reaction_name	template_id	example	reaction_template	reactant_categories
imidazole_Xketone_synthesis	1	CCCC(=O)CF.N=C(N)CCCCCC(=O)CF>>CCCn1ccnc1CCCCCC(=O)CF	[C;$(C(C)(=O)C[F]);!R:1][*;!$(C[F]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAliphaticFluoride.Amidine
imidazole_Xketone_synthesis	2	CCCC(=O)CCl.N=C(N)CCCCCC(=O)CCl>>CCCn1ccnc1CCCCCC(=O)CCl	[C;$(C(C)(=O)C[Cl]);!R:1][*;!$(C[Cl]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAliphaticChloride.Amidine
imidazole_Xketone_synthesis	3	CCCC(=O)CBr.N=C(N)CCCCCC(=O)CBr>>CCCn1ccnc1CCCCCC(=O)CBr	[C;$(C(C)(=O)C[Br]);!R:1][*;!$(C[Br]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAliphaticBromide.Amidine
imidazole_Xketone_synthesis	4	CCCC(=O)CI.N=C(N)CCCCCC(=O)CI>>CCCn1ccnc1CCCCCC(=O)CI	[C;$(C(C)(=O)C[I]);!R:1][*;!$(C[I]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAliphaticIodide.Amidine
imidazole_Xketone_synthesis	5	CCCC(=O)COS(=O)(=O)C(F)(F)F.N=C(N)CCCCCC(=O)COS(=O)(=O)C(F)(F)F>>CCCn1ccnc1CCCCCC(=O)COS(=O)(=O)C(F)(F)F	[C;$(C(C)(=O)C[*;$(OS(=O)(=O)C(F)(F)F)]);!R:1][*;!$(COS(=O)(=O)C(F)(F)F):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAliphaticTriflate.Amidine
imidazole_Xketone_synthesis	6	Cc1ccccc1C(=O)CF.N=C(N)CCCc1ccccc1C(=O)CF>>Cc1ccccc1n1ccnc1CCCc1ccccc1C(=O)CF	[C;$(C([#6;a])(=O)C[F]);!R:1][*;!$(C[F]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAromaticFluoride.Amidine
imidazole_Xketone_synthesis	7	Cc1ccccc1C(=O)CCl.N=C(N)CCCc1ccccc1C(=O)CCl>>Cc1ccccc1n1ccnc1CCCc1ccccc1C(=O)CCl	[C;$(C([#6;a])(=O)C[Cl]);!R:1][*;!$(C[Cl]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAromaticChloride.Amidine
imidazole_Xketone_synthesis	8	Cc1ccccc1C(=O)CBr.N=C(N)CCCc1ccccc1C(=O)CBr>>Cc1ccccc1n1ccnc1CCCc1ccccc1C(=O)CBr	[C;$(C([#6;a])(=O)C[Br]);!R:1][*;!$(C[Br]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAromaticBromide.Amidine
imidazole_Xketone_synthesis	9	Cc1ccccc1C(=O)CI.N=C(N)CCCc1ccccc1C(=O)CI>>Cc1ccccc1n1ccnc1CCCc1ccccc1C(=O)CI	[C;$(C([#6;a])(=O)C[I]);!R:1][*;!$(C[I]):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAromaticIodide.Amidine
imidazole_Xketone_synthesis	10	Cc1ccccc1C(=O)COS(=O)(=O)C(F)(F)F.N=C(N)CCCc1ccccc1C(=O)COS(=O)(=O)C(F)(F)F>>Cc1ccccc1n1ccnc1CCCc1ccccc1C(=O)COS(=O)(=O)C(F)(F)F	[C;$(C([#6;a])(=O)C[$(OS(=O)(=O)C(F)(F)F)]);!R:1][*;!$(COS(=O)(=O)C(F)(F)F):2].[N;!R;$(N([#6])=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]),$([N;D1]=[C;$(C(~N)~N);!$(C(~N)(~N)~N)]):3]=[#6:4][#7:5]>>[*:2][n:3]1:[c:4]:[n:5]:c:c1	XKetoneAromaticTriflate.Amidine
reductive_amination_ketone	11	Cc1cccc2c1C(=O)c1ccccc1-2.NCCNCCCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(CCN)CCCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	12	Cc1cccc2c1C(=O)c1ccccc1-2.NC=CNCCCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(C=CN)CCCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	13	Cc1cccc2c1C(=O)c1ccccc1-2.NC=CNC=CCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(C=CN)C=CCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	14	Cc1cccc2c1C(=O)c1ccccc1-2.NC1CNCC(CCc2cccc3c2C(=O)c2ccccc2-3)C1>>Cc1cccc2c1C(N1CC(N)CC(CCc3cccc4c3C(=O)c3ccccc34)C1)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	15	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(CCC3CC=CNC3)c21>>Cc1cccc2c1C(N1C=CCC(CCc3cccc4c3C(=O)c3ccccc34)C1)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	16	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(CCC3C=CNC=CC3)c21>>Cc1cccc2c1C(N1C=CCC(CCc3cccc4c3C(=O)c3ccccc34)C=C1)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	17	Cc1cccc2c1C(=O)c1ccccc1-2.NCCNCCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(NCCNCCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	18	Cc1cccc2c1C(=O)c1ccccc1-2.NC=CNCCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(NC=CNCCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	19	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cccc(CCc2cccc3c2C(=O)c2ccccc2-3)c1Nc1ccccc1>>Cc1cccc2c1C(N(c1ccccc1)c1c(N)cccc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	20	Cc1cccc2c1C(=O)c1ccccc1-2.NCCNc1ccccc1CCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(CCN)c1ccccc1CCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	21	Cc1cccc2c1C(=O)c1ccccc1-2.NC=CNc1ccccc1CCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(C=CN)c1ccccc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	22	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(CC3CCc4ccccc4Nc4ccccc4C3)c21>>Cc1cccc2c1C(N1c3ccccc3CCC(Cc3cccc4c3C(=O)c3ccccc34)Cc3ccccc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	23	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(Cc3ccc4c(c3)NCCC4)c21>>Cc1cccc2c1C(N1CCCc3ccc(Cc4cccc5c4C(=O)c4ccccc45)cc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	24	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(Cc3ccc4c(c3)NC=CC4)c21>>Cc1cccc2c1C(N1C=CCc3ccc(Cc4cccc5c4C(=O)c4ccccc45)cc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	25	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cccc(CCc2cccc3c2C(=O)c2ccccc2-3)c1N>>Cc1cccc2c1C(Nc1cccc(CCc3cccc4c3C(=O)c3ccccc34)c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Phe
reductive_amination_ketone	26	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cc2ccc(CCc3cccc4c3C(=O)c3ccccc3-4)cc2cc1N>>Cc1cccc2c1C(Nc1cc3ccc(CCc4cccc5c4C(=O)c4ccccc45)cc3cc1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_PhePhe
reductive_amination_ketone	27	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cncc(CCc2cccc3c2C(=O)c2ccccc2-3)c1Nc1ccccc1>>Cc1cccc2c1C(N(c1ccccc1)c1c(N)cncc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	28	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cncc(CCc2cccc3c2C(=O)c2ccccc2-3)c1Nc1cccnc1>>Cc1cccc2c1C(N(c1cccnc1)c1c(N)cncc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	29	Cc1cccc2c1C(=O)c1ccccc1-2.NCCNc1ccncc1CCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(CCN)c1ccncc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	30	Cc1cccc2c1C(=O)c1ccccc1-2.NC=CNc1ccncc1CCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(N(C=CN)c1ccncc1CCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	31	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(CC3CCc4ccncc4Nc4ccccc4C3)c21>>Cc1cccc2c1C(N1c3cnccc3CCC(Cc3cccc4c3C(=O)c3ccccc34)Cc3ccccc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	32	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(CC3CCc4cnccc4Nc4cnccc4C3)c21>>Cc1cccc2c1C(N1c3ccncc3CCC(Cc3cccc4c3C(=O)c3ccccc34)Cc3ccncc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	33	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(Cc3cnc4c(c3)NCCC4)c21>>Cc1cccc2c1C(N1CCCc3ncc(Cc4cccc5c4C(=O)c4ccccc45)cc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	34	Cc1cccc2c1C(=O)c1ccccc1-2.O=C1c2ccccc2-c2cccc(Cc3cnc4c(c3)NC=CC4)c21>>Cc1cccc2c1C(N1C=CCc3ncc(Cc4cccc5c4C(=O)c4ccccc45)cc31)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	35	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1occ(CCc2cccc3c2C(=O)c2ccccc2-3)c1N>>Cc1cccc2c1C(Nc1occ(CCc3cccc4c3C(=O)c3ccccc34)c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het5
reductive_amination_ketone	36	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1oc2c(CCc3cccc4c3C(=O)c3ccccc3-4)occ2c1N>>Cc1cccc2c1C(Nc1oc3c(CCc4cccc5c4C(=O)c4ccccc45)occ3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	37	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1oc2cc(CCc3cccc4c3C(=O)c3ccccc3-4)ncc2c1N>>Cc1cccc2c1C(Nc1oc3cc(CCc4cccc5c4C(=O)c4ccccc45)ncc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	38	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1oc2ccc(CCc3cccc4c3C(=O)c3ccccc3-4)cc2c1N>>Cc1cccc2c1C(Nc1oc3ccc(CCc4cccc5c4C(=O)c4ccccc45)cc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	39	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1nccc(CCc2cccc3c2C(=O)c2ccccc2-3)c1N>>Cc1cccc2c1C(Nc1nccc(CCc3cccc4c3C(=O)c3ccccc34)c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het6
reductive_amination_ketone	40	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1c(Cc2cccc3c2C(=O)c2ccccc2-3)nc2cocc2c1N>>Cc1cccc2c1C(Nc1c(Cc3cccc4c3C(=O)c3ccccc34)nc3cocc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	41	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1ncc2cc(CCc3cccc4c3C(=O)c3ccccc3-4)ncc2c1N>>Cc1cccc2c1C(Nc1ncc3cc(CCc4cccc5c4C(=O)c4ccccc45)ncc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	42	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1ncc2ccc(CCc3cccc4c3C(=O)c3ccccc3-4)cc2c1N>>Cc1cccc2c1C(Nc1ncc3ccc(CCc4cccc5c4C(=O)c4ccccc45)cc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	43	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1c(Cc2cccc3c2C(=O)c2ccccc2-3)cc2cocc2c1N>>Cc1cccc2c1C(Nc1c(Cc3cccc4c3C(=O)c3ccccc34)cc3cocc3c1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_PheHet5
reductive_amination_ketone	44	Cc1cccc2c1C(=O)c1ccccc1-2.Nc1cc2cncc(CCc3cccc4c3C(=O)c3ccccc3-4)c2cc1N>>Cc1cccc2c1C(Nc1cc3cncc(CCc4cccc5c4C(=O)c4ccccc45)c3cc1N)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Amine_Primary_PheHet6
reductive_amination_ketone	45	Cc1cccc2c1C(=O)c1ccccc1-2.NCc1ccccc1CCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(NCc1ccccc1CCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.Benzylamine_primary
reductive_amination_ketone	46	Cc1cccc2c1C(=O)c1ccccc1-2.NCc1cnccc1CCCc1cccc2c1C(=O)c1ccccc1-2>>Cc1cccc2c1C(NCc1cnccc1CCCc1cccc3c1C(=O)c1ccccc13)c1ccccc12	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([*:2])[*:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticCyclic.HeteroBenzylamine_primary
reductive_amination_ketone	47	Cc1ccccc1C(=O)c1ccccc1.NCCNCCCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(CCN)CCCCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	48	Cc1ccccc1C(=O)c1ccccc1.NC=CNCCCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(C=CN)CCCCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	49	Cc1ccccc1C(=O)c1ccccc1.NC=CNC=CCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(C=CN)C=CCCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	50	Cc1ccccc1C(=O)c1ccccc1.NC1CNCC(CCc2ccccc2C(=O)c2ccccc2)C1>>Cc1ccccc1C(c1ccccc1)N1CC(N)CC(CCc2ccccc2C(=O)c2ccccc2)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	51	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(c1ccccc1)N1C=CCC(CCc2ccccc2C(=O)c2ccccc2)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	52	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(c1ccccc1)N1C=CCC(CCc2ccccc2C(=O)c2ccccc2)C=C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	53	Cc1ccccc1C(=O)c1ccccc1.NCCNCCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(NCCNCCCc1ccccc1C(=O)c1ccccc1)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	54	Cc1ccccc1C(=O)c1ccccc1.NC=CNCCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(NC=CNCCCc1ccccc1C(=O)c1ccccc1)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	55	Cc1ccccc1C(=O)c1ccccc1.Nc1cccc(CCc2ccccc2C(=O)c2ccccc2)c1Nc1ccccc1>>Cc1ccccc1C(c1ccccc1)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	56	Cc1ccccc1C(=O)c1ccccc1.NCCNc1ccccc1CCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(CCN)c1ccccc1CCCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	57	Cc1ccccc1C(=O)c1ccccc1.NC=CNc1ccccc1CCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(C=CN)c1ccccc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	58	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(c1ccccc1)N1c2ccccc2CCC(Cc2ccccc2C(=O)c2ccccc2)Cc2ccccc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	59	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(c1ccccc1)N1CCCc2ccc(Cc3ccccc3C(=O)c3ccccc3)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	60	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(c1ccccc1)N1C=CCc2ccc(Cc3ccccc3C(=O)c3ccccc3)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	61	Cc1ccccc1C(=O)c1ccccc1.Nc1cccc(CCc2ccccc2C(=O)c2ccccc2)c1N>>Cc1ccccc1C(Nc1cccc(CCc2ccccc2C(=O)c2ccccc2)c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Phe
reductive_amination_ketone	62	Cc1ccccc1C(=O)c1ccccc1.Nc1cc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2cc1N>>Cc1ccccc1C(Nc1cc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2cc1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_PhePhe
reductive_amination_ketone	63	Cc1ccccc1C(=O)c1ccccc1.Nc1cncc(CCc2ccccc2C(=O)c2ccccc2)c1Nc1ccccc1>>Cc1ccccc1C(c1ccccc1)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	64	Cc1ccccc1C(=O)c1ccccc1.Nc1cncc(CCc2ccccc2C(=O)c2ccccc2)c1Nc1cccnc1>>Cc1ccccc1C(c1ccccc1)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	65	Cc1ccccc1C(=O)c1ccccc1.NCCNc1ccncc1CCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(CCN)c1ccncc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	66	Cc1ccccc1C(=O)c1ccccc1.NC=CNc1ccncc1CCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(c1ccccc1)N(C=CN)c1ccncc1CCc1ccccc1C(=O)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	67	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(c1ccccc1)N1c2cnccc2CCC(Cc2ccccc2C(=O)c2ccccc2)Cc2ccccc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	68	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(c1ccccc1)N1c2ccncc2CCC(Cc2ccccc2C(=O)c2ccccc2)Cc2ccncc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	69	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(c1ccccc1)N1CCCc2ncc(Cc3ccccc3C(=O)c3ccccc3)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	70	Cc1ccccc1C(=O)c1ccccc1.O=C(c1ccccc1)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(c1ccccc1)N1C=CCc2ncc(Cc3ccccc3C(=O)c3ccccc3)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAromaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	71	Cc1ccccc1C(=O)c1ccccc1.Nc1occ(CCc2ccccc2C(=O)c2ccccc2)c1N>>Cc1ccccc1C(Nc1occ(CCc2ccccc2C(=O)c2ccccc2)c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het5
reductive_amination_ketone	72	Cc1ccccc1C(=O)c1ccccc1.Nc1oc2c(CCc3ccccc3C(=O)c3ccccc3)occ2c1N>>Cc1ccccc1C(Nc1oc2c(CCc3ccccc3C(=O)c3ccccc3)occ2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	73	Cc1ccccc1C(=O)c1ccccc1.Nc1oc2cc(CCc3ccccc3C(=O)c3ccccc3)ncc2c1N>>Cc1ccccc1C(Nc1oc2cc(CCc3ccccc3C(=O)c3ccccc3)ncc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	74	Cc1ccccc1C(=O)c1ccccc1.Nc1oc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2c1N>>Cc1ccccc1C(Nc1oc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	75	Cc1ccccc1C(=O)c1ccccc1.Nc1nccc(CCc2ccccc2C(=O)c2ccccc2)c1N>>Cc1ccccc1C(Nc1nccc(CCc2ccccc2C(=O)c2ccccc2)c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het6
reductive_amination_ketone	76	Cc1ccccc1C(=O)c1ccccc1.Nc1c(Cc2ccccc2C(=O)c2ccccc2)nc2cocc2c1N>>Cc1ccccc1C(Nc1c(Cc2ccccc2C(=O)c2ccccc2)nc2cocc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	77	Cc1ccccc1C(=O)c1ccccc1.Nc1ncc2cc(CCc3ccccc3C(=O)c3ccccc3)ncc2c1N>>Cc1ccccc1C(Nc1ncc2cc(CCc3ccccc3C(=O)c3ccccc3)ncc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	78	Cc1ccccc1C(=O)c1ccccc1.Nc1ncc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2c1N>>Cc1ccccc1C(Nc1ncc2ccc(CCc3ccccc3C(=O)c3ccccc3)cc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	79	Cc1ccccc1C(=O)c1ccccc1.Nc1c(Cc2ccccc2C(=O)c2ccccc2)cc2cocc2c1N>>Cc1ccccc1C(Nc1c(Cc2ccccc2C(=O)c2ccccc2)cc2cocc2c1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_PheHet5
reductive_amination_ketone	80	Cc1ccccc1C(=O)c1ccccc1.Nc1cc2cncc(CCc3ccccc3C(=O)c3ccccc3)c2cc1N>>Cc1ccccc1C(Nc1cc2cncc(CCc3ccccc3C(=O)c3ccccc3)c2cc1N)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Amine_Primary_PheHet6
reductive_amination_ketone	81	Cc1ccccc1C(=O)c1ccccc1.NCc1ccccc1CCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(NCc1ccccc1CCCc1ccccc1C(=O)c1ccccc1)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.Benzylamine_primary
reductive_amination_ketone	82	Cc1ccccc1C(=O)c1ccccc1.NCc1cnccc1CCCc1ccccc1C(=O)c1ccccc1>>Cc1ccccc1C(NCc1cnccc1CCCc1ccccc1C(=O)c1ccccc1)c1ccccc1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;a])]):1]([a:2])[*:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAromaticAcyclic.HeteroBenzylamine_primary
reductive_amination_ketone	83	CC1CCCC(=O)CCC1.NCCNCCCCC1CCCC(=O)CCC1>>CC1CCCC(N(CCN)CCCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	84	CC1CCCC(=O)CCC1.NC=CNCCCCC1CCCC(=O)CCC1>>CC1CCCC(N(C=CN)CCCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	85	CC1CCCC(=O)CCC1.NC=CNC=CCCC1CCCC(=O)CCC1>>CC1CCCC(N(C=CN)C=CCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	86	CC1CCCC(=O)CCC1.NC1CNCC(CCC2CCCC(=O)CCC2)C1>>CC1CCCC(N2CC(N)CC(CCC3CCCC(=O)CCC3)C2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	87	CC1CCCC(=O)CCC1.O=C1CCCC(CCC2CC=CNC2)CCC1>>CC1CCCC(N2C=CCC(CCC3CCCC(=O)CCC3)C2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	88	CC1CCCC(=O)CCC1.O=C1CCCC(CCC2C=CNC=CC2)CCC1>>CC1CCCC(N2C=CCC(CCC3CCCC(=O)CCC3)C=C2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	89	CC1CCCC(=O)CCC1.NCCNCCCC1CCCC(=O)CCC1>>CC1CCCC(NCCNCCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	90	CC1CCCC(=O)CCC1.NC=CNCCCC1CCCC(=O)CCC1>>CC1CCCC(NC=CNCCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	91	CC1CCCC(=O)CCC1.Nc1cccc(CCC2CCCC(=O)CCC2)c1Nc1ccccc1>>CC1CCCC(N(c2ccccc2)c2c(N)cccc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	92	CC1CCCC(=O)CCC1.NCCNc1ccccc1CCCC1CCCC(=O)CCC1>>CC1CCCC(N(CCN)c2ccccc2CCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	93	CC1CCCC(=O)CCC1.NC=CNc1ccccc1CCC1CCCC(=O)CCC1>>CC1CCCC(N(C=CN)c2ccccc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	94	CC1CCCC(=O)CCC1.O=C1CCCC(CC2CCc3ccccc3Nc3ccccc3C2)CCC1>>CC1CCCC(N2c3ccccc3CCC(CC3CCCC(=O)CCC3)Cc3ccccc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	95	CC1CCCC(=O)CCC1.O=C1CCCC(Cc2ccc3c(c2)NCCC3)CCC1>>CC1CCCC(N2CCCc3ccc(CC4CCCC(=O)CCC4)cc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	96	CC1CCCC(=O)CCC1.O=C1CCCC(Cc2ccc3c(c2)NC=CC3)CCC1>>CC1CCCC(N2C=CCc3ccc(CC4CCCC(=O)CCC4)cc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	97	CC1CCCC(=O)CCC1.Nc1cccc(CCC2CCCC(=O)CCC2)c1N>>CC1CCCC(Nc2cccc(CCC3CCCC(=O)CCC3)c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Phe
reductive_amination_ketone	98	CC1CCCC(=O)CCC1.Nc1cc2ccc(CCC3CCCC(=O)CCC3)cc2cc1N>>CC1CCCC(Nc2cc3ccc(CCC4CCCC(=O)CCC4)cc3cc2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_PhePhe
reductive_amination_ketone	99	CC1CCCC(=O)CCC1.Nc1cncc(CCC2CCCC(=O)CCC2)c1Nc1ccccc1>>CC1CCCC(N(c2ccccc2)c2c(N)cncc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	100	CC1CCCC(=O)CCC1.Nc1cncc(CCC2CCCC(=O)CCC2)c1Nc1cccnc1>>CC1CCCC(N(c2cccnc2)c2c(N)cncc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	101	CC1CCCC(=O)CCC1.NCCNc1ccncc1CCC1CCCC(=O)CCC1>>CC1CCCC(N(CCN)c2ccncc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	102	CC1CCCC(=O)CCC1.NC=CNc1ccncc1CCC1CCCC(=O)CCC1>>CC1CCCC(N(C=CN)c2ccncc2CCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	103	CC1CCCC(=O)CCC1.O=C1CCCC(CC2CCc3ccncc3Nc3ccccc3C2)CCC1>>CC1CCCC(N2c3cnccc3CCC(CC3CCCC(=O)CCC3)Cc3ccccc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	104	CC1CCCC(=O)CCC1.O=C1CCCC(CC2CCc3cnccc3Nc3cnccc3C2)CCC1>>CC1CCCC(N2c3ccncc3CCC(CC3CCCC(=O)CCC3)Cc3ccncc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	105	CC1CCCC(=O)CCC1.O=C1CCCC(Cc2cnc3c(c2)NCCC3)CCC1>>CC1CCCC(N2CCCc3ncc(CC4CCCC(=O)CCC4)cc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	106	CC1CCCC(=O)CCC1.O=C1CCCC(Cc2cnc3c(c2)NC=CC3)CCC1>>CC1CCCC(N2C=CCc3ncc(CC4CCCC(=O)CCC4)cc32)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	107	CC1CCCC(=O)CCC1.Nc1occ(CCC2CCCC(=O)CCC2)c1N>>CC1CCCC(Nc2occ(CCC3CCCC(=O)CCC3)c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het5
reductive_amination_ketone	108	CC1CCCC(=O)CCC1.Nc1oc2c(CCC3CCCC(=O)CCC3)occ2c1N>>CC1CCCC(Nc2oc3c(CCC4CCCC(=O)CCC4)occ3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	109	CC1CCCC(=O)CCC1.Nc1oc2cc(CCC3CCCC(=O)CCC3)ncc2c1N>>CC1CCCC(Nc2oc3cc(CCC4CCCC(=O)CCC4)ncc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	110	CC1CCCC(=O)CCC1.Nc1oc2ccc(CCC3CCCC(=O)CCC3)cc2c1N>>CC1CCCC(Nc2oc3ccc(CCC4CCCC(=O)CCC4)cc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	111	CC1CCCC(=O)CCC1.Nc1nccc(CCC2CCCC(=O)CCC2)c1N>>CC1CCCC(Nc2nccc(CCC3CCCC(=O)CCC3)c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het6
reductive_amination_ketone	112	CC1CCCC(=O)CCC1.Nc1c(CC2CCCC(=O)CCC2)nc2cocc2c1N>>CC1CCCC(Nc2c(CC3CCCC(=O)CCC3)nc3cocc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	113	CC1CCCC(=O)CCC1.Nc1ncc2cc(CCC3CCCC(=O)CCC3)ncc2c1N>>CC1CCCC(Nc2ncc3cc(CCC4CCCC(=O)CCC4)ncc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	114	CC1CCCC(=O)CCC1.Nc1ncc2ccc(CCC3CCCC(=O)CCC3)cc2c1N>>CC1CCCC(Nc2ncc3ccc(CCC4CCCC(=O)CCC4)cc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	115	CC1CCCC(=O)CCC1.Nc1c(CC2CCCC(=O)CCC2)cc2cocc2c1N>>CC1CCCC(Nc2c(CC3CCCC(=O)CCC3)cc3cocc3c2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_PheHet5
reductive_amination_ketone	116	CC1CCCC(=O)CCC1.Nc1cc2cncc(CCC3CCCC(=O)CCC3)c2cc1N>>CC1CCCC(Nc2cc3cncc(CCC4CCCC(=O)CCC4)c3cc2N)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Amine_Primary_PheHet6
reductive_amination_ketone	117	CC1CCCC(=O)CCC1.NCc1ccccc1CCCC1CCCC(=O)CCC1>>CC1CCCC(NCc2ccccc2CCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.Benzylamine_primary
reductive_amination_ketone	118	CC1CCCC(=O)CCC1.NCc1cnccc1CCCC1CCCC(=O)CCC1>>CC1CCCC(NCc2cnccc2CCCC2CCCC(=O)CCC2)CCC1	[#6;R;$([#6;D3;$([#6](=O)([#6;A])[#6;A])]):1]([A:2])[A:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticCyclic.HeteroBenzylamine_primary
reductive_amination_ketone	119	CCCCCCC(C)=O.CC(=O)CCCCCCCCCNCCN>>CCCCCCC(C)N(CCN)CCCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	120	CCCCCCC(C)=O.CC(=O)CCCCCCCCCNC=CN>>CCCCCCC(C)N(C=CN)CCCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	121	CCCCCCC(C)=O.CC(=O)CCCCCCCC=CNC=CN>>CCCCCCC(C)N(C=CN)C=CCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	122	CCCCCCC(C)=O.CC(=O)CCCCCCCC1CNCC(N)C1>>CCCCCCC(C)N1CC(N)CC(CCCCCCCC(C)=O)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	123	CCCCCCC(C)=O.CC(=O)CCCCCCCC1CC=CNC1>>CCCCCCC(C)N1C=CCC(CCCCCCCC(C)=O)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	124	CCCCCCC(C)=O.CC(=O)CCCCCCCC1C=CNC=CC1>>CCCCCCC(C)N1C=CCC(CCCCCCCC(C)=O)C=C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	125	CCCCCCC(C)=O.CC(=O)CCCCCCCCNCCN>>CCCCCCC(C)NCCNCCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	126	CCCCCCC(C)=O.CC(=O)CCCCCCCCNC=CN>>CCCCCCC(C)NC=CNCCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	127	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cccc(N)c1Nc1ccccc1>>CCCCCCC(C)N(c1ccccc1)c1c(N)cccc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	128	CCCCCCC(C)=O.CC(=O)CCCCCCCCc1ccccc1NCCN>>CCCCCCC(C)N(CCN)c1ccccc1CCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	129	CCCCCCC(C)=O.CC(=O)CCCCCCCc1ccccc1NC=CN>>CCCCCCC(C)N(C=CN)c1ccccc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	130	CCCCCCC(C)=O.CC(=O)CCCCCCC1CCc2ccccc2Nc2ccccc2C1>>CCCCCCC(C)N1c2ccccc2CCC(CCCCCCC(C)=O)Cc2ccccc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	131	CCCCCCC(C)=O.CC(=O)CCCCCCc1ccc2c(c1)NCCC2>>CCCCCCC(C)N1CCCc2ccc(CCCCCCC(C)=O)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	132	CCCCCCC(C)=O.CC(=O)CCCCCCc1ccc2c(c1)NC=CC2>>CCCCCCC(C)N1C=CCc2ccc(CCCCCCC(C)=O)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	133	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cccc(N)c1N>>CCCCCCC(C)Nc1cccc(CCCCCCCC(C)=O)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Phe
reductive_amination_ketone	134	CCCCCCC(C)=O.CC(=O)CCCCCCCc1ccc2cc(N)c(N)cc2c1>>CCCCCCC(C)Nc1cc2ccc(CCCCCCCC(C)=O)cc2cc1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_PhePhe
reductive_amination_ketone	135	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cncc(N)c1Nc1ccccc1>>CCCCCCC(C)N(c1ccccc1)c1c(N)cncc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	136	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cncc(N)c1Nc1cccnc1>>CCCCCCC(C)N(c1cccnc1)c1c(N)cncc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	137	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cnccc1NCCN>>CCCCCCC(C)N(CCN)c1ccncc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	138	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cnccc1NC=CN>>CCCCCCC(C)N(C=CN)c1ccncc1CCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	139	CCCCCCC(C)=O.CC(=O)CCCCCCC1CCc2ccncc2Nc2ccccc2C1>>CCCCCCC(C)N1c2cnccc2CCC(CCCCCCC(C)=O)Cc2ccccc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	140	CCCCCCC(C)=O.CC(=O)CCCCCCC1CCc2cnccc2Nc2cnccc2C1>>CCCCCCC(C)N1c2ccncc2CCC(CCCCCCC(C)=O)Cc2ccncc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	141	CCCCCCC(C)=O.CC(=O)CCCCCCc1cnc2c(c1)NCCC2>>CCCCCCC(C)N1CCCc2ncc(CCCCCCC(C)=O)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	142	CCCCCCC(C)=O.CC(=O)CCCCCCc1cnc2c(c1)NC=CC2>>CCCCCCC(C)N1C=CCc2ncc(CCCCCCC(C)=O)cc21	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneAliphaticAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	143	CCCCCCC(C)=O.CC(=O)CCCCCCCc1coc(N)c1N>>CCCCCCC(C)Nc1occ(CCCCCCCC(C)=O)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het5
reductive_amination_ketone	144	CCCCCCC(C)=O.CC(=O)CCCCCCCc1occ2c(N)c(N)oc12>>CCCCCCC(C)Nc1c(N)oc2c(CCCCCCCC(C)=O)occ12	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	145	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cc2oc(N)c(N)c2cn1>>CCCCCCC(C)Nc1oc2cc(CCCCCCCC(C)=O)ncc2c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	146	CCCCCCC(C)=O.CC(=O)CCCCCCCc1ccc2oc(N)c(N)c2c1>>CCCCCCC(C)Nc1oc2ccc(CCCCCCCC(C)=O)cc2c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	147	CCCCCCC(C)=O.CC(=O)CCCCCCCc1ccnc(N)c1N>>CCCCCCC(C)Nc1nccc(CCCCCCCC(C)=O)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het6
reductive_amination_ketone	148	CCCCCCC(C)=O.CC(=O)CCCCCCc1nc2cocc2c(N)c1N>>CCCCCCC(C)Nc1c(N)c(CCCCCCC(C)=O)nc2cocc12	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	149	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cc2cnc(N)c(N)c2cn1>>CCCCCCC(C)Nc1ncc2cc(CCCCCCCC(C)=O)ncc2c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	150	CCCCCCC(C)=O.CC(=O)CCCCCCCc1ccc2cnc(N)c(N)c2c1>>CCCCCCC(C)Nc1ncc2ccc(CCCCCCCC(C)=O)cc2c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	151	CCCCCCC(C)=O.CC(=O)CCCCCCc1cc2cocc2c(N)c1N>>CCCCCCC(C)Nc1c(N)c(CCCCCCC(C)=O)cc2cocc12	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_PheHet5
reductive_amination_ketone	152	CCCCCCC(C)=O.CC(=O)CCCCCCCc1cncc2cc(N)c(N)cc12>>CCCCCCC(C)Nc1cc2cncc(CCCCCCCC(C)=O)c2cc1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Amine_Primary_PheHet6
reductive_amination_ketone	153	CCCCCCC(C)=O.CC(=O)CCCCCCCCc1ccccc1CN>>CCCCCCC(C)NCc1ccccc1CCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.Benzylamine_primary
reductive_amination_ketone	154	CCCCCCC(C)=O.CC(=O)CCCCCCCCc1ccncc1CN>>CCCCCCC(C)NCc1cnccc1CCCCCCCCC(C)=O	[#6;!R;$([#6;D3;$([#6](=O)([#6;A;!$(*=*)])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[A:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneAliphaticAcyclic.HeteroBenzylamine_primary
reductive_amination_ketone	155	Cc1cccc2c1C(=O)CC2.NCCNCCCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(CCN)CCCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	156	Cc1cccc2c1C(=O)CC2.NC=CNCCCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(C=CN)CCCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	157	Cc1cccc2c1C(=O)CC2.NC=CNC=CCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(C=CN)C=CCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	158	Cc1cccc2c1C(=O)CC2.NC1CNCC(CCc2cccc3c2C(=O)CC3)C1>>Cc1cccc2c1C(N1CC(N)CC(CCc3cccc4c3C(=O)CC4)C1)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	159	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(CCC3CC=CNC3)c21>>Cc1cccc2c1C(N1C=CCC(CCc3cccc4c3C(=O)CC4)C1)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	160	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(CCC3C=CNC=CC3)c21>>Cc1cccc2c1C(N1C=CCC(CCc3cccc4c3C(=O)CC4)C=C1)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	161	Cc1cccc2c1C(=O)CC2.NCCNCCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(NCCNCCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	162	Cc1cccc2c1C(=O)CC2.NC=CNCCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(NC=CNCCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	163	Cc1cccc2c1C(=O)CC2.Nc1cccc(CCc2cccc3c2C(=O)CC3)c1Nc1ccccc1>>Cc1cccc2c1C(N(c1ccccc1)c1c(N)cccc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	164	Cc1cccc2c1C(=O)CC2.NCCNc1ccccc1CCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(CCN)c1ccccc1CCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	165	Cc1cccc2c1C(=O)CC2.NC=CNc1ccccc1CCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(C=CN)c1ccccc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	166	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(CC3CCc4ccccc4Nc4ccccc4C3)c21>>Cc1cccc2c1C(N1c3ccccc3CCC(Cc3cccc4c3C(=O)CC4)Cc3ccccc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	167	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(Cc3ccc4c(c3)NCCC4)c21>>Cc1cccc2c1C(N1CCCc3ccc(Cc4cccc5c4C(=O)CC5)cc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	168	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(Cc3ccc4c(c3)NC=CC4)c21>>Cc1cccc2c1C(N1C=CCc3ccc(Cc4cccc5c4C(=O)CC5)cc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	169	Cc1cccc2c1C(=O)CC2.Nc1cccc(CCc2cccc3c2C(=O)CC3)c1N>>Cc1cccc2c1C(Nc1cccc(CCc3cccc4c3C(=O)CC4)c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Phe
reductive_amination_ketone	170	Cc1cccc2c1C(=O)CC2.Nc1cc2ccc(CCc3cccc4c3C(=O)CC4)cc2cc1N>>Cc1cccc2c1C(Nc1cc3ccc(CCc4cccc5c4C(=O)CC5)cc3cc1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_PhePhe
reductive_amination_ketone	171	Cc1cccc2c1C(=O)CC2.Nc1cncc(CCc2cccc3c2C(=O)CC3)c1Nc1ccccc1>>Cc1cccc2c1C(N(c1ccccc1)c1c(N)cncc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	172	Cc1cccc2c1C(=O)CC2.Nc1cncc(CCc2cccc3c2C(=O)CC3)c1Nc1cccnc1>>Cc1cccc2c1C(N(c1cccnc1)c1c(N)cncc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	173	Cc1cccc2c1C(=O)CC2.NCCNc1ccncc1CCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(CCN)c1ccncc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	174	Cc1cccc2c1C(=O)CC2.NC=CNc1ccncc1CCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(N(C=CN)c1ccncc1CCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	175	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(CC3CCc4ccncc4Nc4ccccc4C3)c21>>Cc1cccc2c1C(N1c3cnccc3CCC(Cc3cccc4c3C(=O)CC4)Cc3ccccc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	176	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(CC3CCc4cnccc4Nc4cnccc4C3)c21>>Cc1cccc2c1C(N1c3ccncc3CCC(Cc3cccc4c3C(=O)CC4)Cc3ccncc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	177	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(Cc3cnc4c(c3)NCCC4)c21>>Cc1cccc2c1C(N1CCCc3ncc(Cc4cccc5c4C(=O)CC5)cc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	178	Cc1cccc2c1C(=O)CC2.O=C1CCc2cccc(Cc3cnc4c(c3)NC=CC4)c21>>Cc1cccc2c1C(N1C=CCc3ncc(Cc4cccc5c4C(=O)CC5)cc31)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixCyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	179	Cc1cccc2c1C(=O)CC2.Nc1occ(CCc2cccc3c2C(=O)CC3)c1N>>Cc1cccc2c1C(Nc1occ(CCc3cccc4c3C(=O)CC4)c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het5
reductive_amination_ketone	180	Cc1cccc2c1C(=O)CC2.Nc1oc2c(CCc3cccc4c3C(=O)CC4)occ2c1N>>Cc1cccc2c1C(Nc1oc3c(CCc4cccc5c4C(=O)CC5)occ3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	181	Cc1cccc2c1C(=O)CC2.Nc1oc2cc(CCc3cccc4c3C(=O)CC4)ncc2c1N>>Cc1cccc2c1C(Nc1oc3cc(CCc4cccc5c4C(=O)CC5)ncc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	182	Cc1cccc2c1C(=O)CC2.Nc1oc2ccc(CCc3cccc4c3C(=O)CC4)cc2c1N>>Cc1cccc2c1C(Nc1oc3ccc(CCc4cccc5c4C(=O)CC5)cc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	183	Cc1cccc2c1C(=O)CC2.Nc1nccc(CCc2cccc3c2C(=O)CC3)c1N>>Cc1cccc2c1C(Nc1nccc(CCc3cccc4c3C(=O)CC4)c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het6
reductive_amination_ketone	184	Cc1cccc2c1C(=O)CC2.Nc1c(Cc2cccc3c2C(=O)CC3)nc2cocc2c1N>>Cc1cccc2c1C(Nc1c(Cc3cccc4c3C(=O)CC4)nc3cocc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	185	Cc1cccc2c1C(=O)CC2.Nc1ncc2cc(CCc3cccc4c3C(=O)CC4)ncc2c1N>>Cc1cccc2c1C(Nc1ncc3cc(CCc4cccc5c4C(=O)CC5)ncc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	186	Cc1cccc2c1C(=O)CC2.Nc1ncc2ccc(CCc3cccc4c3C(=O)CC4)cc2c1N>>Cc1cccc2c1C(Nc1ncc3ccc(CCc4cccc5c4C(=O)CC5)cc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	187	Cc1cccc2c1C(=O)CC2.Nc1c(Cc2cccc3c2C(=O)CC3)cc2cocc2c1N>>Cc1cccc2c1C(Nc1c(Cc3cccc4c3C(=O)CC4)cc3cocc3c1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_PheHet5
reductive_amination_ketone	188	Cc1cccc2c1C(=O)CC2.Nc1cc2cncc(CCc3cccc4c3C(=O)CC4)c2cc1N>>Cc1cccc2c1C(Nc1cc3cncc(CCc4cccc5c4C(=O)CC5)c3cc1N)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Amine_Primary_PheHet6
reductive_amination_ketone	189	Cc1cccc2c1C(=O)CC2.NCc1ccccc1CCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(NCc1ccccc1CCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.Benzylamine_primary
reductive_amination_ketone	190	Cc1cccc2c1C(=O)CC2.NCc1cnccc1CCCc1cccc2c1C(=O)CC2>>Cc1cccc2c1C(NCc1cnccc1CCCc1cccc3c1C(=O)CC3)CC2	[#6;R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]):1]([A:2])[a:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixCyclic.HeteroBenzylamine_primary
reductive_amination_ketone	191	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCCNCCN>>CCC(=O)c1ccccc1CCCCN(CCN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	192	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCCNC=CN>>CCC(=O)c1ccccc1CCCCN(C=CN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	193	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCC=CNC=CN>>CCC(=O)c1ccccc1CCC=CN(C=CN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	194	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCC1CNCC(N)C1>>CCC(=O)c1ccccc1CCC1CC(N)CN(C(CC)c2ccccc2C)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	195	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCC1CC=CNC1>>CCC(=O)c1ccccc1CCC1CC=CN(C(CC)c2ccccc2C)C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	196	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCC1C=CNC=CC1>>CCC(=O)c1ccccc1CCC1C=CN(C(CC)c2ccccc2C)C=CC1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	197	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCNCCN>>CCC(=O)c1ccccc1CCCNCCNC(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	198	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCNC=CN>>CCC(=O)c1ccccc1CCCNC=CNC(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	199	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cccc(N)c1Nc1ccccc1>>CCC(=O)c1ccccc1CCc1cccc(N)c1N(c1ccccc1)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	200	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCc1ccccc1NCCN>>CCC(=O)c1ccccc1CCCc1ccccc1N(CCN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	201	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1ccccc1NC=CN>>CCC(=O)c1ccccc1CCc1ccccc1N(C=CN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	202	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>CCC(=O)c1ccccc1CC1CCc2ccccc2N(C(CC)c2ccccc2C)c2ccccc2C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	203	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1ccc2c(c1)NCCC2>>CCC(=O)c1ccccc1Cc1ccc2c(c1)N(C(CC)c1ccccc1C)CCC2	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	204	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1ccc2c(c1)NC=CC2>>CCC(=O)c1ccccc1Cc1ccc2c(c1)N(C(CC)c1ccccc1C)C=CC2	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	205	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cccc(N)c1N>>CCC(=O)c1ccccc1CCc1cccc(NC(CC)c2ccccc2C)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Phe
reductive_amination_ketone	206	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1ccc2cc(N)c(N)cc2c1>>CCC(=O)c1ccccc1CCc1ccc2cc(NC(CC)c3ccccc3C)c(N)cc2c1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_PhePhe
reductive_amination_ketone	207	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cncc(N)c1Nc1ccccc1>>CCC(=O)c1ccccc1CCc1cncc(N)c1N(c1ccccc1)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	208	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cncc(N)c1Nc1cccnc1>>CCC(=O)c1ccccc1CCc1cncc(N)c1N(c1cccnc1)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	209	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cnccc1NCCN>>CCC(=O)c1ccccc1CCc1cnccc1N(CCN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	210	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cnccc1NC=CN>>CCC(=O)c1ccccc1CCc1cnccc1N(C=CN)C(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	211	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>CCC(=O)c1ccccc1CC1CCc2ccncc2N(C(CC)c2ccccc2C)c2ccccc2C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	212	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>CCC(=O)c1ccccc1CC1CCc2cnccc2N(C(CC)c2ccccc2C)c2cnccc2C1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	213	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1cnc2c(c1)NCCC2>>CCC(=O)c1ccccc1Cc1cnc2c(c1)N(C(CC)c1ccccc1C)CCC2	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	214	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1cnc2c(c1)NC=CC2>>CCC(=O)c1ccccc1Cc1cnc2c(c1)N(C(CC)c1ccccc1C)C=CC2	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	KetoneMixAcyclic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	215	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1coc(N)c1N>>CCC(=O)c1ccccc1CCc1coc(NC(CC)c2ccccc2C)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het5
reductive_amination_ketone	216	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1occ2c(N)c(N)oc12>>CCC(=O)c1ccccc1CCc1occ2c(NC(CC)c3ccccc3C)c(N)oc12	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het5Het5
reductive_amination_ketone	217	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cc2oc(N)c(N)c2cn1>>CCC(=O)c1ccccc1CCc1cc2oc(NC(CC)c3ccccc3C)c(N)c2cn1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het5Het6
reductive_amination_ketone	218	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1ccc2oc(N)c(N)c2c1>>CCC(=O)c1ccccc1CCc1ccc2oc(NC(CC)c3ccccc3C)c(N)c2c1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het5Phe
reductive_amination_ketone	219	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1ccnc(N)c1N>>CCC(=O)c1ccccc1CCc1ccnc(NC(CC)c2ccccc2C)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het6
reductive_amination_ketone	220	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1nc2cocc2c(N)c1N>>CCC(=O)c1ccccc1Cc1nc2cocc2c(NC(CC)c2ccccc2C)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het6Het5
reductive_amination_ketone	221	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cc2cnc(N)c(N)c2cn1>>CCC(=O)c1ccccc1CCc1cc2cnc(NC(CC)c3ccccc3C)c(N)c2cn1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het6Het6
reductive_amination_ketone	222	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1ccc2cnc(N)c(N)c2c1>>CCC(=O)c1ccccc1CCc1ccc2cnc(NC(CC)c3ccccc3C)c(N)c2c1	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_Het6Phe
reductive_amination_ketone	223	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1Cc1cc2cocc2c(N)c1N>>CCC(=O)c1ccccc1Cc1cc2cocc2c(NC(CC)c2ccccc2C)c1N	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_PheHet5
reductive_amination_ketone	224	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCc1cncc2cc(N)c(N)cc12>>CCC(=O)c1ccccc1CCc1cncc2cc(NC(CC)c3ccccc3C)c(N)cc12	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Amine_Primary_PheHet6
reductive_amination_ketone	225	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCc1ccccc1CN>>CCC(=O)c1ccccc1CCCc1ccccc1CNC(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.Benzylamine_primary
reductive_amination_ketone	226	CCC(=O)c1ccccc1C.CCC(=O)c1ccccc1CCCc1ccncc1CN>>CCC(=O)c1ccccc1CCCc1ccncc1CNC(CC)c1ccccc1C	[#6;!R;$([#6;D3;$([#6](=O)([#6;a])[#6;A;!$(*=*)])]);!$([#6](=O)[C;D2][F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):1]([A:2])[a:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	KetoneMixAcyclic.HeteroBenzylamine_primary
reductive_amination_ketone	227	CCC(C)=S.CC(=S)CCCCCNCCN>>CCC(C)N(CCN)CCCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	228	CCC(C)=S.CC(=S)CCCCCNC=CN>>CCC(C)N(C=CN)CCCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	229	CCC(C)=S.CC(=S)CCCC=CNC=CN>>CCC(C)N(C=CN)C=CCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	230	CCC(C)=S.CC(=S)CCCC1CNCC(N)C1>>CCC(C)N1CC(N)CC(CCCC(C)=S)C1	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_ketone	231	CCC(C)=S.CC(=S)CCCC1CC=CNC1>>CCC(C)N1C=CCC(CCCC(C)=S)C1	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	232	CCC(C)=S.CC(=S)CCCC1C=CNC=CC1>>CCC(C)N1C=CCC(CCCC(C)=S)C=C1	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_ketone	233	CCC(C)=S.CC(=S)CCCCNCCN>>CCC(C)NCCNCCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_SaturatedAliphatic
reductive_amination_ketone	234	CCC(C)=S.CC(=S)CCCCNC=CN>>CCC(C)NC=CNCCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_UnsaturatedAliphatic
reductive_amination_ketone	235	CCC(C)=S.CC(=S)CCCc1cccc(N)c1Nc1ccccc1>>CCC(C)N(c1ccccc1)c1c(N)cccc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	236	CCC(C)=S.CC(=S)CCCCc1ccccc1NCCN>>CCC(C)N(CCN)c1ccccc1CCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	237	CCC(C)=S.CC(=S)CCCc1ccccc1NC=CN>>CCC(C)N(C=CN)c1ccccc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	238	CCC(C)=S.CC(=S)CCC1CCc2ccccc2Nc2ccccc2C1>>CCC(C)N1c2ccccc2CCC(CCC(C)=S)Cc2ccccc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_ketone	239	CCC(C)=S.CC(=S)CCc1ccc2c(c1)NCCC2>>CCC(C)N1CCCc2ccc(CCC(C)=S)cc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_ketone	240	CCC(C)=S.CC(=S)CCc1ccc2c(c1)NC=CC2>>CCC(C)N1C=CCc2ccc(CCC(C)=S)cc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_ketone	241	CCC(C)=S.CC(=S)CCCc1cccc(N)c1N>>CCC(C)Nc1cccc(CCCC(C)=S)c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Phe
reductive_amination_ketone	242	CCC(C)=S.CC(=S)CCCc1ccc2cc(N)c(N)cc2c1>>CCC(C)Nc1cc2ccc(CCCC(C)=S)cc2cc1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_PhePhe
reductive_amination_ketone	243	CCC(C)=S.CC(=S)CCCc1cncc(N)c1Nc1ccccc1>>CCC(C)N(c1ccccc1)c1c(N)cncc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	244	CCC(C)=S.CC(=S)CCCc1cncc(N)c1Nc1cccnc1>>CCC(C)N(c1cccnc1)c1c(N)cncc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	245	CCC(C)=S.CC(=S)CCCc1cnccc1NCCN>>CCC(C)N(CCN)c1ccncc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	246	CCC(C)=S.CC(=S)CCCc1cnccc1NC=CN>>CCC(C)N(C=CN)c1ccncc1CCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	247	CCC(C)=S.CC(=S)CCC1CCc2ccncc2Nc2ccccc2C1>>CCC(C)N1c2cnccc2CCC(CCC(C)=S)Cc2ccccc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_ketone	248	CCC(C)=S.CC(=S)CCC1CCc2cnccc2Nc2cnccc2C1>>CCC(C)N1c2ccncc2CCC(CCC(C)=S)Cc2ccncc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_ketone	249	CCC(C)=S.CC(=S)CCc1cnc2c(c1)NCCC2>>CCC(C)N1CCCc2ncc(CCC(C)=S)cc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	250	CCC(C)=S.CC(=S)CCc1cnc2c(c1)NC=CC2>>CCC(C)N1C=CCc2ncc(CCC(C)=S)cc21	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):4]([#6:5])[#6:6]>>C([*:2])([*:3])[N:4]([#6:5])[#6:6]	Thioketone.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_ketone	251	CCC(C)=S.CC(=S)CCCc1coc(N)c1N>>CCC(C)Nc1occ(CCCC(C)=S)c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het5
reductive_amination_ketone	252	CCC(C)=S.CC(=S)CCCc1occ2c(N)c(N)oc12>>CCC(C)Nc1c(N)oc2c(CCCC(C)=S)occ12	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het5Het5
reductive_amination_ketone	253	CCC(C)=S.CC(=S)CCCc1cc2oc(N)c(N)c2cn1>>CCC(C)Nc1oc2cc(CCCC(C)=S)ncc2c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het5Het6
reductive_amination_ketone	254	CCC(C)=S.CC(=S)CCCc1ccc2oc(N)c(N)c2c1>>CCC(C)Nc1oc2ccc(CCCC(C)=S)cc2c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het5Phe
reductive_amination_ketone	255	CCC(C)=S.CC(=S)CCCc1ccnc(N)c1N>>CCC(C)Nc1nccc(CCCC(C)=S)c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het6
reductive_amination_ketone	256	CCC(C)=S.CC(=S)CCc1nc2cocc2c(N)c1N>>CCC(C)Nc1c(N)c(CCC(C)=S)nc2cocc12	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het6Het5
reductive_amination_ketone	257	CCC(C)=S.CC(=S)CCCc1cc2cnc(N)c(N)c2cn1>>CCC(C)Nc1ncc2cc(CCCC(C)=S)ncc2c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het6Het6
reductive_amination_ketone	258	CCC(C)=S.CC(=S)CCCc1ccc2cnc(N)c(N)c2c1>>CCC(C)Nc1ncc2ccc(CCCC(C)=S)cc2c1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_Het6Phe
reductive_amination_ketone	259	CCC(C)=S.CC(=S)CCc1cc2cocc2c(N)c1N>>CCC(C)Nc1c(N)c(CCC(C)=S)cc2cocc12	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_PheHet5
reductive_amination_ketone	260	CCC(C)=S.CC(=S)CCCc1cncc2cc(N)c(N)cc12>>CCC(C)Nc1cc2cncc(CCCC(C)=S)c2cc1N	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Amine_Primary_PheHet6
reductive_amination_ketone	261	CCC(C)=S.CC(=S)CCCCc1ccccc1CN>>CCC(C)NCc1ccccc1CCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.Benzylamine_primary
reductive_amination_ketone	262	CCC(C)=S.CC(=S)CCCCc1ccncc1CN>>CCC(C)NCc1cnccc1CCCCC(C)=S	[#6;$([#6;D3;$([#6](=S)([#6;!$(*=*)])[#6;!$(*=*)])]):1]([*:2])[*:3].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):4][#6:5]>>C([*:2])([*:3])[N:4][#6:5]	Thioketone.HeteroBenzylamine_primary
imidazole_condensation_amine	263	CCC=O.NCCNCCCCCC=O>>CCC1=NC=CN1CCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_amine	264	CCC=O.NC=CNCCCCCC=O>>CCC1=NC=CN1CCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	265	CCC=O.NC=CNC=CCCCC=O>>CCC1=NC=CN1C=CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	266	CCC=O.NCCNCCCCC=O>>CCC1=Nc=CN1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_amine	267	CCC=O.NC=CNCCCCC=O>>CCC1=Nc=CN1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_amine	268	CCC=O.Nc1cccc(CCCC=O)c1Nc1ccccc1>>CCC1=Nc2cccc(CCCC=O)c=2N1c1ccccc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_amine	269	CCC=O.NCCNc1ccccc1CCCCC=O>>CCC1=NC=CN1c1ccccc1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_amine	270	CCC=O.NC=CNc1ccccc1CCCC=O>>CCC1=NC=CN1c1ccccc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_amine	271	CCC=O.Nc1cccc(CCCC=O)c1N>>CCC1=Nc2cccc(CCCC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_SaturatedAliphatic.Amine_Primary_Phe
imidazole_condensation_amine	272	CCC=O.Nc1cncc(CCCC=O)c1Nc1ccccc1>>CCC1=Nc2cncc(CCCC=O)c=2N1c1ccccc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_amine	273	CCC=O.Nc1cncc(CCCC=O)c1Nc1cccnc1>>CCC1=Nc2cncc(CCCC=O)c=2N1c1cccnc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_amine	274	CCC=O.NCCNc1ccncc1CCCC=O>>CCC1=NC=CN1c1ccncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	275	CCC=O.NC=CNc1ccncc1CCCC=O>>CCC1=NC=CN1c1ccncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	276	CCC=O.Nc1occ(CCCC=O)c1N>>CCC1=Nc2occ(CCCC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_SaturatedAliphatic.Amine_Primary_Het5
imidazole_condensation_amine	277	CCC=O.Nc1nccc(CCCC=O)c1N>>CCC1=Nc2nccc(CCCC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_SaturatedAliphatic.Amine_Primary_Het6
imidazole_condensation_amine	278	CCC=CC=O.NCCNCCCCCC=CC=O>>CCC=CC1=NC=CN1CCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_amine	279	CCC=CC=O.NC=CNCCCCCC=CC=O>>CCC=CC1=NC=CN1CCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	280	CCC=CC=O.NC=CNC=CCCCC=CC=O>>CCC=CC1=NC=CN1C=CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	281	CCC=CC=O.NCCNCCCCC=CC=O>>CCC=CC1=Nc=CN1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_amine	282	CCC=CC=O.NC=CNCCCCC=CC=O>>CCC=CC1=Nc=CN1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_amine	283	CCC=CC=O.Nc1cccc(CCCC=CC=O)c1Nc1ccccc1>>CCC=CC1=Nc2cccc(CCCC=CC=O)c=2N1c1ccccc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_amine	284	CCC=CC=O.NCCNc1ccccc1CCCCC=CC=O>>CCC=CC1=NC=CN1c1ccccc1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_amine	285	CCC=CC=O.NC=CNc1ccccc1CCCC=CC=O>>CCC=CC1=NC=CN1c1ccccc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_amine	286	CCC=CC=O.Nc1cccc(CCCC=CC=O)c1N>>CCC=CC1=Nc2cccc(CCCC=CC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Phe
imidazole_condensation_amine	287	CCC=CC=O.Nc1cncc(CCCC=CC=O)c1Nc1ccccc1>>CCC=CC1=Nc2cncc(CCCC=CC=O)c=2N1c1ccccc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_amine	288	CCC=CC=O.Nc1cncc(CCCC=CC=O)c1Nc1cccnc1>>CCC=CC1=Nc2cncc(CCCC=CC=O)c=2N1c1cccnc1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_amine	289	CCC=CC=O.NCCNc1ccncc1CCCC=CC=O>>CCC=CC1=NC=CN1c1ccncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	290	CCC=CC=O.NC=CNc1ccncc1CCCC=CC=O>>CCC=CC1=NC=CN1c1ccncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	291	CCC=CC=O.Nc1occ(CCCC=CC=O)c1N>>CCC=CC1=Nc2occ(CCCC=CC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het5
imidazole_condensation_amine	292	CCC=CC=O.Nc1nccc(CCCC=CC=O)c1N>>CCC=CC1=Nc2nccc(CCCC=CC=O)c=2N1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het6
imidazole_condensation_amine	293	Cc1ccccc1C=O.NCCNCCCCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1CCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_amine	294	Cc1ccccc1C=O.NC=CNCCCCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1CCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	295	Cc1ccccc1C=O.NC=CNC=CCCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1C=CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	296	Cc1ccccc1C=O.NCCNCCCc1ccccc1C=O>>Cc1ccccc1C1=Nc=CN1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Aromatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_amine	297	Cc1ccccc1C=O.NC=CNCCCc1ccccc1C=O>>Cc1ccccc1C1=Nc=CN1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Aromatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_amine	298	Cc1ccccc1C=O.Nc1cccc(CCc2ccccc2C=O)c1Nc1ccccc1>>Cc1ccccc1C1=Nc2cccc(CCc3ccccc3C=O)c=2N1c1ccccc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_amine	299	Cc1ccccc1C=O.NCCNc1ccccc1CCCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1c1ccccc1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_amine	300	Cc1ccccc1C=O.NC=CNc1ccccc1CCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1c1ccccc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_amine	301	Cc1ccccc1C=O.Nc1cccc(CCc2ccccc2C=O)c1N>>Cc1ccccc1C1=Nc2cccc(CCc3ccccc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Aromatic.Amine_Primary_Phe
imidazole_condensation_amine	302	Cc1ccccc1C=O.Nc1cncc(CCc2ccccc2C=O)c1Nc1ccccc1>>Cc1ccccc1C1=Nc2cncc(CCc3ccccc3C=O)c=2N1c1ccccc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_amine	303	Cc1ccccc1C=O.Nc1cncc(CCc2ccccc2C=O)c1Nc1cccnc1>>Cc1ccccc1C1=Nc2cncc(CCc3ccccc3C=O)c=2N1c1cccnc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_amine	304	Cc1ccccc1C=O.NCCNc1ccncc1CCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1c1ccncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	305	Cc1ccccc1C=O.NC=CNc1ccncc1CCc1ccccc1C=O>>Cc1ccccc1C1=NC=CN1c1ccncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	306	Cc1ccccc1C=O.Nc1occ(CCc2ccccc2C=O)c1N>>Cc1ccccc1C1=Nc2occ(CCc3ccccc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Aromatic.Amine_Primary_Het5
imidazole_condensation_amine	307	Cc1ccccc1C=O.Nc1nccc(CCc2ccccc2C=O)c1N>>Cc1ccccc1C1=Nc2nccc(CCc3ccccc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Aromatic.Amine_Primary_Het6
imidazole_condensation_amine	308	Cc1ccncc1C=O.NCCNCCCCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1CCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_amine	309	Cc1ccncc1C=O.NC=CNCCCCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1CCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	310	Cc1ccncc1C=O.NC=CNC=CCCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1C=CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_amine	311	Cc1ccncc1C=O.NCCNCCCc1ccncc1C=O>>Cc1ccncc1C1=Nc=CN1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Heteroaromatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_amine	312	Cc1ccncc1C=O.NC=CNCCCc1ccncc1C=O>>Cc1ccncc1C1=Nc=CN1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_amine	313	Cc1ccncc1C=O.Nc1cccc(CCc2ccncc2C=O)c1Nc1ccccc1>>Cc1ccncc1C1=Nc2cccc(CCc3ccncc3C=O)c=2N1c1ccccc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_amine	314	Cc1ccncc1C=O.NCCNc1ccccc1CCCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1c1ccccc1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_amine	315	Cc1ccncc1C=O.NC=CNc1ccccc1CCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1c1ccccc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_amine	316	Cc1ccncc1C=O.Nc1cccc(CCc2ccncc2C=O)c1N>>Cc1ccncc1C1=Nc2cccc(CCc3ccncc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Heteroaromatic.Amine_Primary_Phe
imidazole_condensation_amine	317	Cc1ccncc1C=O.Nc1cncc(CCc2ccncc2C=O)c1Nc1ccccc1>>Cc1ccncc1C1=Nc2cncc(CCc3ccncc3C=O)c=2N1c1ccccc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_amine	318	Cc1ccncc1C=O.Nc1cncc(CCc2ccncc2C=O)c1Nc1cccnc1>>Cc1ccncc1C1=Nc2cncc(CCc3ccncc3C=O)c=2N1c1cccnc1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_amine	319	Cc1ccncc1C=O.NCCNc1ccncc1CCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1c1ccncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	320	Cc1ccncc1C=O.NC=CNc1ccncc1CCc1ccncc1C=O>>Cc1ccncc1C1=NC=CN1c1ccncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_amine	321	Cc1ccncc1C=O.Nc1occ(CCc2ccncc2C=O)c1N>>Cc1ccncc1C1=Nc2occ(CCc3ccncc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Heteroaromatic.Amine_Primary_Het5
imidazole_condensation_amine	322	Cc1ccncc1C=O.Nc1nccc(CCc2ccncc2C=O)c1N>>Cc1ccncc1C1=Nc2nccc(CCc3ccncc3C=O)c=2N1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Aldehyde_Heteroaromatic.Amine_Primary_Het6
chan_lam	323	CCCCNCCN.NCCNCCCCCCB(O)O>>CCCCN(CCN)CCCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	324	CCCCNCCN.NCCNCCCCCC=CB(O)O>>CCCCN(C=CCCCCCNCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	325	CCCCNCCN.NCCNCCCCC1CCCB(O)O1>>CCCCN(CCN)CCCC(O)CCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.BoronicCyclic
chan_lam	326	CCCCNCCN.NCCNCCCCCc1ccccc1B(O)O>>CCCCN(CCN)c1ccccc1CCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_Aromatic
chan_lam	327	CCCCNCCN.NCCNCCCCCc1cnccc1B(O)O>>CCCCN(CCN)c1ccncc1CCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	328	CCCCNCCN.CC1(C)OB(CCCCCCNCCN)OC1(C)C>>CCCCN(CCN)CCCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	329	CCCCNCCN.CC1(C)OB(C=CCCCCCNCCN)OC1(C)C>>CCCCN(C=CCCCCCNCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	330	CCCCNCCN.CC1(C)OB(c2ccccc2CCCCCNCCN)OC1(C)C>>CCCCN(CCN)c1ccccc1CCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_Aromatic
chan_lam	331	CCCCNCCN.CC1(C)OB(c2ccncc2CCCCCNCCN)OC1(C)C>>CCCCN(CCN)c1ccncc1CCCCCNCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	332	CCCCNC=CN.NC=CNCCCCCCB(O)O>>CCCCN(C=CN)CCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	333	CCCCNC=CN.NC=CNCCCCCC=CB(O)O>>CCCCN(C=CN)C=CCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	334	CCCCNC=CN.NC=CNCCCCC1CCCB(O)O1>>CCCCN(C=CN)CCCC(O)CCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.BoronicCyclic
chan_lam	335	CCCCNC=CN.NC=CNCCCCCc1ccccc1B(O)O>>CCCCN(C=CN)c1ccccc1CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_Aromatic
chan_lam	336	CCCCNC=CN.NC=CNCCCCCc1cnccc1B(O)O>>CCCCN(C=CN)c1ccncc1CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	337	CCCCNC=CN.CC1(C)OB(CCCCCCNC=CN)OC1(C)C>>CCCCN(C=CN)CCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	338	CCCCNC=CN.CC1(C)OB(C=CCCCCCNC=CN)OC1(C)C>>CCCCN(C=CN)C=CCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	339	CCCCNC=CN.CC1(C)OB(c2ccccc2CCCCCNC=CN)OC1(C)C>>CCCCN(C=CN)c1ccccc1CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_Aromatic
chan_lam	340	CCCCNC=CN.CC1(C)OB(c2ccncc2CCCCCNC=CN)OC1(C)C>>CCCCN(C=CN)c1ccncc1CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	341	CCC=CNC=CN.NC=CNC=CCCCCB(O)O>>CCC=CN(C=CN)CCCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	342	CCC=CNC=CN.NC=CNC=CCCCC=CB(O)O>>CCC=CN(C=CN)C=CCCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	343	CCC=CNC=CN.NC=CNC=CCCC1CCCB(O)O1>>CCC=CN(C=CN)CCCC(O)CCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.BoronicCyclic
chan_lam	344	CCC=CNC=CN.NC=CNC=CCCCc1ccccc1B(O)O>>CCC=CN(C=CN)c1ccccc1CCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_Aromatic
chan_lam	345	CCC=CNC=CN.NC=CNC=CCCCc1cnccc1B(O)O>>CCC=CN(C=CN)c1ccncc1CCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	346	CCC=CNC=CN.CC1(C)OB(CCCCC=CNC=CN)OC1(C)C>>CCC=CN(C=CN)CCCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	347	CCC=CNC=CN.CC1(C)OB(C=CCCCC=CNC=CN)OC1(C)C>>CCC=CN(C=CN)C=CCCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	348	CCC=CNC=CN.CC1(C)OB(c2ccccc2CCCC=CNC=CN)OC1(C)C>>CCC=CN(C=CN)c1ccccc1CCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_Aromatic
chan_lam	349	CCC=CNC=CN.CC1(C)OB(c2ccncc2CCCC=CNC=CN)OC1(C)C>>CCC=CN(C=CN)c1ccncc1CCCC=CNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	350	CCC1CNCC(N)C1.NC1CNCC(CCCCB(O)O)C1>>CCC1CC(N)CN(CCCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	351	CCC1CNCC(N)C1.NC1CNCC(CCCC=CB(O)O)C1>>CCC1CC(N)CN(C=CCCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	352	CCC1CNCC(N)C1.NC1CNCC(CCC2CCCB(O)O2)C1>>CCC1CC(N)CN(CCCC(O)CCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.BoronicCyclic
chan_lam	353	CCC1CNCC(N)C1.NC1CNCC(CCCc2ccccc2B(O)O)C1>>CCC1CC(N)CN(c2ccccc2CCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_Aromatic
chan_lam	354	CCC1CNCC(N)C1.NC1CNCC(CCCc2cnccc2B(O)O)C1>>CCC1CC(N)CN(c2ccncc2CCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	355	CCC1CNCC(N)C1.CC1(C)OB(CCCCC2CNCC(N)C2)OC1(C)C>>CCC1CC(N)CN(CCCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	356	CCC1CNCC(N)C1.CC1(C)OB(C=CCCCC2CNCC(N)C2)OC1(C)C>>CCC1CC(N)CN(C=CCCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	357	CCC1CNCC(N)C1.CC1(C)OB(c2ccccc2CCCC2CNCC(N)C2)OC1(C)C>>CCC1CC(N)CN(c2ccccc2CCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_Aromatic
chan_lam	358	CCC1CNCC(N)C1.CC1(C)OB(c2ccncc2CCCC2CNCC(N)C2)OC1(C)C>>CCC1CC(N)CN(c2ccncc2CCCC2CNCC(N)C2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	359	CCC1CC=CNC1.OB(O)CCCCC1CC=CNC1>>CCC1CC=CN(CCCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	360	CCC1CC=CNC1.OB(O)C=CCCCC1CC=CNC1>>CCC1CC=CN(C=CCCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	361	CCC1CC=CNC1.OB1CCCC(CCC2CC=CNC2)O1>>CCC1CC=CN(CCCC(O)CCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.BoronicCyclic
chan_lam	362	CCC1CC=CNC1.OB(O)c1ccccc1CCCC1CC=CNC1>>CCC1CC=CN(c2ccccc2CCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_Aromatic
chan_lam	363	CCC1CC=CNC1.OB(O)c1ccncc1CCCC1CC=CNC1>>CCC1CC=CN(c2ccncc2CCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	364	CCC1CC=CNC1.CC1(C)OB(CCCCC2CC=CNC2)OC1(C)C>>CCC1CC=CN(CCCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	365	CCC1CC=CNC1.CC1(C)OB(C=CCCCC2CC=CNC2)OC1(C)C>>CCC1CC=CN(C=CCCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	366	CCC1CC=CNC1.CC1(C)OB(c2ccccc2CCCC2CC=CNC2)OC1(C)C>>CCC1CC=CN(c2ccccc2CCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_Aromatic
chan_lam	367	CCC1CC=CNC1.CC1(C)OB(c2ccncc2CCCC2CC=CNC2)OC1(C)C>>CCC1CC=CN(c2ccncc2CCCC2CC=CNC2)C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	368	CCC1C=CNC=CC1.OB(O)CCCCC1C=CNC=CC1>>CCC1C=CN(CCCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	369	CCC1C=CNC=CC1.OB(O)C=CCCCC1C=CNC=CC1>>CCC1C=CN(C=CCCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	370	CCC1C=CNC=CC1.OB1CCCC(CCC2C=CNC=CC2)O1>>CCC1C=CN(CCCC(O)CCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.BoronicCyclic
chan_lam	371	CCC1C=CNC=CC1.OB(O)c1ccccc1CCCC1C=CNC=CC1>>CCC1C=CN(c2ccccc2CCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_Aromatic
chan_lam	372	CCC1C=CNC=CC1.OB(O)c1ccncc1CCCC1C=CNC=CC1>>CCC1C=CN(c2ccncc2CCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	373	CCC1C=CNC=CC1.CC1(C)OB(CCCCC2C=CNC=CC2)OC1(C)C>>CCC1C=CN(CCCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	374	CCC1C=CNC=CC1.CC1(C)OB(C=CCCCC2C=CNC=CC2)OC1(C)C>>CCC1C=CN(C=CCCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	375	CCC1C=CNC=CC1.CC1(C)OB(c2ccccc2CCCC2C=CNC=CC2)OC1(C)C>>CCC1C=CN(c2ccccc2CCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_Aromatic
chan_lam	376	CCC1C=CNC=CC1.CC1(C)OB(c2ccncc2CCCC2C=CNC=CC2)OC1(C)C>>CCC1C=CN(c2ccncc2CCCC2C=CNC=CC2)C=CC1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	377	CCCNCCN.NCCNCCCCCB(O)O>>CCCNCCNCCCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	378	CCCNCCN.NCCNCCCCC=CB(O)O>>CCCNCCNC=CCCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	379	CCCNCCN.NCCNCCCC1CCCB(O)O1>>CCCNCCNCCCC(O)CCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.BoronicCyclic
chan_lam	380	CCCNCCN.NCCNCCCCc1ccccc1B(O)O>>CCCNCCNc1ccccc1CCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronic_Aromatic
chan_lam	381	CCCNCCN.NCCNCCCCc1cnccc1B(O)O>>CCCNCCNc1ccncc1CCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	382	CCCNCCN.CC1(C)OB(CCCCCNCCN)OC1(C)C>>CCCNCCNCCCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	383	CCCNCCN.CC1(C)OB(C=CCCCCNCCN)OC1(C)C>>CCCNCCNC=CCCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_SaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	384	CCCNCCN.CC1(C)OB(c2ccccc2CCCCNCCN)OC1(C)C>>CCCNCCNc1ccccc1CCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_SaturatedAliphatic.Boronate_Aromatic
chan_lam	385	CCCNCCN.CC1(C)OB(c2ccncc2CCCCNCCN)OC1(C)C>>CCCNCCNc1ccncc1CCCCNCCN	[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_SaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	386	CCCNC=CN.NC=CNCCCCCB(O)O>>CCCNC=CNCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronic_SaturatedAliphatic
chan_lam	387	CCCNC=CN.NC=CNCCCCC=CB(O)O>>CCCNC=CNC=CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronic_UnsaturatedAliphatic
chan_lam	388	CCCNC=CN.NC=CNCCCC1CCCB(O)O1>>CCCNC=CNCCCC(O)CCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.BoronicCyclic
chan_lam	389	CCCNC=CN.NC=CNCCCCc1ccccc1B(O)O>>CCCNC=CNc1ccccc1CCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronic_Aromatic
chan_lam	390	CCCNC=CN.NC=CNCCCCc1cnccc1B(O)O>>CCCNC=CNc1ccncc1CCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronic_Heteroaromatic
chan_lam	391	CCCNC=CN.CC1(C)OB(CCCCCNC=CN)OC1(C)C>>CCCNC=CNCCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronate_SaturatedAliphatic
chan_lam	392	CCCNC=CN.CC1(C)OB(C=CCCCCNC=CN)OC1(C)C>>CCCNC=CNC=CCCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_UnsaturatedAliphatic.Boronate_UnsaturatedAliphatic
chan_lam	393	CCCNC=CN.CC1(C)OB(c2ccccc2CCCCNC=CN)OC1(C)C>>CCCNC=CNc1ccccc1CCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_UnsaturatedAliphatic.Boronate_Aromatic
chan_lam	394	CCCNC=CN.CC1(C)OB(c2ccncc2CCCCNC=CN)OC1(C)C>>CCCNC=CNc1ccncc1CCCCNC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_UnsaturatedAliphatic.Boronate_Heteroaromatic
chan_lam	395	CCc1cccc(N)c1Nc1ccccc1.Nc1cccc(CCCCB(O)O)c1Nc1ccccc1>>CCc1cccc(N)c1N(CCCCc1cccc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	396	CCc1cccc(N)c1Nc1ccccc1.Nc1cccc(CCCC=CB(O)O)c1Nc1ccccc1>>CCc1cccc(N)c1N(C=CCCCc1cccc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	397	CCc1cccc(N)c1Nc1ccccc1.Nc1cccc(CCC2CCCB(O)O2)c1Nc1ccccc1>>CCc1cccc(N)c1N(CCCC(O)CCc1cccc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.BoronicCyclic
chan_lam	398	CCc1cccc(N)c1Nc1ccccc1.Nc1cccc(CCCc2ccccc2B(O)O)c1Nc1ccccc1>>CCc1cccc(N)c1N(c1ccccc1)c1ccccc1CCCc1cccc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronic_Aromatic
chan_lam	399	CCc1cccc(N)c1Nc1ccccc1.Nc1cccc(CCCc2cnccc2B(O)O)c1Nc1ccccc1>>CCc1cccc(N)c1N(c1ccccc1)c1ccncc1CCCc1cccc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronic_Heteroaromatic
chan_lam	400	CCc1cccc(N)c1Nc1ccccc1.CC1(C)OB(CCCCc2cccc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cccc(N)c1N(CCCCc1cccc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	401	CCc1cccc(N)c1Nc1ccccc1.CC1(C)OB(C=CCCCc2cccc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cccc(N)c1N(C=CCCCc1cccc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	402	CCc1cccc(N)c1Nc1ccccc1.CC1(C)OB(c2ccccc2CCCc2cccc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cccc(N)c1N(c1ccccc1)c1ccccc1CCCc1cccc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronate_Aromatic
chan_lam	403	CCc1cccc(N)c1Nc1ccccc1.CC1(C)OB(c2ccncc2CCCc2cccc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cccc(N)c1N(c1ccccc1)c1ccncc1CCCc1cccc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Aromatic-Aromatic.Boronate_Heteroaromatic
chan_lam	404	CCCc1ccccc1NCCN.NCCNc1ccccc1CCCCCB(O)O>>CCCc1ccccc1N(CCN)CCCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	405	CCCc1ccccc1NCCN.NCCNc1ccccc1CCCCC=CB(O)O>>CCCc1ccccc1N(C=CCCCCc1ccccc1NCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	406	CCCc1ccccc1NCCN.NCCNc1ccccc1CCCC1CCCB(O)O1>>CCCc1ccccc1N(CCN)CCCC(O)CCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.BoronicCyclic
chan_lam	407	CCCc1ccccc1NCCN.NCCNc1ccccc1CCCCc1ccccc1B(O)O>>CCCc1ccccc1N(CCN)c1ccccc1CCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_Aromatic
chan_lam	408	CCCc1ccccc1NCCN.NCCNc1ccccc1CCCCc1cnccc1B(O)O>>CCCc1ccccc1N(CCN)c1ccncc1CCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_Heteroaromatic
chan_lam	409	CCCc1ccccc1NCCN.CC1(C)OB(CCCCCc2ccccc2NCCN)OC1(C)C>>CCCc1ccccc1N(CCN)CCCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	410	CCCc1ccccc1NCCN.CC1(C)OB(C=CCCCCc2ccccc2NCCN)OC1(C)C>>CCCc1ccccc1N(C=CCCCCc1ccccc1NCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	411	CCCc1ccccc1NCCN.CC1(C)OB(c2ccccc2CCCCc2ccccc2NCCN)OC1(C)C>>CCCc1ccccc1N(CCN)c1ccccc1CCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_Aromatic
chan_lam	412	CCCc1ccccc1NCCN.CC1(C)OB(c2ccncc2CCCCc2ccccc2NCCN)OC1(C)C>>CCCc1ccccc1N(CCN)c1ccncc1CCCCc1ccccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_Heteroaromatic
chan_lam	413	CCc1ccccc1NC=CN.NC=CNc1ccccc1CCCCB(O)O>>CCc1ccccc1N(C=CN)CCCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	414	CCc1ccccc1NC=CN.NC=CNc1ccccc1CCCC=CB(O)O>>CCc1ccccc1N(C=CN)C=CCCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	415	CCc1ccccc1NC=CN.NC=CNc1ccccc1CCC1CCCB(O)O1>>CCc1ccccc1N(C=CN)CCCC(O)CCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.BoronicCyclic
chan_lam	416	CCc1ccccc1NC=CN.NC=CNc1ccccc1CCCc1ccccc1B(O)O>>CCc1ccccc1N(C=CN)c1ccccc1CCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_Aromatic
chan_lam	417	CCc1ccccc1NC=CN.NC=CNc1ccccc1CCCc1cnccc1B(O)O>>CCc1ccccc1N(C=CN)c1ccncc1CCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_Heteroaromatic
chan_lam	418	CCc1ccccc1NC=CN.CC1(C)OB(CCCCc2ccccc2NC=CN)OC1(C)C>>CCc1ccccc1N(C=CN)CCCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	419	CCc1ccccc1NC=CN.CC1(C)OB(C=CCCCc2ccccc2NC=CN)OC1(C)C>>CCc1ccccc1N(C=CN)C=CCCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	420	CCc1ccccc1NC=CN.CC1(C)OB(c2ccccc2CCCc2ccccc2NC=CN)OC1(C)C>>CCc1ccccc1N(C=CN)c1ccccc1CCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_Aromatic
chan_lam	421	CCc1ccccc1NC=CN.CC1(C)OB(c2ccncc2CCCc2ccccc2NC=CN)OC1(C)C>>CCc1ccccc1N(C=CN)c1ccncc1CCCc1ccccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_Heteroaromatic
chan_lam	422	CC1CCc2ccccc2Nc2ccccc2C1.OB(O)CCCC1CCc2ccccc2Nc2ccccc2C1>>CC1CCc2ccccc2N(CCCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	423	CC1CCc2ccccc2Nc2ccccc2C1.OB(O)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CC1CCc2ccccc2N(C=CCCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	424	CC1CCc2ccccc2Nc2ccccc2C1.OB1CCCC(CC2CCc3ccccc3Nc3ccccc3C2)O1>>CC1CCc2ccccc2N(CCCC(O)CC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.BoronicCyclic
chan_lam	425	CC1CCc2ccccc2Nc2ccccc2C1.OB(O)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CC1CCc2ccccc2N(c2ccccc2CCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronic_Aromatic
chan_lam	426	CC1CCc2ccccc2Nc2ccccc2C1.OB(O)c1ccncc1CCC1CCc2ccccc2Nc2ccccc2C1>>CC1CCc2ccccc2N(c2ccncc2CCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronic_Heteroaromatic
chan_lam	427	CC1CCc2ccccc2Nc2ccccc2C1.CC1(C)OB(CCCC2CCc3ccccc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccccc2N(CCCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	428	CC1CCc2ccccc2Nc2ccccc2C1.CC1(C)OB(C=CCCC2CCc3ccccc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccccc2N(C=CCCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	429	CC1CCc2ccccc2Nc2ccccc2C1.CC1(C)OB(c2ccccc2CCC2CCc3ccccc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccccc2N(c2ccccc2CCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronate_Aromatic
chan_lam	430	CC1CCc2ccccc2Nc2ccccc2C1.CC1(C)OB(c2ccncc2CCC2CCc3ccccc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccccc2N(c2ccncc2CCC2CCc3ccccc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Aromatic-Aromatic.Boronate_Heteroaromatic
chan_lam	431	Cc1ccc2c(c1)NCCC2.OB(O)CCCc1ccc2c(c1)NCCC2>>Cc1ccc2c(c1)N(CCCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	432	Cc1ccc2c(c1)NCCC2.OB(O)C=CCCc1ccc2c(c1)NCCC2>>Cc1ccc2c(c1)N(C=CCCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	433	Cc1ccc2c(c1)NCCC2.OB1CCCC(Cc2ccc3c(c2)NCCC3)O1>>Cc1ccc2c(c1)N(CCCC(O)Cc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.BoronicCyclic
chan_lam	434	Cc1ccc2c(c1)NCCC2.OB(O)c1ccccc1CCc1ccc2c(c1)NCCC2>>Cc1ccc2c(c1)N(c1ccccc1CCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_Aromatic
chan_lam	435	Cc1ccc2c(c1)NCCC2.OB(O)c1ccncc1CCc1ccc2c(c1)NCCC2>>Cc1ccc2c(c1)N(c1ccncc1CCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronic_Heteroaromatic
chan_lam	436	Cc1ccc2c(c1)NCCC2.CC1(C)OB(CCCc2ccc3c(c2)NCCC3)OC1(C)C>>Cc1ccc2c(c1)N(CCCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	437	Cc1ccc2c(c1)NCCC2.CC1(C)OB(C=CCCc2ccc3c(c2)NCCC3)OC1(C)C>>Cc1ccc2c(c1)N(C=CCCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	438	Cc1ccc2c(c1)NCCC2.CC1(C)OB(c2ccccc2CCc2ccc3c(c2)NCCC3)OC1(C)C>>Cc1ccc2c(c1)N(c1ccccc1CCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_Aromatic
chan_lam	439	Cc1ccc2c(c1)NCCC2.CC1(C)OB(c2ccncc2CCc2ccc3c(c2)NCCC3)OC1(C)C>>Cc1ccc2c(c1)N(c1ccncc1CCc1ccc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-Aromatic.Boronate_Heteroaromatic
chan_lam	440	Cc1ccc2c(c1)NC=CC2.OB(O)CCCc1ccc2c(c1)NC=CC2>>Cc1ccc2c(c1)N(CCCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_SaturatedAliphatic
chan_lam	441	Cc1ccc2c(c1)NC=CC2.OB(O)C=CCCc1ccc2c(c1)NC=CC2>>Cc1ccc2c(c1)N(C=CCCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_UnsaturatedAliphatic
chan_lam	442	Cc1ccc2c(c1)NC=CC2.OB1CCCC(Cc2ccc3c(c2)NC=CC3)O1>>Cc1ccc2c(c1)N(CCCC(O)Cc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.BoronicCyclic
chan_lam	443	Cc1ccc2c(c1)NC=CC2.OB(O)c1ccccc1CCc1ccc2c(c1)NC=CC2>>Cc1ccc2c(c1)N(c1ccccc1CCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_Aromatic
chan_lam	444	Cc1ccc2c(c1)NC=CC2.OB(O)c1ccncc1CCc1ccc2c(c1)NC=CC2>>Cc1ccc2c(c1)N(c1ccncc1CCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronic_Heteroaromatic
chan_lam	445	Cc1ccc2c(c1)NC=CC2.CC1(C)OB(CCCc2ccc3c(c2)NC=CC3)OC1(C)C>>Cc1ccc2c(c1)N(CCCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_SaturatedAliphatic
chan_lam	446	Cc1ccc2c(c1)NC=CC2.CC1(C)OB(C=CCCc2ccc3c(c2)NC=CC3)OC1(C)C>>Cc1ccc2c(c1)N(C=CCCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_UnsaturatedAliphatic
chan_lam	447	Cc1ccc2c(c1)NC=CC2.CC1(C)OB(c2ccccc2CCc2ccc3c(c2)NC=CC3)OC1(C)C>>Cc1ccc2c(c1)N(c1ccccc1CCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_Aromatic
chan_lam	448	Cc1ccc2c(c1)NC=CC2.CC1(C)OB(c2ccncc2CCc2ccc3c(c2)NC=CC3)OC1(C)C>>Cc1ccc2c(c1)N(c1ccncc1CCc1ccc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic.Boronate_Heteroaromatic
chan_lam	449	CCc1cccc(N)c1N.Nc1cccc(CCCCB(O)O)c1N>>CCc1cccc(NCCCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronic_SaturatedAliphatic
chan_lam	450	CCc1cccc(N)c1N.Nc1cccc(CCCC=CB(O)O)c1N>>CCc1cccc(NC=CCCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronic_UnsaturatedAliphatic
chan_lam	451	CCc1cccc(N)c1N.Nc1cccc(CCC2CCCB(O)O2)c1N>>CCc1cccc(NCCCC(O)CCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.BoronicCyclic
chan_lam	452	CCc1cccc(N)c1N.Nc1cccc(CCCc2ccccc2B(O)O)c1N>>CCc1cccc(Nc2ccccc2CCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronic_Aromatic
chan_lam	453	CCc1cccc(N)c1N.Nc1cccc(CCCc2cnccc2B(O)O)c1N>>CCc1cccc(Nc2ccncc2CCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronic_Heteroaromatic
chan_lam	454	CCc1cccc(N)c1N.CC1(C)OB(CCCCc2cccc(N)c2N)OC1(C)C>>CCc1cccc(NCCCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronate_SaturatedAliphatic
chan_lam	455	CCc1cccc(N)c1N.CC1(C)OB(C=CCCCc2cccc(N)c2N)OC1(C)C>>CCc1cccc(NC=CCCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Phe.Boronate_UnsaturatedAliphatic
chan_lam	456	CCc1cccc(N)c1N.CC1(C)OB(c2ccccc2CCCc2cccc(N)c2N)OC1(C)C>>CCc1cccc(Nc2ccccc2CCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Phe.Boronate_Aromatic
chan_lam	457	CCc1cccc(N)c1N.CC1(C)OB(c2ccncc2CCCc2cccc(N)c2N)OC1(C)C>>CCc1cccc(Nc2ccncc2CCCc2cccc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Phe.Boronate_Heteroaromatic
chan_lam	458	CCc1ccc2cc(N)c(N)cc2c1.Nc1cc2ccc(CCCCB(O)O)cc2cc1N>>CCc1ccc2cc(NCCCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronic_SaturatedAliphatic
chan_lam	459	CCc1ccc2cc(N)c(N)cc2c1.Nc1cc2ccc(CCCC=CB(O)O)cc2cc1N>>CCc1ccc2cc(NC=CCCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronic_UnsaturatedAliphatic
chan_lam	460	CCc1ccc2cc(N)c(N)cc2c1.Nc1cc2ccc(CCC3CCCB(O)O3)cc2cc1N>>CCc1ccc2cc(NCCCC(O)CCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.BoronicCyclic
chan_lam	461	CCc1ccc2cc(N)c(N)cc2c1.Nc1cc2ccc(CCCc3ccccc3B(O)O)cc2cc1N>>CCc1ccc2cc(Nc3ccccc3CCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronic_Aromatic
chan_lam	462	CCc1ccc2cc(N)c(N)cc2c1.Nc1cc2ccc(CCCc3cnccc3B(O)O)cc2cc1N>>CCc1ccc2cc(Nc3ccncc3CCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronic_Heteroaromatic
chan_lam	463	CCc1ccc2cc(N)c(N)cc2c1.CC1(C)OB(CCCCc2ccc3cc(N)c(N)cc3c2)OC1(C)C>>CCc1ccc2cc(NCCCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronate_SaturatedAliphatic
chan_lam	464	CCc1ccc2cc(N)c(N)cc2c1.CC1(C)OB(C=CCCCc2ccc3cc(N)c(N)cc3c2)OC1(C)C>>CCc1ccc2cc(NC=CCCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PhePhe.Boronate_UnsaturatedAliphatic
chan_lam	465	CCc1ccc2cc(N)c(N)cc2c1.CC1(C)OB(c2ccccc2CCCc2ccc3cc(N)c(N)cc3c2)OC1(C)C>>CCc1ccc2cc(Nc3ccccc3CCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PhePhe.Boronate_Aromatic
chan_lam	466	CCc1ccc2cc(N)c(N)cc2c1.CC1(C)OB(c2ccncc2CCCc2ccc3cc(N)c(N)cc3c2)OC1(C)C>>CCc1ccc2cc(Nc3ccncc3CCCc3ccc4cc(N)c(N)cc4c3)c(N)cc2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PhePhe.Boronate_Heteroaromatic
chan_lam	467	CCc1cncc(N)c1Nc1ccccc1.Nc1cncc(CCCCB(O)O)c1Nc1ccccc1>>CCc1cncc(N)c1N(CCCCc1cncc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	468	CCc1cncc(N)c1Nc1ccccc1.Nc1cncc(CCCC=CB(O)O)c1Nc1ccccc1>>CCc1cncc(N)c1N(C=CCCCc1cncc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	469	CCc1cncc(N)c1Nc1ccccc1.Nc1cncc(CCC2CCCB(O)O2)c1Nc1ccccc1>>CCc1cncc(N)c1N(CCCC(O)CCc1cncc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.BoronicCyclic
chan_lam	470	CCc1cncc(N)c1Nc1ccccc1.Nc1cncc(CCCc2ccccc2B(O)O)c1Nc1ccccc1>>CCc1cncc(N)c1N(c1ccccc1)c1ccccc1CCCc1cncc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronic_Aromatic
chan_lam	471	CCc1cncc(N)c1Nc1ccccc1.Nc1cncc(CCCc2cnccc2B(O)O)c1Nc1ccccc1>>CCc1cncc(N)c1N(c1ccccc1)c1ccncc1CCCc1cncc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	472	CCc1cncc(N)c1Nc1ccccc1.CC1(C)OB(CCCCc2cncc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cncc(N)c1N(CCCCc1cncc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	473	CCc1cncc(N)c1Nc1ccccc1.CC1(C)OB(C=CCCCc2cncc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cncc(N)c1N(C=CCCCc1cncc(N)c1Nc1ccccc1)c1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	474	CCc1cncc(N)c1Nc1ccccc1.CC1(C)OB(c2ccccc2CCCc2cncc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cncc(N)c1N(c1ccccc1)c1ccccc1CCCc1cncc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronate_Aromatic
chan_lam	475	CCc1cncc(N)c1Nc1ccccc1.CC1(C)OB(c2ccncc2CCCc2cncc(N)c2Nc2ccccc2)OC1(C)C>>CCc1cncc(N)c1N(c1ccccc1)c1ccncc1CCCc1cncc(N)c1Nc1ccccc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Aromatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	476	CCc1cncc(N)c1Nc1cccnc1.Nc1cncc(CCCCB(O)O)c1Nc1cccnc1>>CCc1cncc(N)c1N(CCCCc1cncc(N)c1Nc1cccnc1)c1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	477	CCc1cncc(N)c1Nc1cccnc1.Nc1cncc(CCCC=CB(O)O)c1Nc1cccnc1>>CCc1cncc(N)c1N(C=CCCCc1cncc(N)c1Nc1cccnc1)c1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	478	CCc1cncc(N)c1Nc1cccnc1.Nc1cncc(CCC2CCCB(O)O2)c1Nc1cccnc1>>CCc1cncc(N)c1N(CCCC(O)CCc1cncc(N)c1Nc1cccnc1)c1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.BoronicCyclic
chan_lam	479	CCc1cncc(N)c1Nc1cccnc1.Nc1cncc(CCCc2ccccc2B(O)O)c1Nc1cccnc1>>CCc1cncc(N)c1N(c1cccnc1)c1ccccc1CCCc1cncc(N)c1Nc1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_Aromatic
chan_lam	480	CCc1cncc(N)c1Nc1cccnc1.Nc1cncc(CCCc2cnccc2B(O)O)c1Nc1cccnc1>>CCc1cncc(N)c1N(c1cccnc1)c1ccncc1CCCc1cncc(N)c1Nc1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	481	CCc1cncc(N)c1Nc1cccnc1.CC1(C)OB(CCCCc2cncc(N)c2Nc2cccnc2)OC1(C)C>>CCc1cncc(N)c1N(CCCCc1cncc(N)c1Nc1cccnc1)c1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	482	CCc1cncc(N)c1Nc1cccnc1.CC1(C)OB(C=CCCCc2cncc(N)c2Nc2cccnc2)OC1(C)C>>CCc1cncc(N)c1N(C=CCCCc1cncc(N)c1Nc1cccnc1)c1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	483	CCc1cncc(N)c1Nc1cccnc1.CC1(C)OB(c2ccccc2CCCc2cncc(N)c2Nc2cccnc2)OC1(C)C>>CCc1cncc(N)c1N(c1cccnc1)c1ccccc1CCCc1cncc(N)c1Nc1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_Aromatic
chan_lam	484	CCc1cncc(N)c1Nc1cccnc1.CC1(C)OB(c2ccncc2CCCc2cncc(N)c2Nc2cccnc2)OC1(C)C>>CCc1cncc(N)c1N(c1cccnc1)c1ccncc1CCCc1cncc(N)c1Nc1cccnc1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	485	CCc1cnccc1NCCN.NCCNc1ccncc1CCCCB(O)O>>CCc1cnccc1N(CCN)CCCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	486	CCc1cnccc1NCCN.NCCNc1ccncc1CCCC=CB(O)O>>CCc1cnccc1N(C=CCCCc1cnccc1NCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	487	CCc1cnccc1NCCN.NCCNc1ccncc1CCC1CCCB(O)O1>>CCc1cnccc1N(CCN)CCCC(O)CCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.BoronicCyclic
chan_lam	488	CCc1cnccc1NCCN.NCCNc1ccncc1CCCc1ccccc1B(O)O>>CCc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_Aromatic
chan_lam	489	CCc1cnccc1NCCN.NCCNc1ccncc1CCCc1cnccc1B(O)O>>CCc1cnccc1N(CCN)c1ccncc1CCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	490	CCc1cnccc1NCCN.CC1(C)OB(CCCCc2cnccc2NCCN)OC1(C)C>>CCc1cnccc1N(CCN)CCCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	491	CCc1cnccc1NCCN.CC1(C)OB(C=CCCCc2cnccc2NCCN)OC1(C)C>>CCc1cnccc1N(C=CCCCc1cnccc1NCCN)CCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	492	CCc1cnccc1NCCN.CC1(C)OB(c2ccccc2CCCc2cnccc2NCCN)OC1(C)C>>CCc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_Aromatic
chan_lam	493	CCc1cnccc1NCCN.CC1(C)OB(c2ccncc2CCCc2cnccc2NCCN)OC1(C)C>>CCc1cnccc1N(CCN)c1ccncc1CCCc1cnccc1NCCN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	494	CCc1cnccc1NC=CN.NC=CNc1ccncc1CCCCB(O)O>>CCc1cnccc1N(C=CN)CCCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	495	CCc1cnccc1NC=CN.NC=CNc1ccncc1CCCC=CB(O)O>>CCc1cnccc1N(C=CN)C=CCCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	496	CCc1cnccc1NC=CN.NC=CNc1ccncc1CCC1CCCB(O)O1>>CCc1cnccc1N(C=CN)CCCC(O)CCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.BoronicCyclic
chan_lam	497	CCc1cnccc1NC=CN.NC=CNc1ccncc1CCCc1ccccc1B(O)O>>CCc1cnccc1N(C=CN)c1ccccc1CCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_Aromatic
chan_lam	498	CCc1cnccc1NC=CN.NC=CNc1ccncc1CCCc1cnccc1B(O)O>>CCc1cnccc1N(C=CN)c1ccncc1CCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	499	CCc1cnccc1NC=CN.CC1(C)OB(CCCCc2cnccc2NC=CN)OC1(C)C>>CCc1cnccc1N(C=CN)CCCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	500	CCc1cnccc1NC=CN.CC1(C)OB(C=CCCCc2cnccc2NC=CN)OC1(C)C>>CCc1cnccc1N(C=CN)C=CCCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	501	CCc1cnccc1NC=CN.CC1(C)OB(c2ccccc2CCCc2cnccc2NC=CN)OC1(C)C>>CCc1cnccc1N(C=CN)c1ccccc1CCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_Aromatic
chan_lam	502	CCc1cnccc1NC=CN.CC1(C)OB(c2ccncc2CCCc2cnccc2NC=CN)OC1(C)C>>CCc1cnccc1N(C=CN)c1ccncc1CCCc1cnccc1NC=CN	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	503	CC1CCc2ccncc2Nc2ccccc2C1.OB(O)CCCC1CCc2ccncc2Nc2ccccc2C1>>CC1CCc2ccncc2N(CCCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	504	CC1CCc2ccncc2Nc2ccccc2C1.OB(O)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CC1CCc2ccncc2N(C=CCCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	505	CC1CCc2ccncc2Nc2ccccc2C1.OB1CCCC(CC2CCc3ccncc3Nc3ccccc3C2)O1>>CC1CCc2ccncc2N(CCCC(O)CC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.BoronicCyclic
chan_lam	506	CC1CCc2ccncc2Nc2ccccc2C1.OB(O)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CC1CCc2ccncc2N(c2ccccc2CCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronic_Aromatic
chan_lam	507	CC1CCc2ccncc2Nc2ccccc2C1.OB(O)c1ccncc1CCC1CCc2ccncc2Nc2ccccc2C1>>CC1CCc2ccncc2N(c2ccncc2CCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	508	CC1CCc2ccncc2Nc2ccccc2C1.CC1(C)OB(CCCC2CCc3ccncc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccncc2N(CCCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	509	CC1CCc2ccncc2Nc2ccccc2C1.CC1(C)OB(C=CCCC2CCc3ccncc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccncc2N(C=CCCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	510	CC1CCc2ccncc2Nc2ccccc2C1.CC1(C)OB(c2ccccc2CCC2CCc3ccncc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccncc2N(c2ccccc2CCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronate_Aromatic
chan_lam	511	CC1CCc2ccncc2Nc2ccccc2C1.CC1(C)OB(c2ccncc2CCC2CCc3ccncc3Nc3ccccc3C2)OC1(C)C>>CC1CCc2ccncc2N(c2ccncc2CCC2CCc3ccncc3Nc3ccccc3C2)c2ccccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Aromatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	512	CC1CCc2cnccc2Nc2cnccc2C1.OB(O)CCCC1CCc2cnccc2Nc2cnccc2C1>>CC1CCc2cnccc2N(CCCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	513	CC1CCc2cnccc2Nc2cnccc2C1.OB(O)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CC1CCc2cnccc2N(C=CCCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	514	CC1CCc2cnccc2Nc2cnccc2C1.OB1CCCC(CC2CCc3cnccc3Nc3cnccc3C2)O1>>CC1CCc2cnccc2N(CCCC(O)CC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.BoronicCyclic
chan_lam	515	CC1CCc2cnccc2Nc2cnccc2C1.OB(O)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CC1CCc2cnccc2N(c2ccccc2CCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_Aromatic
chan_lam	516	CC1CCc2cnccc2Nc2cnccc2C1.OB(O)c1ccncc1CCC1CCc2cnccc2Nc2cnccc2C1>>CC1CCc2cnccc2N(c2ccncc2CCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	517	CC1CCc2cnccc2Nc2cnccc2C1.CC1(C)OB(CCCC2CCc3cnccc3Nc3cnccc3C2)OC1(C)C>>CC1CCc2cnccc2N(CCCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	518	CC1CCc2cnccc2Nc2cnccc2C1.CC1(C)OB(C=CCCC2CCc3cnccc3Nc3cnccc3C2)OC1(C)C>>CC1CCc2cnccc2N(C=CCCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	519	CC1CCc2cnccc2Nc2cnccc2C1.CC1(C)OB(c2ccccc2CCC2CCc3cnccc3Nc3cnccc3C2)OC1(C)C>>CC1CCc2cnccc2N(c2ccccc2CCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_Aromatic
chan_lam	520	CC1CCc2cnccc2Nc2cnccc2C1.CC1(C)OB(c2ccncc2CCC2CCc3cnccc3Nc3cnccc3C2)OC1(C)C>>CC1CCc2cnccc2N(c2ccncc2CCC2CCc3cnccc3Nc3cnccc3C2)c2cnccc2C1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	521	Cc1cnc2c(c1)NCCC2.OB(O)CCCc1cnc2c(c1)NCCC2>>Cc1cnc2c(c1)N(CCCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	522	Cc1cnc2c(c1)NCCC2.OB(O)C=CCCc1cnc2c(c1)NCCC2>>Cc1cnc2c(c1)N(C=CCCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	523	Cc1cnc2c(c1)NCCC2.OB1CCCC(Cc2cnc3c(c2)NCCC3)O1>>Cc1cnc2c(c1)N(CCCC(O)Cc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.BoronicCyclic
chan_lam	524	Cc1cnc2c(c1)NCCC2.OB(O)c1ccccc1CCc1cnc2c(c1)NCCC2>>Cc1cnc2c(c1)N(c1ccccc1CCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_Aromatic
chan_lam	525	Cc1cnc2c(c1)NCCC2.OB(O)c1ccncc1CCc1cnc2c(c1)NCCC2>>Cc1cnc2c(c1)N(c1ccncc1CCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	526	Cc1cnc2c(c1)NCCC2.CC1(C)OB(CCCc2cnc3c(c2)NCCC3)OC1(C)C>>Cc1cnc2c(c1)N(CCCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	527	Cc1cnc2c(c1)NCCC2.CC1(C)OB(C=CCCc2cnc3c(c2)NCCC3)OC1(C)C>>Cc1cnc2c(c1)N(C=CCCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	528	Cc1cnc2c(c1)NCCC2.CC1(C)OB(c2ccccc2CCc2cnc3c(c2)NCCC3)OC1(C)C>>Cc1cnc2c(c1)N(c1ccccc1CCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_Aromatic
chan_lam	529	Cc1cnc2c(c1)NCCC2.CC1(C)OB(c2ccncc2CCc2cnc3c(c2)NCCC3)OC1(C)C>>Cc1cnc2c(c1)N(c1ccncc1CCc1cnc3c(c1)NCCC3)CCC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	530	Cc1cnc2c(c1)NC=CC2.OB(O)CCCc1cnc2c(c1)NC=CC2>>Cc1cnc2c(c1)N(CCCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_SaturatedAliphatic
chan_lam	531	Cc1cnc2c(c1)NC=CC2.OB(O)C=CCCc1cnc2c(c1)NC=CC2>>Cc1cnc2c(c1)N(C=CCCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_UnsaturatedAliphatic
chan_lam	532	Cc1cnc2c(c1)NC=CC2.OB1CCCC(Cc2cnc3c(c2)NC=CC3)O1>>Cc1cnc2c(c1)N(CCCC(O)Cc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;R;$(B([O;D1])[O;D2]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.BoronicCyclic
chan_lam	533	Cc1cnc2c(c1)NC=CC2.OB(O)c1ccccc1CCc1cnc2c(c1)NC=CC2>>Cc1cnc2c(c1)N(c1ccccc1CCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_Aromatic
chan_lam	534	Cc1cnc2c(c1)NC=CC2.OB(O)c1ccncc1CCc1cnc2c(c1)NC=CC2>>Cc1cnc2c(c1)N(c1ccncc1CCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronic_Heteroaromatic
chan_lam	535	Cc1cnc2c(c1)NC=CC2.CC1(C)OB(CCCc2cnc3c(c2)NC=CC3)OC1(C)C>>Cc1cnc2c(c1)N(CCCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_SaturatedAliphatic
chan_lam	536	Cc1cnc2c(c1)NC=CC2.CC1(C)OB(C=CCCc2cnc3c(c2)NC=CC3)OC1(C)C>>Cc1cnc2c(c1)N(C=CCCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):4][#6:5]>>[N:1]([#6:2])([#6:3])[#6:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_UnsaturatedAliphatic
chan_lam	537	Cc1cnc2c(c1)NC=CC2.CC1(C)OB(c2ccccc2CCc2cnc3c(c2)NC=CC3)OC1(C)C>>Cc1cnc2c(c1)N(c1ccccc1CCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_Aromatic
chan_lam	538	Cc1cnc2c(c1)NC=CC2.CC1(C)OB(c2ccncc2CCc2cnc3c(c2)NC=CC3)OC1(C)C>>Cc1cnc2c(c1)N(c1ccncc1CCc1cnc3c(c1)NC=CC3)C=CC2	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):1]([#6:2])[#6:3].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):4][a:5]>>[N:1]([#6:2])([#6:3])[a:5]	Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic.Boronate_Heteroaromatic
chan_lam	539	CCc1coc(N)c1N.Nc1occ(CCCCB(O)O)c1N>>CCc1coc(NCCCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronic_SaturatedAliphatic
chan_lam	540	CCc1coc(N)c1N.Nc1occ(CCCC=CB(O)O)c1N>>CCc1coc(NC=CCCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronic_UnsaturatedAliphatic
chan_lam	541	CCc1coc(N)c1N.Nc1occ(CCC2CCCB(O)O2)c1N>>CCc1coc(NCCCC(O)CCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.BoronicCyclic
chan_lam	542	CCc1coc(N)c1N.Nc1occ(CCCc2ccccc2B(O)O)c1N>>CCc1coc(Nc2ccccc2CCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronic_Aromatic
chan_lam	543	CCc1coc(N)c1N.Nc1occ(CCCc2cnccc2B(O)O)c1N>>CCc1coc(Nc2ccncc2CCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronic_Heteroaromatic
chan_lam	544	CCc1coc(N)c1N.CC1(C)OB(CCCCc2coc(N)c2N)OC1(C)C>>CCc1coc(NCCCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronate_SaturatedAliphatic
chan_lam	545	CCc1coc(N)c1N.CC1(C)OB(C=CCCCc2coc(N)c2N)OC1(C)C>>CCc1coc(NC=CCCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5.Boronate_UnsaturatedAliphatic
chan_lam	546	CCc1coc(N)c1N.CC1(C)OB(c2ccccc2CCCc2coc(N)c2N)OC1(C)C>>CCc1coc(Nc2ccccc2CCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5.Boronate_Aromatic
chan_lam	547	CCc1coc(N)c1N.CC1(C)OB(c2ccncc2CCCc2coc(N)c2N)OC1(C)C>>CCc1coc(Nc2ccncc2CCCc2coc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5.Boronate_Heteroaromatic
chan_lam	548	CCc1occ2c(N)c(N)oc12.Nc1oc2c(CCCCB(O)O)occ2c1N>>CCc1occ2c(NCCCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronic_SaturatedAliphatic
chan_lam	549	CCc1occ2c(N)c(N)oc12.Nc1oc2c(CCCC=CB(O)O)occ2c1N>>CCc1occ2c(NC=CCCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronic_UnsaturatedAliphatic
chan_lam	550	CCc1occ2c(N)c(N)oc12.Nc1oc2c(CCC3CCCB(O)O3)occ2c1N>>CCc1occ2c(NCCCC(O)CCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.BoronicCyclic
chan_lam	551	CCc1occ2c(N)c(N)oc12.Nc1oc2c(CCCc3ccccc3B(O)O)occ2c1N>>CCc1occ2c(Nc3ccccc3CCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronic_Aromatic
chan_lam	552	CCc1occ2c(N)c(N)oc12.Nc1oc2c(CCCc3cnccc3B(O)O)occ2c1N>>CCc1occ2c(Nc3ccncc3CCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronic_Heteroaromatic
chan_lam	553	CCc1occ2c(N)c(N)oc12.CC1(C)OB(CCCCc2occ3c(N)c(N)oc23)OC1(C)C>>CCc1occ2c(NCCCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronate_SaturatedAliphatic
chan_lam	554	CCc1occ2c(N)c(N)oc12.CC1(C)OB(C=CCCCc2occ3c(N)c(N)oc23)OC1(C)C>>CCc1occ2c(NC=CCCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het5.Boronate_UnsaturatedAliphatic
chan_lam	555	CCc1occ2c(N)c(N)oc12.CC1(C)OB(c2ccccc2CCCc2occ3c(N)c(N)oc23)OC1(C)C>>CCc1occ2c(Nc3ccccc3CCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Het5.Boronate_Aromatic
chan_lam	556	CCc1occ2c(N)c(N)oc12.CC1(C)OB(c2ccncc2CCCc2occ3c(N)c(N)oc23)OC1(C)C>>CCc1occ2c(Nc3ccncc3CCCc3occ4c(N)c(N)oc34)c(N)oc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Het5.Boronate_Heteroaromatic
chan_lam	557	CCc1cc2oc(N)c(N)c2cn1.Nc1oc2cc(CCCCB(O)O)ncc2c1N>>CCc1cc2oc(NCCCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronic_SaturatedAliphatic
chan_lam	558	CCc1cc2oc(N)c(N)c2cn1.Nc1oc2cc(CCCC=CB(O)O)ncc2c1N>>CCc1cc2oc(NC=CCCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronic_UnsaturatedAliphatic
chan_lam	559	CCc1cc2oc(N)c(N)c2cn1.Nc1oc2cc(CCC3CCCB(O)O3)ncc2c1N>>CCc1cc2oc(NCCCC(O)CCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.BoronicCyclic
chan_lam	560	CCc1cc2oc(N)c(N)c2cn1.Nc1oc2cc(CCCc3ccccc3B(O)O)ncc2c1N>>CCc1cc2oc(Nc3ccccc3CCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronic_Aromatic
chan_lam	561	CCc1cc2oc(N)c(N)c2cn1.Nc1oc2cc(CCCc3cnccc3B(O)O)ncc2c1N>>CCc1cc2oc(Nc3ccncc3CCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronic_Heteroaromatic
chan_lam	562	CCc1cc2oc(N)c(N)c2cn1.CC1(C)OB(CCCCc2cc3oc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2oc(NCCCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronate_SaturatedAliphatic
chan_lam	563	CCc1cc2oc(N)c(N)c2cn1.CC1(C)OB(C=CCCCc2cc3oc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2oc(NC=CCCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Het6.Boronate_UnsaturatedAliphatic
chan_lam	564	CCc1cc2oc(N)c(N)c2cn1.CC1(C)OB(c2ccccc2CCCc2cc3oc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2oc(Nc3ccccc3CCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Het6.Boronate_Aromatic
chan_lam	565	CCc1cc2oc(N)c(N)c2cn1.CC1(C)OB(c2ccncc2CCCc2cc3oc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2oc(Nc3ccncc3CCCc3cc4oc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Het6.Boronate_Heteroaromatic
chan_lam	566	CCc1ccc2oc(N)c(N)c2c1.Nc1oc2ccc(CCCCB(O)O)cc2c1N>>CCc1ccc2oc(NCCCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronic_SaturatedAliphatic
chan_lam	567	CCc1ccc2oc(N)c(N)c2c1.Nc1oc2ccc(CCCC=CB(O)O)cc2c1N>>CCc1ccc2oc(NC=CCCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronic_UnsaturatedAliphatic
chan_lam	568	CCc1ccc2oc(N)c(N)c2c1.Nc1oc2ccc(CCC3CCCB(O)O3)cc2c1N>>CCc1ccc2oc(NCCCC(O)CCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.BoronicCyclic
chan_lam	569	CCc1ccc2oc(N)c(N)c2c1.Nc1oc2ccc(CCCc3ccccc3B(O)O)cc2c1N>>CCc1ccc2oc(Nc3ccccc3CCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronic_Aromatic
chan_lam	570	CCc1ccc2oc(N)c(N)c2c1.Nc1oc2ccc(CCCc3cnccc3B(O)O)cc2c1N>>CCc1ccc2oc(Nc3ccncc3CCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronic_Heteroaromatic
chan_lam	571	CCc1ccc2oc(N)c(N)c2c1.CC1(C)OB(CCCCc2ccc3oc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2oc(NCCCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronate_SaturatedAliphatic
chan_lam	572	CCc1ccc2oc(N)c(N)c2c1.CC1(C)OB(C=CCCCc2ccc3oc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2oc(NC=CCCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het5Phe.Boronate_UnsaturatedAliphatic
chan_lam	573	CCc1ccc2oc(N)c(N)c2c1.CC1(C)OB(c2ccccc2CCCc2ccc3oc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2oc(Nc3ccccc3CCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Phe.Boronate_Aromatic
chan_lam	574	CCc1ccc2oc(N)c(N)c2c1.CC1(C)OB(c2ccncc2CCCc2ccc3oc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2oc(Nc3ccncc3CCCc3ccc4oc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het5Phe.Boronate_Heteroaromatic
chan_lam	575	CCc1ccnc(N)c1N.Nc1nccc(CCCCB(O)O)c1N>>CCc1ccnc(NCCCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronic_SaturatedAliphatic
chan_lam	576	CCc1ccnc(N)c1N.Nc1nccc(CCCC=CB(O)O)c1N>>CCc1ccnc(NC=CCCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronic_UnsaturatedAliphatic
chan_lam	577	CCc1ccnc(N)c1N.Nc1nccc(CCC2CCCB(O)O2)c1N>>CCc1ccnc(NCCCC(O)CCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.BoronicCyclic
chan_lam	578	CCc1ccnc(N)c1N.Nc1nccc(CCCc2ccccc2B(O)O)c1N>>CCc1ccnc(Nc2ccccc2CCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronic_Aromatic
chan_lam	579	CCc1ccnc(N)c1N.Nc1nccc(CCCc2cnccc2B(O)O)c1N>>CCc1ccnc(Nc2ccncc2CCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronic_Heteroaromatic
chan_lam	580	CCc1ccnc(N)c1N.CC1(C)OB(CCCCc2ccnc(N)c2N)OC1(C)C>>CCc1ccnc(NCCCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronate_SaturatedAliphatic
chan_lam	581	CCc1ccnc(N)c1N.CC1(C)OB(C=CCCCc2ccnc(N)c2N)OC1(C)C>>CCc1ccnc(NC=CCCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6.Boronate_UnsaturatedAliphatic
chan_lam	582	CCc1ccnc(N)c1N.CC1(C)OB(c2ccccc2CCCc2ccnc(N)c2N)OC1(C)C>>CCc1ccnc(Nc2ccccc2CCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6.Boronate_Aromatic
chan_lam	583	CCc1ccnc(N)c1N.CC1(C)OB(c2ccncc2CCCc2ccnc(N)c2N)OC1(C)C>>CCc1ccnc(Nc2ccncc2CCCc2ccnc(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6.Boronate_Heteroaromatic
chan_lam	584	Cc1nc2cocc2c(N)c1N.Nc1c(CCCB(O)O)nc2cocc2c1N>>Cc1nc2cocc2c(NCCCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronic_SaturatedAliphatic
chan_lam	585	Cc1nc2cocc2c(N)c1N.Nc1c(CCC=CB(O)O)nc2cocc2c1N>>Cc1nc2cocc2c(NC=CCCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronic_UnsaturatedAliphatic
chan_lam	586	Cc1nc2cocc2c(N)c1N.Nc1c(CC2CCCB(O)O2)nc2cocc2c1N>>Cc1nc2cocc2c(NCCCC(O)Cc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.BoronicCyclic
chan_lam	587	Cc1nc2cocc2c(N)c1N.Nc1c(CCc2ccccc2B(O)O)nc2cocc2c1N>>Cc1nc2cocc2c(Nc2ccccc2CCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronic_Aromatic
chan_lam	588	Cc1nc2cocc2c(N)c1N.Nc1c(CCc2cnccc2B(O)O)nc2cocc2c1N>>Cc1nc2cocc2c(Nc2ccncc2CCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronic_Heteroaromatic
chan_lam	589	Cc1nc2cocc2c(N)c1N.CC1(C)OB(CCCc2nc3cocc3c(N)c2N)OC1(C)C>>Cc1nc2cocc2c(NCCCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronate_SaturatedAliphatic
chan_lam	590	Cc1nc2cocc2c(N)c1N.CC1(C)OB(C=CCCc2nc3cocc3c(N)c2N)OC1(C)C>>Cc1nc2cocc2c(NC=CCCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het5.Boronate_UnsaturatedAliphatic
chan_lam	591	Cc1nc2cocc2c(N)c1N.CC1(C)OB(c2ccccc2CCc2nc3cocc3c(N)c2N)OC1(C)C>>Cc1nc2cocc2c(Nc2ccccc2CCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Het5.Boronate_Aromatic
chan_lam	592	Cc1nc2cocc2c(N)c1N.CC1(C)OB(c2ccncc2CCc2nc3cocc3c(N)c2N)OC1(C)C>>Cc1nc2cocc2c(Nc2ccncc2CCc2nc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Het5.Boronate_Heteroaromatic
chan_lam	593	CCc1cc2cnc(N)c(N)c2cn1.Nc1ncc2cc(CCCCB(O)O)ncc2c1N>>CCc1cc2cnc(NCCCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronic_SaturatedAliphatic
chan_lam	594	CCc1cc2cnc(N)c(N)c2cn1.Nc1ncc2cc(CCCC=CB(O)O)ncc2c1N>>CCc1cc2cnc(NC=CCCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronic_UnsaturatedAliphatic
chan_lam	595	CCc1cc2cnc(N)c(N)c2cn1.Nc1ncc2cc(CCC3CCCB(O)O3)ncc2c1N>>CCc1cc2cnc(NCCCC(O)CCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.BoronicCyclic
chan_lam	596	CCc1cc2cnc(N)c(N)c2cn1.Nc1ncc2cc(CCCc3ccccc3B(O)O)ncc2c1N>>CCc1cc2cnc(Nc3ccccc3CCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronic_Aromatic
chan_lam	597	CCc1cc2cnc(N)c(N)c2cn1.Nc1ncc2cc(CCCc3cnccc3B(O)O)ncc2c1N>>CCc1cc2cnc(Nc3ccncc3CCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronic_Heteroaromatic
chan_lam	598	CCc1cc2cnc(N)c(N)c2cn1.CC1(C)OB(CCCCc2cc3cnc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2cnc(NCCCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronate_SaturatedAliphatic
chan_lam	599	CCc1cc2cnc(N)c(N)c2cn1.CC1(C)OB(C=CCCCc2cc3cnc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2cnc(NC=CCCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Het6.Boronate_UnsaturatedAliphatic
chan_lam	600	CCc1cc2cnc(N)c(N)c2cn1.CC1(C)OB(c2ccccc2CCCc2cc3cnc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2cnc(Nc3ccccc3CCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Het6.Boronate_Aromatic
chan_lam	601	CCc1cc2cnc(N)c(N)c2cn1.CC1(C)OB(c2ccncc2CCCc2cc3cnc(N)c(N)c3cn2)OC1(C)C>>CCc1cc2cnc(Nc3ccncc3CCCc3cc4cnc(N)c(N)c4cn3)c(N)c2cn1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Het6.Boronate_Heteroaromatic
chan_lam	602	CCc1ccc2cnc(N)c(N)c2c1.Nc1ncc2ccc(CCCCB(O)O)cc2c1N>>CCc1ccc2cnc(NCCCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronic_SaturatedAliphatic
chan_lam	603	CCc1ccc2cnc(N)c(N)c2c1.Nc1ncc2ccc(CCCC=CB(O)O)cc2c1N>>CCc1ccc2cnc(NC=CCCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronic_UnsaturatedAliphatic
chan_lam	604	CCc1ccc2cnc(N)c(N)c2c1.Nc1ncc2ccc(CCC3CCCB(O)O3)cc2c1N>>CCc1ccc2cnc(NCCCC(O)CCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.BoronicCyclic
chan_lam	605	CCc1ccc2cnc(N)c(N)c2c1.Nc1ncc2ccc(CCCc3ccccc3B(O)O)cc2c1N>>CCc1ccc2cnc(Nc3ccccc3CCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronic_Aromatic
chan_lam	606	CCc1ccc2cnc(N)c(N)c2c1.Nc1ncc2ccc(CCCc3cnccc3B(O)O)cc2c1N>>CCc1ccc2cnc(Nc3ccncc3CCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronic_Heteroaromatic
chan_lam	607	CCc1ccc2cnc(N)c(N)c2c1.CC1(C)OB(CCCCc2ccc3cnc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2cnc(NCCCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronate_SaturatedAliphatic
chan_lam	608	CCc1ccc2cnc(N)c(N)c2c1.CC1(C)OB(C=CCCCc2ccc3cnc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2cnc(NC=CCCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_Het6Phe.Boronate_UnsaturatedAliphatic
chan_lam	609	CCc1ccc2cnc(N)c(N)c2c1.CC1(C)OB(c2ccccc2CCCc2ccc3cnc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2cnc(Nc3ccccc3CCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Phe.Boronate_Aromatic
chan_lam	610	CCc1ccc2cnc(N)c(N)c2c1.CC1(C)OB(c2ccncc2CCCc2ccc3cnc(N)c(N)c3c2)OC1(C)C>>CCc1ccc2cnc(Nc3ccncc3CCCc3ccc4cnc(N)c(N)c4c3)c(N)c2c1	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_Het6Phe.Boronate_Heteroaromatic
chan_lam	611	Cc1cc2cocc2c(N)c1N.Nc1c(CCCB(O)O)cc2cocc2c1N>>Cc1cc2cocc2c(NCCCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronic_SaturatedAliphatic
chan_lam	612	Cc1cc2cocc2c(N)c1N.Nc1c(CCC=CB(O)O)cc2cocc2c1N>>Cc1cc2cocc2c(NC=CCCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronic_UnsaturatedAliphatic
chan_lam	613	Cc1cc2cocc2c(N)c1N.Nc1c(CC2CCCB(O)O2)cc2cocc2c1N>>Cc1cc2cocc2c(NCCCC(O)Cc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.BoronicCyclic
chan_lam	614	Cc1cc2cocc2c(N)c1N.Nc1c(CCc2ccccc2B(O)O)cc2cocc2c1N>>Cc1cc2cocc2c(Nc2ccccc2CCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronic_Aromatic
chan_lam	615	Cc1cc2cocc2c(N)c1N.Nc1c(CCc2cnccc2B(O)O)cc2cocc2c1N>>Cc1cc2cocc2c(Nc2ccncc2CCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronic_Heteroaromatic
chan_lam	616	Cc1cc2cocc2c(N)c1N.CC1(C)OB(CCCc2cc3cocc3c(N)c2N)OC1(C)C>>Cc1cc2cocc2c(NCCCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronate_SaturatedAliphatic
chan_lam	617	Cc1cc2cocc2c(N)c1N.CC1(C)OB(C=CCCc2cc3cocc3c(N)c2N)OC1(C)C>>Cc1cc2cocc2c(NC=CCCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet5.Boronate_UnsaturatedAliphatic
chan_lam	618	Cc1cc2cocc2c(N)c1N.CC1(C)OB(c2ccccc2CCc2cc3cocc3c(N)c2N)OC1(C)C>>Cc1cc2cocc2c(Nc2ccccc2CCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PheHet5.Boronate_Aromatic
chan_lam	619	Cc1cc2cocc2c(N)c1N.CC1(C)OB(c2ccncc2CCc2cc3cocc3c(N)c2N)OC1(C)C>>Cc1cc2cocc2c(Nc2ccncc2CCc2cc3cocc3c(N)c2N)c1N	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PheHet5.Boronate_Heteroaromatic
chan_lam	620	CCc1cncc2cc(N)c(N)cc12.Nc1cc2cncc(CCCCB(O)O)c2cc1N>>CCc1cncc2cc(NCCCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronic_SaturatedAliphatic
chan_lam	621	CCc1cncc2cc(N)c(N)cc12.Nc1cc2cncc(CCCC=CB(O)O)c2cc1N>>CCc1cncc2cc(NC=CCCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronic_UnsaturatedAliphatic
chan_lam	622	CCc1cncc2cc(N)c(N)cc12.Nc1cc2cncc(CCC3CCCB(O)O3)c2cc1N>>CCc1cncc2cc(NCCCC(O)CCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.BoronicCyclic
chan_lam	623	CCc1cncc2cc(N)c(N)cc12.Nc1cc2cncc(CCCc3ccccc3B(O)O)c2cc1N>>CCc1cncc2cc(Nc3ccccc3CCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronic_Aromatic
chan_lam	624	CCc1cncc2cc(N)c(N)cc12.Nc1cc2cncc(CCCc3cnccc3B(O)O)c2cc1N>>CCc1cncc2cc(Nc3ccncc3CCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronic_Heteroaromatic
chan_lam	625	CCc1cncc2cc(N)c(N)cc12.CC1(C)OB(CCCCc2cncc3cc(N)c(N)cc23)OC1(C)C>>CCc1cncc2cc(NCCCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronate_SaturatedAliphatic
chan_lam	626	CCc1cncc2cc(N)c(N)cc12.CC1(C)OB(C=CCCCc2cncc3cc(N)c(N)cc23)OC1(C)C>>CCc1cncc2cc(NC=CCCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Amine_Primary_PheHet6.Boronate_UnsaturatedAliphatic
chan_lam	627	CCc1cncc2cc(N)c(N)cc12.CC1(C)OB(c2ccccc2CCCc2cncc3cc(N)c(N)cc23)OC1(C)C>>CCc1cncc2cc(Nc3ccccc3CCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PheHet6.Boronate_Aromatic
chan_lam	628	CCc1cncc2cc(N)c(N)cc12.CC1(C)OB(c2ccncc2CCCc2cncc3cc(N)c(N)cc23)OC1(C)C>>CCc1cncc2cc(Nc3ccncc3CCCc3cncc4cc(N)c(N)cc34)c(N)cc12	[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Amine_Primary_PheHet6.Boronate_Heteroaromatic
chan_lam	629	CCCc1ccccc1CN.NCc1ccccc1CCCCCB(O)O>>CCCc1ccccc1CNCCCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronic_SaturatedAliphatic
chan_lam	630	CCCc1ccccc1CN.NCc1ccccc1CCCCC=CB(O)O>>CCCc1ccccc1CNC=CCCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronic_UnsaturatedAliphatic
chan_lam	631	CCCc1ccccc1CN.NCc1ccccc1CCCC1CCCB(O)O1>>CCCc1ccccc1CNCCCC(O)CCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.BoronicCyclic
chan_lam	632	CCCc1ccccc1CN.NCc1ccccc1CCCCc1ccccc1B(O)O>>CCCc1ccccc1CNc1ccccc1CCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronic_Aromatic
chan_lam	633	CCCc1ccccc1CN.NCc1ccccc1CCCCc1cnccc1B(O)O>>CCCc1ccccc1CNc1ccncc1CCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronic_Heteroaromatic
chan_lam	634	CCCc1ccccc1CN.CC1(C)OB(CCCCCc2ccccc2CN)OC1(C)C>>CCCc1ccccc1CNCCCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronate_SaturatedAliphatic
chan_lam	635	CCCc1ccccc1CN.CC1(C)OB(C=CCCCCc2ccccc2CN)OC1(C)C>>CCCc1ccccc1CNC=CCCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	Benzylamine_primary.Boronate_UnsaturatedAliphatic
chan_lam	636	CCCc1ccccc1CN.CC1(C)OB(c2ccccc2CCCCc2ccccc2CN)OC1(C)C>>CCCc1ccccc1CNc1ccccc1CCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	Benzylamine_primary.Boronate_Aromatic
chan_lam	637	CCCc1ccccc1CN.CC1(C)OB(c2ccncc2CCCCc2ccccc2CN)OC1(C)C>>CCCc1ccccc1CNc1ccncc1CCCCc1ccccc1CN	[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	Benzylamine_primary.Boronate_Heteroaromatic
chan_lam	638	CCCc1ccncc1CN.NCc1cnccc1CCCCCB(O)O>>CCCc1ccncc1CNCCCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronic_SaturatedAliphatic
chan_lam	639	CCCc1ccncc1CN.NCc1cnccc1CCCCC=CB(O)O>>CCCc1ccncc1CNC=CCCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronic_UnsaturatedAliphatic
chan_lam	640	CCCc1ccncc1CN.NCc1cnccc1CCCC1CCCB(O)O1>>CCCc1ccncc1CNCCCC(O)CCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.BoronicCyclic
chan_lam	641	CCCc1ccncc1CN.NCc1cnccc1CCCCc1ccccc1B(O)O>>CCCc1ccncc1CNc1ccccc1CCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronic_Aromatic
chan_lam	642	CCCc1ccncc1CN.NCc1cnccc1CCCCc1cnccc1B(O)O>>CCCc1ccncc1CNc1ccncc1CCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronic_Heteroaromatic
chan_lam	643	CCCc1ccncc1CN.CC1(C)OB(CCCCCc2ccncc2CN)OC1(C)C>>CCCc1ccncc1CNCCCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronate_SaturatedAliphatic
chan_lam	644	CCCc1ccncc1CN.CC1(C)OB(C=CCCCCc2ccncc2CN)OC1(C)C>>CCCc1ccncc1CNC=CCCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[#6:2][N:1][#6:4]	HeteroBenzylamine_primary.Boronate_UnsaturatedAliphatic
chan_lam	645	CCCc1ccncc1CN.CC1(C)OB(c2ccccc2CCCCc2ccncc2CN)OC1(C)C>>CCCc1ccncc1CNc1ccccc1CCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[#6:2][N:1][a:4]	HeteroBenzylamine_primary.Boronate_Aromatic
chan_lam	646	CCCc1ccncc1CN.CC1(C)OB(c2ccncc2CCCCc2ccncc2CN)OC1(C)C>>CCCc1ccncc1CNc1ccncc1CCCCc1ccncc1CN	[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):1][#6:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[#6:2][N:1][a:4]	HeteroBenzylamine_primary.Boronate_Heteroaromatic
chan_lam	647	Cc1cc[nH]c1.OB(O)CCCc1cc[nH]c1>>Cc1ccn(CCCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$([B;!R]([O;D1])[O;D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronic_SaturatedAliphatic
chan_lam	648	Cc1cc[nH]c1.OB(O)C=CCCc1cc[nH]c1>>Cc1ccn(C=CCCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$([B;!R]([O;D1])[O;D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronic_UnsaturatedAliphatic
chan_lam	649	Cc1cc[nH]c1.OB1CCCC(Cc2cc[nH]c2)O1>>Cc1ccn(CCCC(O)Cc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.BoronicCyclic
chan_lam	650	Cc1cc[nH]c1.OB(O)c1ccccc1CCc1cc[nH]c1>>Cc1ccn(c2ccccc2CCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronic_Aromatic
chan_lam	651	Cc1cc[nH]c1.OB(O)c1ccncc1CCc1cc[nH]c1>>Cc1ccn(c2ccncc2CCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronic_Heteroaromatic
chan_lam	652	Cc1cc[nH]c1.CC1(C)OB(CCCc2cc[nH]c2)OC1(C)C>>Cc1ccn(CCCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronate_SaturatedAliphatic
chan_lam	653	Cc1cc[nH]c1.CC1(C)OB(C=CCCc2cc[nH]c2)OC1(C)C>>Cc1ccn(C=CCCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$(B([O;!D1])[O;!D1]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[N:1][#6:4]	Heterocycle5_1NH.Boronate_UnsaturatedAliphatic
chan_lam	654	Cc1cc[nH]c1.CC1(C)OB(c2ccccc2CCc2cc[nH]c2)OC1(C)C>>Cc1ccn(c2ccccc2CCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[N:1][a:4]	Heterocycle5_1NH.Boronate_Aromatic
chan_lam	655	Cc1cc[nH]c1.CC1(C)OB(c2ccncc2CCc2cc[nH]c2)OC1(C)C>>Cc1ccn(c2ccncc2CCc2cc[nH]c2)c1	[n;D2;H1;$(n1cccc1):1].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[N:1][a:4]	Heterocycle5_1NH.Boronate_Heteroaromatic
sn2_nheterocycle	656	CCCBr.BrCCCc1cc[nH]c1>>CCCn1ccc(CCCBr)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Bromide_Aliph.Heterocycle5_1NH
sn2_nheterocycle	657	CCCBr.BrCCCc1cnc[nH]1>>CCCn1cncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Bromide_Aliph.Heterocycle5_polyHetNH
sn2_nheterocycle	658	CCC[N+]#CBr.BrC#[N+]CCCc1cc[nH]c1>>CCC[N+]#Cn1ccc(CCC[N+]#CBr)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Bromide_Nitrile.Heterocycle5_1NH
sn2_nheterocycle	659	CCC[N+]#CBr.BrC#[N+]CCCc1cnc[nH]1>>CCC[N+]#Cn1cncc1CCC[N+]#CBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Bromide_Nitrile.Heterocycle5_polyHetNH
sn2_nheterocycle	660	CCCCl.ClCCCc1cc[nH]c1>>CCCn1ccc(CCCCl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Chloride_Aliph.Heterocycle5_1NH
sn2_nheterocycle	661	CCCCl.ClCCCc1cnc[nH]1>>CCCn1cncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Chloride_Aliph.Heterocycle5_polyHetNH
sn2_nheterocycle	662	CCC[N+]#CCl.ClC#[N+]CCCc1cc[nH]c1>>CCC[N+]#Cn1ccc(CCC[N+]#CCl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Chloride_Nitrile.Heterocycle5_1NH
sn2_nheterocycle	663	CCC[N+]#CCl.ClC#[N+]CCCc1cnc[nH]1>>CCC[N+]#Cn1cncc1CCC[N+]#CCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Chloride_Nitrile.Heterocycle5_polyHetNH
sn2_nheterocycle	664	CCCI.ICCCc1cc[nH]c1>>CCCn1ccc(CCCI)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Iodide_Aliph.Heterocycle5_1NH
sn2_nheterocycle	665	CCCI.ICCCc1cnc[nH]1>>CCCn1cncc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Iodide_Aliph.Heterocycle5_polyHetNH
sn2_nheterocycle	666	CCC[N+]#CI.IC#[N+]CCCc1cc[nH]c1>>CCC[N+]#Cn1ccc(CCC[N+]#CI)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Iodide_Nitrile.Heterocycle5_1NH
sn2_nheterocycle	667	CCC[N+]#CI.IC#[N+]CCCc1cnc[nH]1>>CCC[N+]#Cn1cncc1CCC[N+]#CI	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Iodide_Nitrile.Heterocycle5_polyHetNH
sn2_nheterocycle	668	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cc[nH]c1)C(F)(F)F>>CCCn1ccc(CCCOS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Triflate_Aliph.Heterocycle5_1NH
sn2_nheterocycle	669	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cnc[nH]1)C(F)(F)F>>CCCn1cncc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Triflate_Aliph.Heterocycle5_polyHetNH
sn2_nheterocycle	670	CCC[N+]#COS(=O)(=O)C(F)(F)F.O=S(=O)(OC#[N+]CCCc1cc[nH]c1)C(F)(F)F>>CCC[N+]#Cn1ccc(CCC[N+]#COS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;D2;H1;$(n1cccc1):3]>>[C:2][N:3]	X-Triflate_Nitrile.Heterocycle5_1NH
sn2_nheterocycle	671	CCC[N+]#COS(=O)(=O)C(F)(F)F.O=S(=O)(OC#[N+]CCCc1cnc[nH]1)C(F)(F)F>>CCC[N+]#Cn1cncc1CCC[N+]#COS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):1][C:2].[n;H1;$(n1aaaa1);!$(n1cccc1):3]>>[C:2][N:3]	X-Triflate_Nitrile.Heterocycle5_polyHetNH
amide_coupling	672	CCCCC(=O)O.NCCNCCCCCCCC(=O)O>>CCCCC(=O)N(CCN)CCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	673	CCCCC(=O)O.NC=CNCCCCCCCC(=O)O>>CCCCC(=O)N(C=CN)CCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	674	CCCCC(=O)O.NC=CNC=CCCCCCC(=O)O>>CCCCC(=O)N(C=CN)C=CCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	675	CCCCC(=O)O.NC1CNCC(CCCCCC(=O)O)C1>>CCCCC(=O)N1CC(N)CC(CCCCCC(=O)O)C1	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	676	CCCCC(=O)O.O=C(O)CCCCCC1CC=CNC1>>CCCCC(=O)N1C=CCC(CCCCCC(=O)O)C1	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	677	CCCCC(=O)O.O=C(O)CCCCCC1C=CNC=CC1>>CCCCC(=O)N1C=CCC(CCCCCC(=O)O)C=C1	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	678	CCCCC(=O)O.NCCNCCCCCCC(=O)O>>CCCCC(=O)NCCNCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amide_coupling	679	CCCCC(=O)O.NC=CNCCCCCCC(=O)O>>CCCCC(=O)NC=CNCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	680	CCCCC(=O)O.Nc1cccc(CCCCCC(=O)O)c1Nc1ccccc1>>CCCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	681	CCCCC(=O)O.NCCNc1ccccc1CCCCCCC(=O)O>>CCCCC(=O)N(CCN)c1ccccc1CCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	682	CCCCC(=O)O.NC=CNc1ccccc1CCCCCC(=O)O>>CCCCC(=O)N(C=CN)c1ccccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	683	CCCCC(=O)O.O=C(O)CCCCC1CCc2ccccc2Nc2ccccc2C1>>CCCCC(=O)N1c2ccccc2CCC(CCCCC(=O)O)Cc2ccccc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	684	CCCCC(=O)O.O=C(O)CCCCc1ccc2c(c1)NCCC2>>CCCCC(=O)N1CCCc2ccc(CCCCC(=O)O)cc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	685	CCCCC(=O)O.O=C(O)CCCCc1ccc2c(c1)NC=CC2>>CCCCC(=O)N1C=CCc2ccc(CCCCC(=O)O)cc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	686	CCCCC(=O)O.Nc1cccc(CCCCCC(=O)O)c1N>>CCCCC(=O)Nc1cccc(CCCCCC(=O)O)c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Phe
amide_coupling	687	CCCCC(=O)O.Nc1cc2ccc(CCCCCC(=O)O)cc2cc1N>>CCCCC(=O)Nc1cc2ccc(CCCCCC(=O)O)cc2cc1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_PhePhe
amide_coupling	688	CCCCC(=O)O.Nc1cncc(CCCCCC(=O)O)c1Nc1ccccc1>>CCCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	689	CCCCC(=O)O.Nc1cncc(CCCCCC(=O)O)c1Nc1cccnc1>>CCCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	690	CCCCC(=O)O.NCCNc1ccncc1CCCCCC(=O)O>>CCCCC(=O)N(CCN)c1ccncc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	691	CCCCC(=O)O.NC=CNc1ccncc1CCCCCC(=O)O>>CCCCC(=O)N(C=CN)c1ccncc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	692	CCCCC(=O)O.O=C(O)CCCCC1CCc2ccncc2Nc2ccccc2C1>>CCCCC(=O)N1c2cnccc2CCC(CCCCC(=O)O)Cc2ccccc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	693	CCCCC(=O)O.O=C(O)CCCCC1CCc2cnccc2Nc2cnccc2C1>>CCCCC(=O)N1c2ccncc2CCC(CCCCC(=O)O)Cc2ccncc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	694	CCCCC(=O)O.O=C(O)CCCCc1cnc2c(c1)NCCC2>>CCCCC(=O)N1CCCc2ncc(CCCCC(=O)O)cc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	695	CCCCC(=O)O.O=C(O)CCCCc1cnc2c(c1)NC=CC2>>CCCCC(=O)N1C=CCc2ncc(CCCCC(=O)O)cc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	696	CCCCC(=O)O.Nc1occ(CCCCCC(=O)O)c1N>>CCCCC(=O)Nc1occ(CCCCCC(=O)O)c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het5
amide_coupling	697	CCCCC(=O)O.Nc1oc2c(CCCCCC(=O)O)occ2c1N>>CCCCC(=O)Nc1oc2c(CCCCCC(=O)O)occ2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het5Het5
amide_coupling	698	CCCCC(=O)O.Nc1oc2cc(CCCCCC(=O)O)ncc2c1N>>CCCCC(=O)Nc1oc2cc(CCCCCC(=O)O)ncc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het5Het6
amide_coupling	699	CCCCC(=O)O.Nc1oc2ccc(CCCCCC(=O)O)cc2c1N>>CCCCC(=O)Nc1oc2ccc(CCCCCC(=O)O)cc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het5Phe
amide_coupling	700	CCCCC(=O)O.Nc1nccc(CCCCCC(=O)O)c1N>>CCCCC(=O)Nc1nccc(CCCCCC(=O)O)c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het6
amide_coupling	701	CCCCC(=O)O.Nc1c(CCCCC(=O)O)nc2cocc2c1N>>CCCCC(=O)Nc1c(CCCCC(=O)O)nc2cocc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het6Het5
amide_coupling	702	CCCCC(=O)O.Nc1ncc2cc(CCCCCC(=O)O)ncc2c1N>>CCCCC(=O)Nc1ncc2cc(CCCCCC(=O)O)ncc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het6Het6
amide_coupling	703	CCCCC(=O)O.Nc1ncc2ccc(CCCCCC(=O)O)cc2c1N>>CCCCC(=O)Nc1ncc2ccc(CCCCCC(=O)O)cc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_Het6Phe
amide_coupling	704	CCCCC(=O)O.Nc1c(CCCCC(=O)O)cc2cocc2c1N>>CCCCC(=O)Nc1c(CCCCC(=O)O)cc2cocc2c1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_PheHet5
amide_coupling	705	CCCCC(=O)O.Nc1cc2cncc(CCCCCC(=O)O)c2cc1N>>CCCCC(=O)Nc1cc2cncc(CCCCCC(=O)O)c2cc1N	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Amine_Primary_PheHet6
amide_coupling	706	CCCCC(=O)O.NCc1ccccc1CCCCCCC(=O)O>>CCCCC(=O)NCc1ccccc1CCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.Benzylamine_primary
amide_coupling	707	CCCCC(=O)O.NCc1cnccc1CCCCCCC(=O)O>>CCCCC(=O)NCc1cnccc1CCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_SaturatedAliphatic.HeteroBenzylamine_primary
amide_coupling	708	CCC=CC(=O)O.NCCNCCCCCC=CC(=O)O>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	709	CCC=CC(=O)O.NC=CNCCCCCC=CC(=O)O>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	710	CCC=CC(=O)O.NC=CNC=CCCCC=CC(=O)O>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	711	CCC=CC(=O)O.NC1CNCC(CCCC=CC(=O)O)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)O)C1	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	712	CCC=CC(=O)O.O=C(O)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)O)C1	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	713	CCC=CC(=O)O.O=C(O)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)O)C=C1	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	714	CCC=CC(=O)O.NCCNCCCCC=CC(=O)O>>CCC=CC(=O)NCCNCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amide_coupling	715	CCC=CC(=O)O.NC=CNCCCCC=CC(=O)O>>CCC=CC(=O)NC=CNCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	716	CCC=CC(=O)O.Nc1cccc(CCCC=CC(=O)O)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	717	CCC=CC(=O)O.NCCNc1ccccc1CCCCC=CC(=O)O>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	718	CCC=CC(=O)O.NC=CNc1ccccc1CCCC=CC(=O)O>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	719	CCC=CC(=O)O.O=C(O)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)O)Cc2ccccc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	720	CCC=CC(=O)O.O=C(O)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)O)cc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	721	CCC=CC(=O)O.O=C(O)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)O)cc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	722	CCC=CC(=O)O.Nc1cccc(CCCC=CC(=O)O)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)O)c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Phe
amide_coupling	723	CCC=CC(=O)O.Nc1cc2ccc(CCCC=CC(=O)O)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)O)cc2cc1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_PhePhe
amide_coupling	724	CCC=CC(=O)O.Nc1cncc(CCCC=CC(=O)O)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	725	CCC=CC(=O)O.Nc1cncc(CCCC=CC(=O)O)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	726	CCC=CC(=O)O.NCCNc1ccncc1CCCC=CC(=O)O>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	727	CCC=CC(=O)O.NC=CNc1ccncc1CCCC=CC(=O)O>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	728	CCC=CC(=O)O.O=C(O)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)O)Cc2ccccc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	729	CCC=CC(=O)O.O=C(O)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)O)Cc2ccncc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	730	CCC=CC(=O)O.O=C(O)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)O)cc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	731	CCC=CC(=O)O.O=C(O)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)O)cc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	732	CCC=CC(=O)O.Nc1occ(CCCC=CC(=O)O)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)O)c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het5
amide_coupling	733	CCC=CC(=O)O.Nc1oc2c(CCCC=CC(=O)O)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)O)occ2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amide_coupling	734	CCC=CC(=O)O.Nc1oc2cc(CCCC=CC(=O)O)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)O)ncc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amide_coupling	735	CCC=CC(=O)O.Nc1oc2ccc(CCCC=CC(=O)O)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)O)cc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amide_coupling	736	CCC=CC(=O)O.Nc1nccc(CCCC=CC(=O)O)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)O)c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het6
amide_coupling	737	CCC=CC(=O)O.Nc1c(CCC=CC(=O)O)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)O)nc2cocc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amide_coupling	738	CCC=CC(=O)O.Nc1ncc2cc(CCCC=CC(=O)O)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)O)ncc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amide_coupling	739	CCC=CC(=O)O.Nc1ncc2ccc(CCCC=CC(=O)O)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)O)cc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amide_coupling	740	CCC=CC(=O)O.Nc1c(CCC=CC(=O)O)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)O)cc2cocc2c1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_PheHet5
amide_coupling	741	CCC=CC(=O)O.Nc1cc2cncc(CCCC=CC(=O)O)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)O)c2cc1N	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Amine_Primary_PheHet6
amide_coupling	742	CCC=CC(=O)O.NCc1ccccc1CCCCC=CC(=O)O>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.Benzylamine_primary
amide_coupling	743	CCC=CC(=O)O.NCc1cnccc1CCCCC=CC(=O)O>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_UnsaturatedAliphatic.HeteroBenzylamine_primary
amide_coupling	744	Cc1ccccc1C(=O)O.NCCNCCCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	745	Cc1ccccc1C(=O)O.NC=CNCCCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	746	Cc1ccccc1C(=O)O.NC=CNC=CCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	747	Cc1ccccc1C(=O)O.NC1CNCC(CCc2ccccc2C(=O)O)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	748	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	749	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)O)C=C1	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	750	Cc1ccccc1C(=O)O.NCCNCCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_SaturatedAliphatic
amide_coupling	751	Cc1ccccc1C(=O)O.NC=CNCCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	752	Cc1ccccc1C(=O)O.Nc1cccc(CCc2ccccc2C(=O)O)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	753	Cc1ccccc1C(=O)O.NCCNc1ccccc1CCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	754	Cc1ccccc1C(=O)O.NC=CNc1ccccc1CCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	755	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)O)Cc2ccccc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	756	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	757	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	758	Cc1ccccc1C(=O)O.Nc1cccc(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Phe
amide_coupling	759	Cc1ccccc1C(=O)O.Nc1cc2ccc(CCc3ccccc3C(=O)O)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)O)cc2cc1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_PhePhe
amide_coupling	760	Cc1ccccc1C(=O)O.Nc1cncc(CCc2ccccc2C(=O)O)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	761	Cc1ccccc1C(=O)O.Nc1cncc(CCc2ccccc2C(=O)O)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	762	Cc1ccccc1C(=O)O.NCCNc1ccncc1CCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	763	Cc1ccccc1C(=O)O.NC=CNc1ccncc1CCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	764	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)O)Cc2ccccc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	765	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)O)Cc2ccncc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	766	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	767	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	768	Cc1ccccc1C(=O)O.Nc1occ(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het5
amide_coupling	769	Cc1ccccc1C(=O)O.Nc1oc2c(CCc3ccccc3C(=O)O)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)O)occ2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het5Het5
amide_coupling	770	Cc1ccccc1C(=O)O.Nc1oc2cc(CCc3ccccc3C(=O)O)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)O)ncc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het5Het6
amide_coupling	771	Cc1ccccc1C(=O)O.Nc1oc2ccc(CCc3ccccc3C(=O)O)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)O)cc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het5Phe
amide_coupling	772	Cc1ccccc1C(=O)O.Nc1nccc(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het6
amide_coupling	773	Cc1ccccc1C(=O)O.Nc1c(Cc2ccccc2C(=O)O)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)O)nc2cocc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het6Het5
amide_coupling	774	Cc1ccccc1C(=O)O.Nc1ncc2cc(CCc3ccccc3C(=O)O)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)O)ncc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het6Het6
amide_coupling	775	Cc1ccccc1C(=O)O.Nc1ncc2ccc(CCc3ccccc3C(=O)O)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)O)cc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_Het6Phe
amide_coupling	776	Cc1ccccc1C(=O)O.Nc1c(Cc2ccccc2C(=O)O)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)O)cc2cocc2c1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_PheHet5
amide_coupling	777	Cc1ccccc1C(=O)O.Nc1cc2cncc(CCc3ccccc3C(=O)O)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)O)c2cc1N	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Amine_Primary_PheHet6
amide_coupling	778	Cc1ccccc1C(=O)O.NCc1ccccc1CCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.Benzylamine_primary
amide_coupling	779	Cc1ccccc1C(=O)O.NCc1cnccc1CCCc1ccccc1C(=O)O>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Aromatic.HeteroBenzylamine_primary
amide_coupling	780	Cc1cnccc1C(=O)O.NCCNCCCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	781	Cc1cnccc1C(=O)O.NC=CNCCCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	782	Cc1cnccc1C(=O)O.NC=CNC=CCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	783	Cc1cnccc1C(=O)O.NC1CNCC(CCc2cnccc2C(=O)O)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	784	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	785	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)O)C=C1	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	786	Cc1cnccc1C(=O)O.NCCNCCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amide_coupling	787	Cc1cnccc1C(=O)O.NC=CNCCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	788	Cc1cnccc1C(=O)O.Nc1cccc(CCc2cnccc2C(=O)O)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	789	Cc1cnccc1C(=O)O.NCCNc1ccccc1CCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	790	Cc1cnccc1C(=O)O.NC=CNc1ccccc1CCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	791	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)O)Cc2ccccc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	792	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	793	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	794	Cc1cnccc1C(=O)O.Nc1cccc(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Phe
amide_coupling	795	Cc1cnccc1C(=O)O.Nc1cc2ccc(CCc3cnccc3C(=O)O)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)O)cc2cc1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_PhePhe
amide_coupling	796	Cc1cnccc1C(=O)O.Nc1cncc(CCc2cnccc2C(=O)O)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	797	Cc1cnccc1C(=O)O.Nc1cncc(CCc2cnccc2C(=O)O)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	798	Cc1cnccc1C(=O)O.NCCNc1ccncc1CCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	799	Cc1cnccc1C(=O)O.NC=CNc1ccncc1CCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	800	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)O)Cc2ccccc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	801	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)O)Cc2ccncc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	802	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	803	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Acid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	804	Cc1cnccc1C(=O)O.Nc1occ(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het5
amide_coupling	805	Cc1cnccc1C(=O)O.Nc1oc2c(CCc3cnccc3C(=O)O)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)O)occ2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het5Het5
amide_coupling	806	Cc1cnccc1C(=O)O.Nc1oc2cc(CCc3cnccc3C(=O)O)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)O)ncc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het5Het6
amide_coupling	807	Cc1cnccc1C(=O)O.Nc1oc2ccc(CCc3cnccc3C(=O)O)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)O)cc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het5Phe
amide_coupling	808	Cc1cnccc1C(=O)O.Nc1nccc(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)O)c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het6
amide_coupling	809	Cc1cnccc1C(=O)O.Nc1c(Cc2cnccc2C(=O)O)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)O)nc2cocc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het6Het5
amide_coupling	810	Cc1cnccc1C(=O)O.Nc1ncc2cc(CCc3cnccc3C(=O)O)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)O)ncc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het6Het6
amide_coupling	811	Cc1cnccc1C(=O)O.Nc1ncc2ccc(CCc3cnccc3C(=O)O)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)O)cc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_Het6Phe
amide_coupling	812	Cc1cnccc1C(=O)O.Nc1c(Cc2cnccc2C(=O)O)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)O)cc2cocc2c1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_PheHet5
amide_coupling	813	Cc1cnccc1C(=O)O.Nc1cc2cncc(CCc3cnccc3C(=O)O)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)O)c2cc1N	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Amine_Primary_PheHet6
amide_coupling	814	Cc1cnccc1C(=O)O.NCc1ccccc1CCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.Benzylamine_primary
amide_coupling	815	Cc1cnccc1C(=O)O.NCc1cnccc1CCCc1cnccc1C(=O)O>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Acid_Heteroaromatic.HeteroBenzylamine_primary
amide_coupling	816	CCCC(=O)S.NCCNCCCCCCC(=O)S>>CCCC(=O)N(CCN)CCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	817	CCCC(=O)S.NC=CNCCCCCCC(=O)S>>CCCC(=O)N(C=CN)CCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	818	CCCC(=O)S.NC=CNC=CCCCCC(=O)S>>CCCC(=O)N(C=CN)C=CCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	819	CCCC(=O)S.NC1CNCC(CCCCC(=O)S)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	820	CCCC(=O)S.O=C(S)CCCCC1CC=CNC1>>CCCC(=O)N1C=CCC(CCCCC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	821	CCCC(=O)S.O=C(S)CCCCC1C=CNC=CC1>>CCCC(=O)N1C=CCC(CCCCC(=O)S)C=C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	822	CCCC(=O)S.NCCNCCCCCC(=O)S>>CCCC(=O)NCCNCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amide_coupling	823	CCCC(=O)S.NC=CNCCCCCC(=O)S>>CCCC(=O)NC=CNCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	824	CCCC(=O)S.Nc1cccc(CCCCC(=O)S)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	825	CCCC(=O)S.NCCNc1ccccc1CCCCCC(=O)S>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	826	CCCC(=O)S.NC=CNc1ccccc1CCCCC(=O)S>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	827	CCCC(=O)S.O=C(S)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	828	CCCC(=O)S.O=C(S)CCCc1ccc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ccc(CCCC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	829	CCCC(=O)S.O=C(S)CCCc1ccc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	830	CCCC(=O)S.Nc1cccc(CCCCC(=O)S)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Phe
amide_coupling	831	CCCC(=O)S.Nc1cc2ccc(CCCCC(=O)S)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)S)cc2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_PhePhe
amide_coupling	832	CCCC(=O)S.Nc1cncc(CCCCC(=O)S)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	833	CCCC(=O)S.Nc1cncc(CCCCC(=O)S)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	834	CCCC(=O)S.NCCNc1ccncc1CCCCC(=O)S>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	835	CCCC(=O)S.NC=CNc1ccncc1CCCCC(=O)S>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	836	CCCC(=O)S.O=C(S)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	837	CCCC(=O)S.O=C(S)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)S)Cc2ccncc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	838	CCCC(=O)S.O=C(S)CCCc1cnc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ncc(CCCC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	839	CCCC(=O)S.O=C(S)CCCc1cnc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	840	CCCC(=O)S.Nc1occ(CCCCC(=O)S)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het5
amide_coupling	841	CCCC(=O)S.Nc1oc2c(CCCCC(=O)S)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)S)occ2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het5Het5
amide_coupling	842	CCCC(=O)S.Nc1oc2cc(CCCCC(=O)S)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het5Het6
amide_coupling	843	CCCC(=O)S.Nc1oc2ccc(CCCCC(=O)S)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het5Phe
amide_coupling	844	CCCC(=O)S.Nc1nccc(CCCCC(=O)S)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het6
amide_coupling	845	CCCC(=O)S.Nc1c(CCCC(=O)S)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)S)nc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het6Het5
amide_coupling	846	CCCC(=O)S.Nc1ncc2cc(CCCCC(=O)S)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het6Het6
amide_coupling	847	CCCC(=O)S.Nc1ncc2ccc(CCCCC(=O)S)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_Het6Phe
amide_coupling	848	CCCC(=O)S.Nc1c(CCCC(=O)S)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)S)cc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_PheHet5
amide_coupling	849	CCCC(=O)S.Nc1cc2cncc(CCCCC(=O)S)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)S)c2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Amine_Primary_PheHet6
amide_coupling	850	CCCC(=O)S.NCc1ccccc1CCCCCC(=O)S>>CCCC(=O)NCc1ccccc1CCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.Benzylamine_primary
amide_coupling	851	CCCC(=O)S.NCc1cnccc1CCCCCC(=O)S>>CCCC(=O)NCc1cnccc1CCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_SaturatedAliphatic.HeteroBenzylamine_primary
amide_coupling	852	CCC=CC(=O)S.NCCNCCCCCC=CC(=O)S>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	853	CCC=CC(=O)S.NC=CNCCCCCC=CC(=O)S>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	854	CCC=CC(=O)S.NC=CNC=CCCCC=CC(=O)S>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	855	CCC=CC(=O)S.NC1CNCC(CCCC=CC(=O)S)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	856	CCC=CC(=O)S.O=C(S)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	857	CCC=CC(=O)S.O=C(S)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)S)C=C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	858	CCC=CC(=O)S.NCCNCCCCC=CC(=O)S>>CCC=CC(=O)NCCNCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amide_coupling	859	CCC=CC(=O)S.NC=CNCCCCC=CC(=O)S>>CCC=CC(=O)NC=CNCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	860	CCC=CC(=O)S.Nc1cccc(CCCC=CC(=O)S)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	861	CCC=CC(=O)S.NCCNc1ccccc1CCCCC=CC(=O)S>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	862	CCC=CC(=O)S.NC=CNc1ccccc1CCCC=CC(=O)S>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	863	CCC=CC(=O)S.O=C(S)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	864	CCC=CC(=O)S.O=C(S)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	865	CCC=CC(=O)S.O=C(S)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	866	CCC=CC(=O)S.Nc1cccc(CCCC=CC(=O)S)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Phe
amide_coupling	867	CCC=CC(=O)S.Nc1cc2ccc(CCCC=CC(=O)S)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)S)cc2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_PhePhe
amide_coupling	868	CCC=CC(=O)S.Nc1cncc(CCCC=CC(=O)S)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	869	CCC=CC(=O)S.Nc1cncc(CCCC=CC(=O)S)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	870	CCC=CC(=O)S.NCCNc1ccncc1CCCC=CC(=O)S>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	871	CCC=CC(=O)S.NC=CNc1ccncc1CCCC=CC(=O)S>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	872	CCC=CC(=O)S.O=C(S)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	873	CCC=CC(=O)S.O=C(S)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)S)Cc2ccncc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	874	CCC=CC(=O)S.O=C(S)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	875	CCC=CC(=O)S.O=C(S)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	876	CCC=CC(=O)S.Nc1occ(CCCC=CC(=O)S)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het5
amide_coupling	877	CCC=CC(=O)S.Nc1oc2c(CCCC=CC(=O)S)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)S)occ2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amide_coupling	878	CCC=CC(=O)S.Nc1oc2cc(CCCC=CC(=O)S)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amide_coupling	879	CCC=CC(=O)S.Nc1oc2ccc(CCCC=CC(=O)S)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amide_coupling	880	CCC=CC(=O)S.Nc1nccc(CCCC=CC(=O)S)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het6
amide_coupling	881	CCC=CC(=O)S.Nc1c(CCC=CC(=O)S)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)S)nc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amide_coupling	882	CCC=CC(=O)S.Nc1ncc2cc(CCCC=CC(=O)S)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amide_coupling	883	CCC=CC(=O)S.Nc1ncc2ccc(CCCC=CC(=O)S)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amide_coupling	884	CCC=CC(=O)S.Nc1c(CCC=CC(=O)S)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)S)cc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_PheHet5
amide_coupling	885	CCC=CC(=O)S.Nc1cc2cncc(CCCC=CC(=O)S)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)S)c2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Amine_Primary_PheHet6
amide_coupling	886	CCC=CC(=O)S.NCc1ccccc1CCCCC=CC(=O)S>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.Benzylamine_primary
amide_coupling	887	CCC=CC(=O)S.NCc1cnccc1CCCCC=CC(=O)S>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_UnsaturatedAliphatic.HeteroBenzylamine_primary
amide_coupling	888	Cc1ccccc1C(=O)S.NCCNCCCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	889	Cc1ccccc1C(=O)S.NC=CNCCCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	890	Cc1ccccc1C(=O)S.NC=CNC=CCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	891	Cc1ccccc1C(=O)S.NC1CNCC(CCc2ccccc2C(=O)S)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	892	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	893	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)S)C=C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	894	Cc1ccccc1C(=O)S.NCCNCCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_SaturatedAliphatic
amide_coupling	895	Cc1ccccc1C(=O)S.NC=CNCCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	896	Cc1ccccc1C(=O)S.Nc1cccc(CCc2ccccc2C(=O)S)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	897	Cc1ccccc1C(=O)S.NCCNc1ccccc1CCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	898	Cc1ccccc1C(=O)S.NC=CNc1ccccc1CCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	899	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	900	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	901	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	902	Cc1ccccc1C(=O)S.Nc1cccc(CCc2ccccc2C(=O)S)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Phe
amide_coupling	903	Cc1ccccc1C(=O)S.Nc1cc2ccc(CCc3ccccc3C(=O)S)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)S)cc2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_PhePhe
amide_coupling	904	Cc1ccccc1C(=O)S.Nc1cncc(CCc2ccccc2C(=O)S)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	905	Cc1ccccc1C(=O)S.Nc1cncc(CCc2ccccc2C(=O)S)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	906	Cc1ccccc1C(=O)S.NCCNc1ccncc1CCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	907	Cc1ccccc1C(=O)S.NC=CNc1ccncc1CCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	908	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	909	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)S)Cc2ccncc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	910	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	911	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	912	Cc1ccccc1C(=O)S.Nc1occ(CCc2ccccc2C(=O)S)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het5
amide_coupling	913	Cc1ccccc1C(=O)S.Nc1oc2c(CCc3ccccc3C(=O)S)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)S)occ2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het5Het5
amide_coupling	914	Cc1ccccc1C(=O)S.Nc1oc2cc(CCc3ccccc3C(=O)S)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het5Het6
amide_coupling	915	Cc1ccccc1C(=O)S.Nc1oc2ccc(CCc3ccccc3C(=O)S)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het5Phe
amide_coupling	916	Cc1ccccc1C(=O)S.Nc1nccc(CCc2ccccc2C(=O)S)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het6
amide_coupling	917	Cc1ccccc1C(=O)S.Nc1c(Cc2ccccc2C(=O)S)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)S)nc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het6Het5
amide_coupling	918	Cc1ccccc1C(=O)S.Nc1ncc2cc(CCc3ccccc3C(=O)S)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het6Het6
amide_coupling	919	Cc1ccccc1C(=O)S.Nc1ncc2ccc(CCc3ccccc3C(=O)S)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_Het6Phe
amide_coupling	920	Cc1ccccc1C(=O)S.Nc1c(Cc2ccccc2C(=O)S)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)S)cc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_PheHet5
amide_coupling	921	Cc1ccccc1C(=O)S.Nc1cc2cncc(CCc3ccccc3C(=O)S)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)S)c2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Amine_Primary_PheHet6
amide_coupling	922	Cc1ccccc1C(=O)S.NCc1ccccc1CCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.Benzylamine_primary
amide_coupling	923	Cc1ccccc1C(=O)S.NCc1cnccc1CCCc1ccccc1C(=O)S>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Aromatic.HeteroBenzylamine_primary
amide_coupling	924	Cc1cnccc1C(=O)S.NCCNCCCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	925	Cc1cnccc1C(=O)S.NC=CNCCCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	926	Cc1cnccc1C(=O)S.NC=CNC=CCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	927	Cc1cnccc1C(=O)S.NC1CNCC(CCc2cnccc2C(=O)S)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amide_coupling	928	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	929	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)S)C=C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amide_coupling	930	Cc1cnccc1C(=O)S.NCCNCCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amide_coupling	931	Cc1cnccc1C(=O)S.NC=CNCCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amide_coupling	932	Cc1cnccc1C(=O)S.Nc1cccc(CCc2cnccc2C(=O)S)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amide_coupling	933	Cc1cnccc1C(=O)S.NCCNc1ccccc1CCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	934	Cc1cnccc1C(=O)S.NC=CNc1ccccc1CCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	935	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amide_coupling	936	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amide_coupling	937	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amide_coupling	938	Cc1cnccc1C(=O)S.Nc1cccc(CCc2cnccc2C(=O)S)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Phe
amide_coupling	939	Cc1cnccc1C(=O)S.Nc1cc2ccc(CCc3cnccc3C(=O)S)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)S)cc2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_PhePhe
amide_coupling	940	Cc1cnccc1C(=O)S.Nc1cncc(CCc2cnccc2C(=O)S)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	941	Cc1cnccc1C(=O)S.Nc1cncc(CCc2cnccc2C(=O)S)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	942	Cc1cnccc1C(=O)S.NCCNc1ccncc1CCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	943	Cc1cnccc1C(=O)S.NC=CNc1ccncc1CCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	944	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)S)Cc2ccccc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amide_coupling	945	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)S)Cc2ccncc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amide_coupling	946	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amide_coupling	947	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Thioacid_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amide_coupling	948	Cc1cnccc1C(=O)S.Nc1occ(CCc2cnccc2C(=O)S)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het5
amide_coupling	949	Cc1cnccc1C(=O)S.Nc1oc2c(CCc3cnccc3C(=O)S)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)S)occ2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het5Het5
amide_coupling	950	Cc1cnccc1C(=O)S.Nc1oc2cc(CCc3cnccc3C(=O)S)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het5Het6
amide_coupling	951	Cc1cnccc1C(=O)S.Nc1oc2ccc(CCc3cnccc3C(=O)S)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het5Phe
amide_coupling	952	Cc1cnccc1C(=O)S.Nc1nccc(CCc2cnccc2C(=O)S)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)S)c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het6
amide_coupling	953	Cc1cnccc1C(=O)S.Nc1c(Cc2cnccc2C(=O)S)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)S)nc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het6Het5
amide_coupling	954	Cc1cnccc1C(=O)S.Nc1ncc2cc(CCc3cnccc3C(=O)S)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)S)ncc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het6Het6
amide_coupling	955	Cc1cnccc1C(=O)S.Nc1ncc2ccc(CCc3cnccc3C(=O)S)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)S)cc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_Het6Phe
amide_coupling	956	Cc1cnccc1C(=O)S.Nc1c(Cc2cnccc2C(=O)S)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)S)cc2cocc2c1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_PheHet5
amide_coupling	957	Cc1cnccc1C(=O)S.Nc1cc2cncc(CCc3cnccc3C(=O)S)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)S)c2cc1N	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Amine_Primary_PheHet6
amide_coupling	958	Cc1cnccc1C(=O)S.NCc1ccccc1CCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.Benzylamine_primary
amide_coupling	959	Cc1cnccc1C(=O)S.NCc1cnccc1CCCc1cnccc1C(=O)S>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Thioacid_Heteroaromatic.HeteroBenzylamine_primary
amine_sulfonation	960	CCCS(=O)(=O)O.NCCNCCCCCCS(=O)(=O)O>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	961	CCCS(=O)(=O)O.NC=CNCCCCCCS(=O)(=O)O>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	962	CCCS(=O)(=O)O.NC=CNC=CCCCCS(=O)(=O)O>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	963	CCCS(=O)(=O)O.NC1CNCC(CCCCS(=O)(=O)O)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)O)C1	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	964	CCCS(=O)(=O)O.O=S(=O)(O)CCCCC1CC=CNC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)O)C1	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	965	CCCS(=O)(=O)O.O=S(=O)(O)CCCCC1C=CNC=CC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)O)C=C1	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	966	CCCS(=O)(=O)O.NCCNCCCCCS(=O)(=O)O>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	967	CCCS(=O)(=O)O.NC=CNCCCCCS(=O)(=O)O>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	968	CCCS(=O)(=O)O.Nc1cccc(CCCCS(=O)(=O)O)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	969	CCCS(=O)(=O)O.NCCNc1ccccc1CCCCCS(=O)(=O)O>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	970	CCCS(=O)(=O)O.NC=CNc1ccccc1CCCCS(=O)(=O)O>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	971	CCCS(=O)(=O)O.O=S(=O)(O)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)O)Cc2ccccc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	972	CCCS(=O)(=O)O.O=S(=O)(O)CCCc1ccc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	973	CCCS(=O)(=O)O.O=S(=O)(O)CCCc1ccc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	974	CCCS(=O)(=O)O.Nc1cccc(CCCCS(=O)(=O)O)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Phe
amine_sulfonation	975	CCCS(=O)(=O)O.Nc1cc2ccc(CCCCS(=O)(=O)O)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)O)cc2cc1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	976	CCCS(=O)(=O)O.Nc1cncc(CCCCS(=O)(=O)O)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	977	CCCS(=O)(=O)O.Nc1cncc(CCCCS(=O)(=O)O)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	978	CCCS(=O)(=O)O.NCCNc1ccncc1CCCCS(=O)(=O)O>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	979	CCCS(=O)(=O)O.NC=CNc1ccncc1CCCCS(=O)(=O)O>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	980	CCCS(=O)(=O)O.O=S(=O)(O)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)O)Cc2ccccc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	981	CCCS(=O)(=O)O.O=S(=O)(O)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)O)Cc2ccncc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	982	CCCS(=O)(=O)O.O=S(=O)(O)CCCc1cnc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	983	CCCS(=O)(=O)O.O=S(=O)(O)CCCc1cnc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	984	CCCS(=O)(=O)O.Nc1occ(CCCCS(=O)(=O)O)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het5
amine_sulfonation	985	CCCS(=O)(=O)O.Nc1oc2c(CCCCS(=O)(=O)O)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)O)occ2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	986	CCCS(=O)(=O)O.Nc1oc2cc(CCCCS(=O)(=O)O)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)O)ncc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	987	CCCS(=O)(=O)O.Nc1oc2ccc(CCCCS(=O)(=O)O)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)O)cc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	988	CCCS(=O)(=O)O.Nc1nccc(CCCCS(=O)(=O)O)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het6
amine_sulfonation	989	CCCS(=O)(=O)O.Nc1c(CCCS(=O)(=O)O)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)O)nc2cocc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	990	CCCS(=O)(=O)O.Nc1ncc2cc(CCCCS(=O)(=O)O)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)O)ncc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	991	CCCS(=O)(=O)O.Nc1ncc2ccc(CCCCS(=O)(=O)O)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)O)cc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	992	CCCS(=O)(=O)O.Nc1c(CCCS(=O)(=O)O)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)O)cc2cocc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	993	CCCS(=O)(=O)O.Nc1cc2cncc(CCCCS(=O)(=O)O)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)O)c2cc1N	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	994	CCCS(=O)(=O)O.NCc1ccccc1CCCCCS(=O)(=O)O>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.Benzylamine_primary
amine_sulfonation	995	CCCS(=O)(=O)O.NCc1cnccc1CCCCCS(=O)(=O)O>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	996	CCCS(=O)(=O)Br.NCCNCCCCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	997	CCCS(=O)(=O)Br.NC=CNCCCCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	998	CCCS(=O)(=O)Br.NC=CNC=CCCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	999	CCCS(=O)(=O)Br.NC1CNCC(CCCCS(=O)(=O)Br)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1000	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCC1CC=CNC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1001	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCC1C=CNC=CC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)Br)C=C1	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1002	CCCS(=O)(=O)Br.NCCNCCCCCS(=O)(=O)Br>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1003	CCCS(=O)(=O)Br.NC=CNCCCCCS(=O)(=O)Br>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1004	CCCS(=O)(=O)Br.Nc1cccc(CCCCS(=O)(=O)Br)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1005	CCCS(=O)(=O)Br.NCCNc1ccccc1CCCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1006	CCCS(=O)(=O)Br.NC=CNc1ccccc1CCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1007	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)Br)Cc2ccccc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1008	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1ccc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1009	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1ccc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1010	CCCS(=O)(=O)Br.Nc1cccc(CCCCS(=O)(=O)Br)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Phe
amine_sulfonation	1011	CCCS(=O)(=O)Br.Nc1cc2ccc(CCCCS(=O)(=O)Br)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)Br)cc2cc1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	1012	CCCS(=O)(=O)Br.Nc1cncc(CCCCS(=O)(=O)Br)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1013	CCCS(=O)(=O)Br.Nc1cncc(CCCCS(=O)(=O)Br)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1014	CCCS(=O)(=O)Br.NCCNc1ccncc1CCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1015	CCCS(=O)(=O)Br.NC=CNc1ccncc1CCCCS(=O)(=O)Br>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1016	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)Br)Cc2ccccc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1017	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)Br)Cc2ccncc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1018	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1cnc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1019	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1cnc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1020	CCCS(=O)(=O)Br.Nc1occ(CCCCS(=O)(=O)Br)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het5
amine_sulfonation	1021	CCCS(=O)(=O)Br.Nc1oc2c(CCCCS(=O)(=O)Br)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)Br)occ2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	1022	CCCS(=O)(=O)Br.Nc1oc2cc(CCCCS(=O)(=O)Br)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)Br)ncc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	1023	CCCS(=O)(=O)Br.Nc1oc2ccc(CCCCS(=O)(=O)Br)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)Br)cc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	1024	CCCS(=O)(=O)Br.Nc1nccc(CCCCS(=O)(=O)Br)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het6
amine_sulfonation	1025	CCCS(=O)(=O)Br.Nc1c(CCCS(=O)(=O)Br)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)Br)nc2cocc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	1026	CCCS(=O)(=O)Br.Nc1ncc2cc(CCCCS(=O)(=O)Br)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)Br)ncc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	1027	CCCS(=O)(=O)Br.Nc1ncc2ccc(CCCCS(=O)(=O)Br)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)Br)cc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	1028	CCCS(=O)(=O)Br.Nc1c(CCCS(=O)(=O)Br)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)Br)cc2cocc2c1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	1029	CCCS(=O)(=O)Br.Nc1cc2cncc(CCCCS(=O)(=O)Br)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)Br)c2cc1N	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	1030	CCCS(=O)(=O)Br.NCc1ccccc1CCCCCS(=O)(=O)Br>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.Benzylamine_primary
amine_sulfonation	1031	CCCS(=O)(=O)Br.NCc1cnccc1CCCCCS(=O)(=O)Br>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	1032	CCCS(=O)(=O)Cl.NCCNCCCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1033	CCCS(=O)(=O)Cl.NC=CNCCCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1034	CCCS(=O)(=O)Cl.NC=CNC=CCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1035	CCCS(=O)(=O)Cl.NC1CNCC(CCCCS(=O)(=O)Cl)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1036	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCC1CC=CNC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1037	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCC1C=CNC=CC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)Cl)C=C1	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1038	CCCS(=O)(=O)Cl.NCCNCCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1039	CCCS(=O)(=O)Cl.NC=CNCCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1040	CCCS(=O)(=O)Cl.Nc1cccc(CCCCS(=O)(=O)Cl)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1041	CCCS(=O)(=O)Cl.NCCNc1ccccc1CCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1042	CCCS(=O)(=O)Cl.NC=CNc1ccccc1CCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1043	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)Cl)Cc2ccccc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1044	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1ccc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1045	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1ccc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1046	CCCS(=O)(=O)Cl.Nc1cccc(CCCCS(=O)(=O)Cl)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Phe
amine_sulfonation	1047	CCCS(=O)(=O)Cl.Nc1cc2ccc(CCCCS(=O)(=O)Cl)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)Cl)cc2cc1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	1048	CCCS(=O)(=O)Cl.Nc1cncc(CCCCS(=O)(=O)Cl)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1049	CCCS(=O)(=O)Cl.Nc1cncc(CCCCS(=O)(=O)Cl)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1050	CCCS(=O)(=O)Cl.NCCNc1ccncc1CCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1051	CCCS(=O)(=O)Cl.NC=CNc1ccncc1CCCCS(=O)(=O)Cl>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1052	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)Cl)Cc2ccccc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1053	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)Cl)Cc2ccncc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1054	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1cnc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1055	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1cnc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1056	CCCS(=O)(=O)Cl.Nc1occ(CCCCS(=O)(=O)Cl)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het5
amine_sulfonation	1057	CCCS(=O)(=O)Cl.Nc1oc2c(CCCCS(=O)(=O)Cl)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)Cl)occ2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	1058	CCCS(=O)(=O)Cl.Nc1oc2cc(CCCCS(=O)(=O)Cl)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)Cl)ncc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	1059	CCCS(=O)(=O)Cl.Nc1oc2ccc(CCCCS(=O)(=O)Cl)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)Cl)cc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	1060	CCCS(=O)(=O)Cl.Nc1nccc(CCCCS(=O)(=O)Cl)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het6
amine_sulfonation	1061	CCCS(=O)(=O)Cl.Nc1c(CCCS(=O)(=O)Cl)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	1062	CCCS(=O)(=O)Cl.Nc1ncc2cc(CCCCS(=O)(=O)Cl)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)Cl)ncc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	1063	CCCS(=O)(=O)Cl.Nc1ncc2ccc(CCCCS(=O)(=O)Cl)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)Cl)cc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	1064	CCCS(=O)(=O)Cl.Nc1c(CCCS(=O)(=O)Cl)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	1065	CCCS(=O)(=O)Cl.Nc1cc2cncc(CCCCS(=O)(=O)Cl)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)Cl)c2cc1N	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	1066	CCCS(=O)(=O)Cl.NCc1ccccc1CCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.Benzylamine_primary
amine_sulfonation	1067	CCCS(=O)(=O)Cl.NCc1cnccc1CCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	1068	CCCS(=O)(=O)F.NCCNCCCCCCS(=O)(=O)F>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1069	CCCS(=O)(=O)F.NC=CNCCCCCCS(=O)(=O)F>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1070	CCCS(=O)(=O)F.NC=CNC=CCCCCS(=O)(=O)F>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1071	CCCS(=O)(=O)F.NC1CNCC(CCCCS(=O)(=O)F)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1072	CCCS(=O)(=O)F.O=S(=O)(F)CCCCC1CC=CNC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1073	CCCS(=O)(=O)F.O=S(=O)(F)CCCCC1C=CNC=CC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)F)C=C1	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1074	CCCS(=O)(=O)F.NCCNCCCCCS(=O)(=O)F>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1075	CCCS(=O)(=O)F.NC=CNCCCCCS(=O)(=O)F>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1076	CCCS(=O)(=O)F.Nc1cccc(CCCCS(=O)(=O)F)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1077	CCCS(=O)(=O)F.NCCNc1ccccc1CCCCCS(=O)(=O)F>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1078	CCCS(=O)(=O)F.NC=CNc1ccccc1CCCCS(=O)(=O)F>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1079	CCCS(=O)(=O)F.O=S(=O)(F)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)F)Cc2ccccc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1080	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1ccc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1081	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1ccc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1082	CCCS(=O)(=O)F.Nc1cccc(CCCCS(=O)(=O)F)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Phe
amine_sulfonation	1083	CCCS(=O)(=O)F.Nc1cc2ccc(CCCCS(=O)(=O)F)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)F)cc2cc1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	1084	CCCS(=O)(=O)F.Nc1cncc(CCCCS(=O)(=O)F)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1085	CCCS(=O)(=O)F.Nc1cncc(CCCCS(=O)(=O)F)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1086	CCCS(=O)(=O)F.NCCNc1ccncc1CCCCS(=O)(=O)F>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1087	CCCS(=O)(=O)F.NC=CNc1ccncc1CCCCS(=O)(=O)F>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1088	CCCS(=O)(=O)F.O=S(=O)(F)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)F)Cc2ccccc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1089	CCCS(=O)(=O)F.O=S(=O)(F)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)F)Cc2ccncc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1090	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1cnc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1091	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1cnc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1092	CCCS(=O)(=O)F.Nc1occ(CCCCS(=O)(=O)F)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het5
amine_sulfonation	1093	CCCS(=O)(=O)F.Nc1oc2c(CCCCS(=O)(=O)F)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)F)occ2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	1094	CCCS(=O)(=O)F.Nc1oc2cc(CCCCS(=O)(=O)F)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)F)ncc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	1095	CCCS(=O)(=O)F.Nc1oc2ccc(CCCCS(=O)(=O)F)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)F)cc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	1096	CCCS(=O)(=O)F.Nc1nccc(CCCCS(=O)(=O)F)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het6
amine_sulfonation	1097	CCCS(=O)(=O)F.Nc1c(CCCS(=O)(=O)F)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)F)nc2cocc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	1098	CCCS(=O)(=O)F.Nc1ncc2cc(CCCCS(=O)(=O)F)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)F)ncc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	1099	CCCS(=O)(=O)F.Nc1ncc2ccc(CCCCS(=O)(=O)F)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)F)cc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	1100	CCCS(=O)(=O)F.Nc1c(CCCS(=O)(=O)F)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)F)cc2cocc2c1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	1101	CCCS(=O)(=O)F.Nc1cc2cncc(CCCCS(=O)(=O)F)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)F)c2cc1N	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	1102	CCCS(=O)(=O)F.NCc1ccccc1CCCCCS(=O)(=O)F>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.Benzylamine_primary
amine_sulfonation	1103	CCCS(=O)(=O)F.NCc1cnccc1CCCCCS(=O)(=O)F>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	1104	CCCS(=O)(=O)I.NCCNCCCCCCS(=O)(=O)I>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1105	CCCS(=O)(=O)I.NC=CNCCCCCCS(=O)(=O)I>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1106	CCCS(=O)(=O)I.NC=CNC=CCCCCS(=O)(=O)I>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1107	CCCS(=O)(=O)I.NC1CNCC(CCCCS(=O)(=O)I)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1108	CCCS(=O)(=O)I.O=S(=O)(I)CCCCC1CC=CNC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1109	CCCS(=O)(=O)I.O=S(=O)(I)CCCCC1C=CNC=CC1>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)I)C=C1	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1110	CCCS(=O)(=O)I.NCCNCCCCCS(=O)(=O)I>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1111	CCCS(=O)(=O)I.NC=CNCCCCCS(=O)(=O)I>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1112	CCCS(=O)(=O)I.Nc1cccc(CCCCS(=O)(=O)I)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1113	CCCS(=O)(=O)I.NCCNc1ccccc1CCCCCS(=O)(=O)I>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1114	CCCS(=O)(=O)I.NC=CNc1ccccc1CCCCS(=O)(=O)I>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1115	CCCS(=O)(=O)I.O=S(=O)(I)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)I)Cc2ccccc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1116	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1ccc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1117	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1ccc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1118	CCCS(=O)(=O)I.Nc1cccc(CCCCS(=O)(=O)I)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Phe
amine_sulfonation	1119	CCCS(=O)(=O)I.Nc1cc2ccc(CCCCS(=O)(=O)I)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)I)cc2cc1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	1120	CCCS(=O)(=O)I.Nc1cncc(CCCCS(=O)(=O)I)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1121	CCCS(=O)(=O)I.Nc1cncc(CCCCS(=O)(=O)I)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1122	CCCS(=O)(=O)I.NCCNc1ccncc1CCCCS(=O)(=O)I>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1123	CCCS(=O)(=O)I.NC=CNc1ccncc1CCCCS(=O)(=O)I>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1124	CCCS(=O)(=O)I.O=S(=O)(I)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)I)Cc2ccccc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1125	CCCS(=O)(=O)I.O=S(=O)(I)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)I)Cc2ccncc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1126	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1cnc2c(c1)NCCC2>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1127	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1cnc2c(c1)NC=CC2>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1128	CCCS(=O)(=O)I.Nc1occ(CCCCS(=O)(=O)I)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het5
amine_sulfonation	1129	CCCS(=O)(=O)I.Nc1oc2c(CCCCS(=O)(=O)I)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)I)occ2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	1130	CCCS(=O)(=O)I.Nc1oc2cc(CCCCS(=O)(=O)I)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)I)ncc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	1131	CCCS(=O)(=O)I.Nc1oc2ccc(CCCCS(=O)(=O)I)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)I)cc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	1132	CCCS(=O)(=O)I.Nc1nccc(CCCCS(=O)(=O)I)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het6
amine_sulfonation	1133	CCCS(=O)(=O)I.Nc1c(CCCS(=O)(=O)I)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)I)nc2cocc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	1134	CCCS(=O)(=O)I.Nc1ncc2cc(CCCCS(=O)(=O)I)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)I)ncc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	1135	CCCS(=O)(=O)I.Nc1ncc2ccc(CCCCS(=O)(=O)I)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)I)cc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	1136	CCCS(=O)(=O)I.Nc1c(CCCS(=O)(=O)I)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)I)cc2cocc2c1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	1137	CCCS(=O)(=O)I.Nc1cc2cncc(CCCCS(=O)(=O)I)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)I)c2cc1N	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	1138	CCCS(=O)(=O)I.NCc1ccccc1CCCCCS(=O)(=O)I>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.Benzylamine_primary
amine_sulfonation	1139	CCCS(=O)(=O)I.NCc1cnccc1CCCCCS(=O)(=O)I>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	1140	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(CCN)CCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1141	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(C=CN)CCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1142	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(C=CN)C=CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1143	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C1>>CCCS(=O)(=O)N1CC(N)CC(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1144	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCC1CC=CNC1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1145	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCC1C=CNC=CC1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1C=CCC(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1146	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)NCCNCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1147	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)NC=CNCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1148	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1149	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(CCN)c1ccccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1150	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(C=CN)c1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1151	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCC1CCc2ccccc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1c2ccccc2CCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1152	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1ccc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1CCCc2ccc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1153	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1ccc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1C=CCc2ccc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1154	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCS(=O)(=O)Nc1cccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Phe
amine_sulfonation	1155	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>CCCS(=O)(=O)Nc1cc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_PhePhe
amine_sulfonation	1156	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCCS(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1157	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>CCCS(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1158	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(CCN)c1ccncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1159	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N(C=CN)c1ccncc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1160	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCC1CCc2ccncc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1c2cnccc2CCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1161	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCC1CCc2cnccc2Nc2cnccc2C1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1c2ccncc2CCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1162	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1cnc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1CCCc2ncc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1163	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1cnc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)N1C=CCc2ncc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1164	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCS(=O)(=O)Nc1occ(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het5
amine_sulfonation	1165	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>CCCS(=O)(=O)Nc1oc2c(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het5Het5
amine_sulfonation	1166	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCCS(=O)(=O)Nc1oc2cc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het5Het6
amine_sulfonation	1167	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCCS(=O)(=O)Nc1oc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het5Phe
amine_sulfonation	1168	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCS(=O)(=O)Nc1nccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het6
amine_sulfonation	1169	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het6Het5
amine_sulfonation	1170	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCCS(=O)(=O)Nc1ncc2cc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het6Het6
amine_sulfonation	1171	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCCS(=O)(=O)Nc1ncc2ccc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_Het6Phe
amine_sulfonation	1172	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>CCCS(=O)(=O)Nc1c(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_PheHet5
amine_sulfonation	1173	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>CCCS(=O)(=O)Nc1cc2cncc(CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Amine_Primary_PheHet6
amine_sulfonation	1174	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)NCc1ccccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.Benzylamine_primary
amine_sulfonation	1175	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)NCc1cnccc1CCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aliphatic.HeteroBenzylamine_primary
amine_sulfonation	1176	CCCc1ccccc1S(=O)(=O)O.NCCNCCCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(CCN)CCCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1177	CCCc1ccccc1S(=O)(=O)O.NC=CNCCCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(C=CN)CCCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1178	CCCc1ccccc1S(=O)(=O)O.NC=CNC=CCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1179	CCCc1ccccc1S(=O)(=O)O.NC1CNCC(CCCCc2ccccc2S(=O)(=O)O)C1>>CCCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCCc2ccccc2S(=O)(=O)O)C1	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1180	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCCC1CC=CNC1>>CCCc1ccccc1S(=O)(=O)N1C=CCC(CCCCc2ccccc2S(=O)(=O)O)C1	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1181	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCCC1C=CNC=CC1>>CCCc1ccccc1S(=O)(=O)N1C=CCC(CCCCc2ccccc2S(=O)(=O)O)C=C1	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1182	CCCc1ccccc1S(=O)(=O)O.NCCNCCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)NCCNCCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1183	CCCc1ccccc1S(=O)(=O)O.NC=CNCCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)NC=CNCCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1184	CCCc1ccccc1S(=O)(=O)O.Nc1cccc(CCCCc2ccccc2S(=O)(=O)O)c1Nc1ccccc1>>CCCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1185	CCCc1ccccc1S(=O)(=O)O.NCCNc1ccccc1CCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1186	CCCc1ccccc1S(=O)(=O)O.NC=CNc1ccccc1CCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1187	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCCc2ccccc2S(=O)(=O)O)Cc2ccccc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1188	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCc1ccc2c(c1)NCCC2>>CCCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCCc3ccccc3S(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1189	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCc1ccc2c(c1)NC=CC2>>CCCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCCc3ccccc3S(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1190	CCCc1ccccc1S(=O)(=O)O.Nc1cccc(CCCCc2ccccc2S(=O)(=O)O)c1N>>CCCc1ccccc1S(=O)(=O)Nc1cccc(CCCCc2ccccc2S(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Phe
amine_sulfonation	1191	CCCc1ccccc1S(=O)(=O)O.Nc1cc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2cc1N>>CCCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2cc1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1192	CCCc1ccccc1S(=O)(=O)O.Nc1cncc(CCCCc2ccccc2S(=O)(=O)O)c1Nc1ccccc1>>CCCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1193	CCCc1ccccc1S(=O)(=O)O.Nc1cncc(CCCCc2ccccc2S(=O)(=O)O)c1Nc1cccnc1>>CCCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1194	CCCc1ccccc1S(=O)(=O)O.NCCNc1ccncc1CCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1195	CCCc1ccccc1S(=O)(=O)O.NC=CNc1ccncc1CCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1196	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCCc2ccccc2S(=O)(=O)O)Cc2ccccc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1197	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCCc2ccccc2S(=O)(=O)O)Cc2ccncc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1198	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCc1cnc2c(c1)NCCC2>>CCCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCCc3ccccc3S(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1199	CCCc1ccccc1S(=O)(=O)O.O=S(=O)(O)c1ccccc1CCCc1cnc2c(c1)NC=CC2>>CCCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCCc3ccccc3S(=O)(=O)O)cc21	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonic_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1200	CCCc1ccccc1S(=O)(=O)O.Nc1occ(CCCCc2ccccc2S(=O)(=O)O)c1N>>CCCc1ccccc1S(=O)(=O)Nc1occ(CCCCc2ccccc2S(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het5
amine_sulfonation	1201	CCCc1ccccc1S(=O)(=O)O.Nc1oc2c(CCCCc3ccccc3S(=O)(=O)O)occ2c1N>>CCCc1ccccc1S(=O)(=O)Nc1oc2c(CCCCc3ccccc3S(=O)(=O)O)occ2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1202	CCCc1ccccc1S(=O)(=O)O.Nc1oc2cc(CCCCc3ccccc3S(=O)(=O)O)ncc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCCc3ccccc3S(=O)(=O)O)ncc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1203	CCCc1ccccc1S(=O)(=O)O.Nc1oc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1204	CCCc1ccccc1S(=O)(=O)O.Nc1nccc(CCCCc2ccccc2S(=O)(=O)O)c1N>>CCCc1ccccc1S(=O)(=O)Nc1nccc(CCCCc2ccccc2S(=O)(=O)O)c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het6
amine_sulfonation	1205	CCCc1ccccc1S(=O)(=O)O.Nc1c(CCCc2ccccc2S(=O)(=O)O)nc2cocc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1c(CCCc2ccccc2S(=O)(=O)O)nc2cocc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1206	CCCc1ccccc1S(=O)(=O)O.Nc1ncc2cc(CCCCc3ccccc3S(=O)(=O)O)ncc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCCc3ccccc3S(=O)(=O)O)ncc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1207	CCCc1ccccc1S(=O)(=O)O.Nc1ncc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCCc3ccccc3S(=O)(=O)O)cc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1208	CCCc1ccccc1S(=O)(=O)O.Nc1c(CCCc2ccccc2S(=O)(=O)O)cc2cocc2c1N>>CCCc1ccccc1S(=O)(=O)Nc1c(CCCc2ccccc2S(=O)(=O)O)cc2cocc2c1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1209	CCCc1ccccc1S(=O)(=O)O.Nc1cc2cncc(CCCCc3ccccc3S(=O)(=O)O)c2cc1N>>CCCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCCc3ccccc3S(=O)(=O)O)c2cc1N	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1210	CCCc1ccccc1S(=O)(=O)O.NCc1ccccc1CCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.Benzylamine_primary
amine_sulfonation	1211	CCCc1ccccc1S(=O)(=O)O.NCc1cnccc1CCCCCc1ccccc1S(=O)(=O)O>>CCCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCCc1ccccc1S(=O)(=O)O	[O;$([O;D1][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonic_Aromatic.HeteroBenzylamine_primary
amine_sulfonation	1212	CCc1ccccc1S(=O)(=O)Br.NCCNCCCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(CCN)CCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1213	CCc1ccccc1S(=O)(=O)Br.NC=CNCCCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(C=CN)CCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1214	CCc1ccccc1S(=O)(=O)Br.NC=CNC=CCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1215	CCc1ccccc1S(=O)(=O)Br.NC1CNCC(CCCc2ccccc2S(=O)(=O)Br)C1>>CCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCc2ccccc2S(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1216	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCC1CC=CNC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1217	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)Br)C=C1	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1218	CCc1ccccc1S(=O)(=O)Br.NCCNCCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)NCCNCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1219	CCc1ccccc1S(=O)(=O)Br.NC=CNCCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)NC=CNCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1220	CCc1ccccc1S(=O)(=O)Br.Nc1cccc(CCCc2ccccc2S(=O)(=O)Br)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1221	CCc1ccccc1S(=O)(=O)Br.NCCNc1ccccc1CCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1222	CCc1ccccc1S(=O)(=O)Br.NC=CNc1ccccc1CCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1223	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCc2ccccc2S(=O)(=O)Br)Cc2ccccc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1224	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCc3ccccc3S(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1225	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCc3ccccc3S(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1226	CCc1ccccc1S(=O)(=O)Br.Nc1cccc(CCCc2ccccc2S(=O)(=O)Br)c1N>>CCc1ccccc1S(=O)(=O)Nc1cccc(CCCc2ccccc2S(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Phe
amine_sulfonation	1227	CCc1ccccc1S(=O)(=O)Br.Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2cc1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1228	CCc1ccccc1S(=O)(=O)Br.Nc1cncc(CCCc2ccccc2S(=O)(=O)Br)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1229	CCc1ccccc1S(=O)(=O)Br.Nc1cncc(CCCc2ccccc2S(=O)(=O)Br)c1Nc1cccnc1>>CCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1230	CCc1ccccc1S(=O)(=O)Br.NCCNc1ccncc1CCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1231	CCc1ccccc1S(=O)(=O)Br.NC=CNc1ccncc1CCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1232	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCc2ccccc2S(=O)(=O)Br)Cc2ccccc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1233	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCc2ccccc2S(=O)(=O)Br)Cc2ccncc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1234	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCc3ccccc3S(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1235	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCc3ccccc3S(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1236	CCc1ccccc1S(=O)(=O)Br.Nc1occ(CCCc2ccccc2S(=O)(=O)Br)c1N>>CCc1ccccc1S(=O)(=O)Nc1occ(CCCc2ccccc2S(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het5
amine_sulfonation	1237	CCc1ccccc1S(=O)(=O)Br.Nc1oc2c(CCCc3ccccc3S(=O)(=O)Br)occ2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2c(CCCc3ccccc3S(=O)(=O)Br)occ2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1238	CCc1ccccc1S(=O)(=O)Br.Nc1oc2cc(CCCc3ccccc3S(=O)(=O)Br)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCc3ccccc3S(=O)(=O)Br)ncc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1239	CCc1ccccc1S(=O)(=O)Br.Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1240	CCc1ccccc1S(=O)(=O)Br.Nc1nccc(CCCc2ccccc2S(=O)(=O)Br)c1N>>CCc1ccccc1S(=O)(=O)Nc1nccc(CCCc2ccccc2S(=O)(=O)Br)c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het6
amine_sulfonation	1241	CCc1ccccc1S(=O)(=O)Br.Nc1c(CCc2ccccc2S(=O)(=O)Br)nc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)Br)nc2cocc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1242	CCc1ccccc1S(=O)(=O)Br.Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)Br)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)Br)ncc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1243	CCc1ccccc1S(=O)(=O)Br.Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)Br)cc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1244	CCc1ccccc1S(=O)(=O)Br.Nc1c(CCc2ccccc2S(=O)(=O)Br)cc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)Br)cc2cocc2c1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1245	CCc1ccccc1S(=O)(=O)Br.Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)Br)c2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)Br)c2cc1N	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1246	CCc1ccccc1S(=O)(=O)Br.NCc1ccccc1CCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.Benzylamine_primary
amine_sulfonation	1247	CCc1ccccc1S(=O)(=O)Br.NCc1cnccc1CCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Bromide_Aromatic.HeteroBenzylamine_primary
amine_sulfonation	1248	CCc1ccccc1S(=O)(=O)Cl.NCCNCCCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(CCN)CCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1249	CCc1ccccc1S(=O)(=O)Cl.NC=CNCCCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(C=CN)CCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1250	CCc1ccccc1S(=O)(=O)Cl.NC=CNC=CCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1251	CCc1ccccc1S(=O)(=O)Cl.NC1CNCC(CCCc2ccccc2S(=O)(=O)Cl)C1>>CCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCc2ccccc2S(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1252	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCC1CC=CNC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1253	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)Cl)C=C1	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1254	CCc1ccccc1S(=O)(=O)Cl.NCCNCCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)NCCNCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1255	CCc1ccccc1S(=O)(=O)Cl.NC=CNCCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)NC=CNCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1256	CCc1ccccc1S(=O)(=O)Cl.Nc1cccc(CCCc2ccccc2S(=O)(=O)Cl)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1257	CCc1ccccc1S(=O)(=O)Cl.NCCNc1ccccc1CCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1258	CCc1ccccc1S(=O)(=O)Cl.NC=CNc1ccccc1CCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1259	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCc2ccccc2S(=O)(=O)Cl)Cc2ccccc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1260	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCc3ccccc3S(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1261	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCc3ccccc3S(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1262	CCc1ccccc1S(=O)(=O)Cl.Nc1cccc(CCCc2ccccc2S(=O)(=O)Cl)c1N>>CCc1ccccc1S(=O)(=O)Nc1cccc(CCCc2ccccc2S(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Phe
amine_sulfonation	1263	CCc1ccccc1S(=O)(=O)Cl.Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2cc1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1264	CCc1ccccc1S(=O)(=O)Cl.Nc1cncc(CCCc2ccccc2S(=O)(=O)Cl)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1265	CCc1ccccc1S(=O)(=O)Cl.Nc1cncc(CCCc2ccccc2S(=O)(=O)Cl)c1Nc1cccnc1>>CCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1266	CCc1ccccc1S(=O)(=O)Cl.NCCNc1ccncc1CCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1267	CCc1ccccc1S(=O)(=O)Cl.NC=CNc1ccncc1CCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1268	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCc2ccccc2S(=O)(=O)Cl)Cc2ccccc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1269	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCc2ccccc2S(=O)(=O)Cl)Cc2ccncc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1270	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCc3ccccc3S(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1271	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCc3ccccc3S(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1272	CCc1ccccc1S(=O)(=O)Cl.Nc1occ(CCCc2ccccc2S(=O)(=O)Cl)c1N>>CCc1ccccc1S(=O)(=O)Nc1occ(CCCc2ccccc2S(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het5
amine_sulfonation	1273	CCc1ccccc1S(=O)(=O)Cl.Nc1oc2c(CCCc3ccccc3S(=O)(=O)Cl)occ2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2c(CCCc3ccccc3S(=O)(=O)Cl)occ2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1274	CCc1ccccc1S(=O)(=O)Cl.Nc1oc2cc(CCCc3ccccc3S(=O)(=O)Cl)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCc3ccccc3S(=O)(=O)Cl)ncc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1275	CCc1ccccc1S(=O)(=O)Cl.Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1276	CCc1ccccc1S(=O)(=O)Cl.Nc1nccc(CCCc2ccccc2S(=O)(=O)Cl)c1N>>CCc1ccccc1S(=O)(=O)Nc1nccc(CCCc2ccccc2S(=O)(=O)Cl)c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het6
amine_sulfonation	1277	CCc1ccccc1S(=O)(=O)Cl.Nc1c(CCc2ccccc2S(=O)(=O)Cl)nc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1278	CCc1ccccc1S(=O)(=O)Cl.Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)Cl)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)Cl)ncc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1279	CCc1ccccc1S(=O)(=O)Cl.Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)Cl)cc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1280	CCc1ccccc1S(=O)(=O)Cl.Nc1c(CCc2ccccc2S(=O)(=O)Cl)cc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1281	CCc1ccccc1S(=O)(=O)Cl.Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)Cl)c2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)Cl)c2cc1N	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1282	CCc1ccccc1S(=O)(=O)Cl.NCc1ccccc1CCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.Benzylamine_primary
amine_sulfonation	1283	CCc1ccccc1S(=O)(=O)Cl.NCc1cnccc1CCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Chloride_Aromatic.HeteroBenzylamine_primary
amine_sulfonation	1284	CCc1ccccc1S(=O)(=O)F.NCCNCCCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(CCN)CCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1285	CCc1ccccc1S(=O)(=O)F.NC=CNCCCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(C=CN)CCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1286	CCc1ccccc1S(=O)(=O)F.NC=CNC=CCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1287	CCc1ccccc1S(=O)(=O)F.NC1CNCC(CCCc2ccccc2S(=O)(=O)F)C1>>CCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCc2ccccc2S(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1288	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCC1CC=CNC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1289	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)F)C=C1	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1290	CCc1ccccc1S(=O)(=O)F.NCCNCCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)NCCNCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1291	CCc1ccccc1S(=O)(=O)F.NC=CNCCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)NC=CNCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1292	CCc1ccccc1S(=O)(=O)F.Nc1cccc(CCCc2ccccc2S(=O)(=O)F)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1293	CCc1ccccc1S(=O)(=O)F.NCCNc1ccccc1CCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1294	CCc1ccccc1S(=O)(=O)F.NC=CNc1ccccc1CCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1295	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCc2ccccc2S(=O)(=O)F)Cc2ccccc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1296	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCc3ccccc3S(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1297	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCc3ccccc3S(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1298	CCc1ccccc1S(=O)(=O)F.Nc1cccc(CCCc2ccccc2S(=O)(=O)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1cccc(CCCc2ccccc2S(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Phe
amine_sulfonation	1299	CCc1ccccc1S(=O)(=O)F.Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2cc1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1300	CCc1ccccc1S(=O)(=O)F.Nc1cncc(CCCc2ccccc2S(=O)(=O)F)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1301	CCc1ccccc1S(=O)(=O)F.Nc1cncc(CCCc2ccccc2S(=O)(=O)F)c1Nc1cccnc1>>CCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1302	CCc1ccccc1S(=O)(=O)F.NCCNc1ccncc1CCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1303	CCc1ccccc1S(=O)(=O)F.NC=CNc1ccncc1CCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1304	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCc2ccccc2S(=O)(=O)F)Cc2ccccc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1305	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCc2ccccc2S(=O)(=O)F)Cc2ccncc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1306	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCc3ccccc3S(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1307	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCc3ccccc3S(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1308	CCc1ccccc1S(=O)(=O)F.Nc1occ(CCCc2ccccc2S(=O)(=O)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1occ(CCCc2ccccc2S(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het5
amine_sulfonation	1309	CCc1ccccc1S(=O)(=O)F.Nc1oc2c(CCCc3ccccc3S(=O)(=O)F)occ2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2c(CCCc3ccccc3S(=O)(=O)F)occ2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1310	CCc1ccccc1S(=O)(=O)F.Nc1oc2cc(CCCc3ccccc3S(=O)(=O)F)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCc3ccccc3S(=O)(=O)F)ncc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1311	CCc1ccccc1S(=O)(=O)F.Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1312	CCc1ccccc1S(=O)(=O)F.Nc1nccc(CCCc2ccccc2S(=O)(=O)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1nccc(CCCc2ccccc2S(=O)(=O)F)c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het6
amine_sulfonation	1313	CCc1ccccc1S(=O)(=O)F.Nc1c(CCc2ccccc2S(=O)(=O)F)nc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)F)nc2cocc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1314	CCc1ccccc1S(=O)(=O)F.Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)F)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)F)ncc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1315	CCc1ccccc1S(=O)(=O)F.Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)F)cc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1316	CCc1ccccc1S(=O)(=O)F.Nc1c(CCc2ccccc2S(=O)(=O)F)cc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)F)cc2cocc2c1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1317	CCc1ccccc1S(=O)(=O)F.Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)F)c2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)F)c2cc1N	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1318	CCc1ccccc1S(=O)(=O)F.NCc1ccccc1CCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.Benzylamine_primary
amine_sulfonation	1319	CCc1ccccc1S(=O)(=O)F.NCc1cnccc1CCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Fluoride_Aromatic.HeteroBenzylamine_primary
amine_sulfonation	1320	CCc1ccccc1S(=O)(=O)I.NCCNCCCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(CCN)CCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1321	CCc1ccccc1S(=O)(=O)I.NC=CNCCCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(C=CN)CCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1322	CCc1ccccc1S(=O)(=O)I.NC=CNC=CCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1323	CCc1ccccc1S(=O)(=O)I.NC1CNCC(CCCc2ccccc2S(=O)(=O)I)C1>>CCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCc2ccccc2S(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1324	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCC1CC=CNC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1325	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)I)C=C1	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1326	CCc1ccccc1S(=O)(=O)I.NCCNCCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)NCCNCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1327	CCc1ccccc1S(=O)(=O)I.NC=CNCCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)NC=CNCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1328	CCc1ccccc1S(=O)(=O)I.Nc1cccc(CCCc2ccccc2S(=O)(=O)I)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1329	CCc1ccccc1S(=O)(=O)I.NCCNc1ccccc1CCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1330	CCc1ccccc1S(=O)(=O)I.NC=CNc1ccccc1CCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1331	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCc2ccccc2S(=O)(=O)I)Cc2ccccc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1332	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCc3ccccc3S(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1333	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCc3ccccc3S(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1334	CCc1ccccc1S(=O)(=O)I.Nc1cccc(CCCc2ccccc2S(=O)(=O)I)c1N>>CCc1ccccc1S(=O)(=O)Nc1cccc(CCCc2ccccc2S(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Phe
amine_sulfonation	1335	CCc1ccccc1S(=O)(=O)I.Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2cc1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1336	CCc1ccccc1S(=O)(=O)I.Nc1cncc(CCCc2ccccc2S(=O)(=O)I)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1337	CCc1ccccc1S(=O)(=O)I.Nc1cncc(CCCc2ccccc2S(=O)(=O)I)c1Nc1cccnc1>>CCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1338	CCc1ccccc1S(=O)(=O)I.NCCNc1ccncc1CCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1339	CCc1ccccc1S(=O)(=O)I.NC=CNc1ccncc1CCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1340	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCc2ccccc2S(=O)(=O)I)Cc2ccccc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1341	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCc2ccccc2S(=O)(=O)I)Cc2ccncc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1342	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCc3ccccc3S(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1343	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCc3ccccc3S(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1344	CCc1ccccc1S(=O)(=O)I.Nc1occ(CCCc2ccccc2S(=O)(=O)I)c1N>>CCc1ccccc1S(=O)(=O)Nc1occ(CCCc2ccccc2S(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het5
amine_sulfonation	1345	CCc1ccccc1S(=O)(=O)I.Nc1oc2c(CCCc3ccccc3S(=O)(=O)I)occ2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2c(CCCc3ccccc3S(=O)(=O)I)occ2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1346	CCc1ccccc1S(=O)(=O)I.Nc1oc2cc(CCCc3ccccc3S(=O)(=O)I)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCc3ccccc3S(=O)(=O)I)ncc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1347	CCc1ccccc1S(=O)(=O)I.Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1348	CCc1ccccc1S(=O)(=O)I.Nc1nccc(CCCc2ccccc2S(=O)(=O)I)c1N>>CCc1ccccc1S(=O)(=O)Nc1nccc(CCCc2ccccc2S(=O)(=O)I)c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het6
amine_sulfonation	1349	CCc1ccccc1S(=O)(=O)I.Nc1c(CCc2ccccc2S(=O)(=O)I)nc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)I)nc2cocc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1350	CCc1ccccc1S(=O)(=O)I.Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)I)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)I)ncc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1351	CCc1ccccc1S(=O)(=O)I.Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)I)cc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1352	CCc1ccccc1S(=O)(=O)I.Nc1c(CCc2ccccc2S(=O)(=O)I)cc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)I)cc2cocc2c1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1353	CCc1ccccc1S(=O)(=O)I.Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)I)c2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)I)c2cc1N	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1354	CCc1ccccc1S(=O)(=O)I.NCc1ccccc1CCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.Benzylamine_primary
amine_sulfonation	1355	CCc1ccccc1S(=O)(=O)I.NCc1cnccc1CCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Iodide_Aromatic.HeteroBenzylamine_primary
amine_sulfonation	1356	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(CCN)CCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1357	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(C=CN)CCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1358	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(C=CN)C=CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1359	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C1>>CCc1ccccc1S(=O)(=O)N1CC(N)CC(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_sulfonation	1360	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCC1CC=CNC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1361	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1S(=O)(=O)N1C=CCC(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_sulfonation	1362	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)NCCNCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_SaturatedAliphatic
amine_sulfonation	1363	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)NC=CNCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_sulfonation	1364	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1365	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1366	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1367	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccccc2CCC(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_sulfonation	1368	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ccc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_sulfonation	1369	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ccc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_sulfonation	1370	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1cccc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Phe
amine_sulfonation	1371	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_PhePhe
amine_sulfonation	1372	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCc1ccccc1S(=O)(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1373	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>CCc1ccccc1S(=O)(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1374	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(CCN)c1ccncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1375	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)N(C=CN)c1ccncc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1376	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1S(=O)(=O)N1c2cnccc2CCC(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_sulfonation	1377	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1S(=O)(=O)N1c2ccncc2CCC(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_sulfonation	1378	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1S(=O)(=O)N1CCCc2ncc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_sulfonation	1379	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1S(=O)(=O)N1C=CCc2ncc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	Sulfonyl-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_sulfonation	1380	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1occ(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het5
amine_sulfonation	1381	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2c(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het5Het5
amine_sulfonation	1382	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2cc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het5Het6
amine_sulfonation	1383	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1oc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het5Phe
amine_sulfonation	1384	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCc1ccccc1S(=O)(=O)Nc1nccc(CCCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het6
amine_sulfonation	1385	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het6Het5
amine_sulfonation	1386	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2cc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het6Het6
amine_sulfonation	1387	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCc1ccccc1S(=O)(=O)Nc1ncc2ccc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_Het6Phe
amine_sulfonation	1388	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>CCc1ccccc1S(=O)(=O)Nc1c(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_PheHet5
amine_sulfonation	1389	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>CCc1ccccc1S(=O)(=O)Nc1cc2cncc(CCCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Amine_Primary_PheHet6
amine_sulfonation	1390	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)NCc1ccccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.Benzylamine_primary
amine_sulfonation	1391	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)NCc1cnccc1CCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	Sulfonyl-Triflate_Aromatic.HeteroBenzylamine_primary
snar_thiol	1392	Cc1ccccc1Br.SCCCCCc1ccccc1Br>>Cc1ccccc1SCCCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.PrimaryThiolAliphatic
snar_thiol	1393	Cc1ccccc1Br.SCc1ccccc1CCc1ccccc1Br>>Cc1ccccc1SCc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.PrimaryThiolAromatic
snar_thiol	1394	Cc1ccccc1Br.CCC(S)CCCCc1ccccc1Br>>CCC(CCCCc1ccccc1Br)Sc1ccccc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1395	Cc1ccccc1Br.SC1C2CCCCC2C2CCC(Cc3ccccc3Br)CC12>>Cc1ccccc1SC1C2CCCCC2C2CCC(Cc3ccccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1396	Cc1ccccc1Br.SC(c1ccccc1)c1ccccc1CCc1ccccc1Br>>Cc1ccccc1SC(c1ccccc1)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1397	Cc1ccccc1Br.SC1c2ccccc2-c2ccc(Cc3ccccc3Br)cc21>>Cc1ccccc1SC1c2ccccc2c2ccc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolAromaticCyclic
snar_thiol	1398	Cc1ccccc1Br.CCCC(S)c1ccccc1CCc1ccccc1Br>>CCCC(Sc1ccccc1C)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolMixAcyclic
snar_thiol	1399	Cc1ccccc1Br.SC1c2cc(Cc3ccccc3Br)ccc2C2CCCCC12>>Cc1ccccc1SC1c2cc(Cc3ccccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.SecondaryThiolMixCyclic
snar_thiol	1400	Cc1ccccc1Br.CC(Cc1ccccc1Br)CC(C)(C)S>>Cc1ccccc1SC(C)(C)CC(C)Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.TertiaryThiolAcyclic
snar_thiol	1401	Cc1ccccc1Br.CC1(S)CCCC(Cc2ccccc2Br)C1>>Cc1ccccc1SC1(C)CCCC(Cc2ccccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.TertiaryThiolCyclic
snar_thiol	1402	Cc1ccccc1Br.Sc1ccccc1CCc1ccccc1Br>>Cc1ccccc1Sc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.Thiophenol
snar_thiol	1403	Cc1ccccc1Br.Sc1occc1CCc1ccccc1Br>>Cc1ccccc1Sc1occc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1404	Cc1ccccc1Br.Sc1ncccc1CCc1ccccc1Br>>Cc1ccccc1Sc1ncccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1405	Cc1c(Br)ccc2ccccc12.SCCCCCc1c(Br)ccc2ccccc12>>Cc1c(SCCCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.PrimaryThiolAliphatic
snar_thiol	1406	Cc1c(Br)ccc2ccccc12.SCc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.PrimaryThiolAromatic
snar_thiol	1407	Cc1c(Br)ccc2ccccc12.CCC(S)CCCCc1c(Br)ccc2ccccc12>>CCC(CCCCc1c(Br)ccc2ccccc12)Sc1ccc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolAliphaticAcyclic
snar_thiol	1408	Cc1c(Br)ccc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(Br)ccc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)ccc5ccccc45)CC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolAliphaticCyclic
snar_thiol	1409	Cc1c(Br)ccc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolAromaticAcyclic
snar_thiol	1410	Cc1c(Br)ccc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(Br)ccc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolAromaticCyclic
snar_thiol	1411	Cc1c(Br)ccc2ccccc12.CCCC(S)c1ccccc1CCc1c(Br)ccc2ccccc12>>CCCC(Sc1ccc2ccccc2c1C)c1ccccc1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolMixAcyclic
snar_thiol	1412	Cc1c(Br)ccc2ccccc12.SC1c2cc(Cc3c(Br)ccc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.SecondaryThiolMixCyclic
snar_thiol	1413	Cc1c(Br)ccc2ccccc12.CC(Cc1c(Br)ccc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.TertiaryThiolAcyclic
snar_thiol	1414	Cc1c(Br)ccc2ccccc12.CC1(S)CCCC(Cc2c(Br)ccc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)ccc4ccccc34)C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.TertiaryThiolCyclic
snar_thiol	1415	Cc1c(Br)ccc2ccccc12.Sc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.Thiophenol
snar_thiol	1416	Cc1c(Br)ccc2ccccc12.Sc1occc1CCc1c(Br)ccc2ccccc12>>Cc1c(Sc2occc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.ThiophenolHeteroaromatic5membered
snar_thiol	1417	Cc1c(Br)ccc2ccccc12.Sc1ncccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PhePhe.ThiophenolHeteroaromatic6membered
snar_thiol	1418	Cc1ccccc1I.SCCCCCc1ccccc1I>>Cc1ccccc1SCCCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.PrimaryThiolAliphatic
snar_thiol	1419	Cc1ccccc1I.SCc1ccccc1CCc1ccccc1I>>Cc1ccccc1SCc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.PrimaryThiolAromatic
snar_thiol	1420	Cc1ccccc1I.CCC(S)CCCCc1ccccc1I>>CCC(CCCCc1ccccc1I)Sc1ccccc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1421	Cc1ccccc1I.SC1C2CCCCC2C2CCC(Cc3ccccc3I)CC12>>Cc1ccccc1SC1C2CCCCC2C2CCC(Cc3ccccc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1422	Cc1ccccc1I.SC(c1ccccc1)c1ccccc1CCc1ccccc1I>>Cc1ccccc1SC(c1ccccc1)c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1423	Cc1ccccc1I.SC1c2ccccc2-c2ccc(Cc3ccccc3I)cc21>>Cc1ccccc1SC1c2ccccc2c2ccc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolAromaticCyclic
snar_thiol	1424	Cc1ccccc1I.CCCC(S)c1ccccc1CCc1ccccc1I>>CCCC(Sc1ccccc1C)c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolMixAcyclic
snar_thiol	1425	Cc1ccccc1I.SC1c2cc(Cc3ccccc3I)ccc2C2CCCCC12>>Cc1ccccc1SC1c2cc(Cc3ccccc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.SecondaryThiolMixCyclic
snar_thiol	1426	Cc1ccccc1I.CC(Cc1ccccc1I)CC(C)(C)S>>Cc1ccccc1SC(C)(C)CC(C)Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.TertiaryThiolAcyclic
snar_thiol	1427	Cc1ccccc1I.CC1(S)CCCC(Cc2ccccc2I)C1>>Cc1ccccc1SC1(C)CCCC(Cc2ccccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.TertiaryThiolCyclic
snar_thiol	1428	Cc1ccccc1I.Sc1ccccc1CCc1ccccc1I>>Cc1ccccc1Sc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.Thiophenol
snar_thiol	1429	Cc1ccccc1I.Sc1occc1CCc1ccccc1I>>Cc1ccccc1Sc1occc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1430	Cc1ccccc1I.Sc1ncccc1CCc1ccccc1I>>Cc1ccccc1Sc1ncccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1431	Cc1c(I)ccc2ccccc12.SCCCCCc1c(I)ccc2ccccc12>>Cc1c(SCCCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.PrimaryThiolAliphatic
snar_thiol	1432	Cc1c(I)ccc2ccccc12.SCc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.PrimaryThiolAromatic
snar_thiol	1433	Cc1c(I)ccc2ccccc12.CCC(S)CCCCc1c(I)ccc2ccccc12>>CCC(CCCCc1c(I)ccc2ccccc12)Sc1ccc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolAliphaticAcyclic
snar_thiol	1434	Cc1c(I)ccc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(I)ccc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)ccc5ccccc45)CC32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolAliphaticCyclic
snar_thiol	1435	Cc1c(I)ccc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolAromaticAcyclic
snar_thiol	1436	Cc1c(I)ccc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(I)ccc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolAromaticCyclic
snar_thiol	1437	Cc1c(I)ccc2ccccc12.CCCC(S)c1ccccc1CCc1c(I)ccc2ccccc12>>CCCC(Sc1ccc2ccccc2c1C)c1ccccc1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolMixAcyclic
snar_thiol	1438	Cc1c(I)ccc2ccccc12.SC1c2cc(Cc3c(I)ccc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.SecondaryThiolMixCyclic
snar_thiol	1439	Cc1c(I)ccc2ccccc12.CC(Cc1c(I)ccc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.TertiaryThiolAcyclic
snar_thiol	1440	Cc1c(I)ccc2ccccc12.CC1(S)CCCC(Cc2c(I)ccc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)ccc4ccccc34)C2)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.TertiaryThiolCyclic
snar_thiol	1441	Cc1c(I)ccc2ccccc12.Sc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.Thiophenol
snar_thiol	1442	Cc1c(I)ccc2ccccc12.Sc1occc1CCc1c(I)ccc2ccccc12>>Cc1c(Sc2occc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.ThiophenolHeteroaromatic5membered
snar_thiol	1443	Cc1c(I)ccc2ccccc12.Sc1ncccc1CCc1c(I)ccc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PhePhe.ThiophenolHeteroaromatic6membered
snar_thiol	1444	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCCCCS)c1)C(F)(F)F>>Cc1cccc(SCCCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.PrimaryThiolAliphatic
snar_thiol	1445	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2CS)c1)C(F)(F)F>>Cc1cccc(SCc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.PrimaryThiolAromatic
snar_thiol	1446	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CCC(S)CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCC(CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1)Sc1cccc(C)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1447	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCC3C(C2)C(S)C2CCCCC23)c1)C(F)(F)F>>Cc1cccc(SC2C3CCCCC3C3CCC(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)CC32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1448	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2C(S)c2ccccc2)c1)C(F)(F)F>>Cc1cccc(SC(c2ccccc2)c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1449	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)C(S)c2ccccc2-3)c1)C(F)(F)F>>Cc1cccc(SC2c3ccccc3c3ccc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolAromaticCyclic
snar_thiol	1450	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CCCC(S)c1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCCC(Sc1cccc(C)c1)c1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolMixAcyclic
snar_thiol	1451	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)C(S)C2CCCCC32)c1)C(F)(F)F>>Cc1cccc(SC2c3cc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)ccc3C3CCCCC32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.SecondaryThiolMixCyclic
snar_thiol	1452	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC(Cc1cccc(OS(=O)(=O)C(F)(F)F)c1)CC(C)(C)S>>Cc1cccc(SC(C)(C)CC(C)Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.TertiaryThiolAcyclic
snar_thiol	1453	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC1(S)CCCC(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)C1>>Cc1cccc(SC2(C)CCCC(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)C2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.TertiaryThiolCyclic
snar_thiol	1454	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2S)c1)C(F)(F)F>>Cc1cccc(Sc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.Thiophenol
snar_thiol	1455	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccoc2S)c1)C(F)(F)F>>Cc1cccc(Sc2occc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1456	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2cccnc2S)c1)C(F)(F)F>>Cc1cccc(Sc2ncccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1457	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.PrimaryThiolAliphatic
snar_thiol	1458	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.PrimaryThiolAromatic
snar_thiol	1459	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)Sc1ccc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolAliphaticAcyclic
snar_thiol	1460	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)CC32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolAliphaticCyclic
snar_thiol	1461	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolAromaticAcyclic
snar_thiol	1462	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolAromaticCyclic
snar_thiol	1463	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCCC(Sc1ccc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolMixAcyclic
snar_thiol	1464	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.SecondaryThiolMixCyclic
snar_thiol	1465	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.TertiaryThiolAcyclic
snar_thiol	1466	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)C2)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.TertiaryThiolCyclic
snar_thiol	1467	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.Thiophenol
snar_thiol	1468	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.ThiophenolHeteroaromatic5membered
snar_thiol	1469	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PhePhe.ThiophenolHeteroaromatic6membered
snar_thiol	1470	Cc1cocc1Br.SCCCCCc1cocc1Br>>Cc1cocc1SCCCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.PrimaryThiolAliphatic
snar_thiol	1471	Cc1cocc1Br.SCc1ccccc1CCc1cocc1Br>>Cc1cocc1SCc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.PrimaryThiolAromatic
snar_thiol	1472	Cc1cocc1Br.CCC(S)CCCCc1cocc1Br>>CCC(CCCCc1cocc1Br)Sc1cocc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1473	Cc1cocc1Br.SC1C2CCCCC2C2CCC(Cc3cocc3Br)CC12>>Cc1cocc1SC1C2CCCCC2C2CCC(Cc3cocc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1474	Cc1cocc1Br.SC(c1ccccc1)c1ccccc1CCc1cocc1Br>>Cc1cocc1SC(c1ccccc1)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1475	Cc1cocc1Br.SC1c2ccccc2-c2ccc(Cc3cocc3Br)cc21>>Cc1cocc1SC1c2ccccc2c2ccc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolAromaticCyclic
snar_thiol	1476	Cc1cocc1Br.CCCC(S)c1ccccc1CCc1cocc1Br>>CCCC(Sc1cocc1C)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolMixAcyclic
snar_thiol	1477	Cc1cocc1Br.SC1c2cc(Cc3cocc3Br)ccc2C2CCCCC12>>Cc1cocc1SC1c2cc(Cc3cocc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.SecondaryThiolMixCyclic
snar_thiol	1478	Cc1cocc1Br.CC(Cc1cocc1Br)CC(C)(C)S>>Cc1cocc1SC(C)(C)CC(C)Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.TertiaryThiolAcyclic
snar_thiol	1479	Cc1cocc1Br.CC1(S)CCCC(Cc2cocc2Br)C1>>Cc1cocc1SC1(C)CCCC(Cc2cocc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.TertiaryThiolCyclic
snar_thiol	1480	Cc1cocc1Br.Sc1ccccc1CCc1cocc1Br>>Cc1cocc1Sc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.Thiophenol
snar_thiol	1481	Cc1cocc1Br.Sc1occc1CCc1cocc1Br>>Cc1cocc1Sc1occc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1482	Cc1cocc1Br.Sc1ncccc1CCc1cocc1Br>>Cc1cocc1Sc1ncccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1483	Cc1c(Br)oc2cocc12.SCCCCCc1c(Br)oc2cocc12>>Cc1c(SCCCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.PrimaryThiolAliphatic
snar_thiol	1484	Cc1c(Br)oc2cocc12.SCc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(SCc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.PrimaryThiolAromatic
snar_thiol	1485	Cc1c(Br)oc2cocc12.CCC(S)CCCCc1c(Br)oc2cocc12>>CCC(CCCCc1c(Br)oc2cocc12)Sc1oc2cocc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1486	Cc1c(Br)oc2cocc12.SC1C2CCCCC2C2CCC(Cc3c(Br)oc4cocc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)oc5cocc45)CC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1487	Cc1c(Br)oc2cocc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1488	Cc1c(Br)oc2cocc12.SC1c2ccccc2-c2ccc(Cc3c(Br)oc4cocc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolAromaticCyclic
snar_thiol	1489	Cc1c(Br)oc2cocc12.CCCC(S)c1ccccc1CCc1c(Br)oc2cocc12>>CCCC(Sc1oc2cocc2c1C)c1ccccc1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolMixAcyclic
snar_thiol	1490	Cc1c(Br)oc2cocc12.SC1c2cc(Cc3c(Br)oc4cocc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.SecondaryThiolMixCyclic
snar_thiol	1491	Cc1c(Br)oc2cocc12.CC(Cc1c(Br)oc2cocc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.TertiaryThiolAcyclic
snar_thiol	1492	Cc1c(Br)oc2cocc12.CC1(S)CCCC(Cc2c(Br)oc3cocc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)oc4cocc34)C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.TertiaryThiolCyclic
snar_thiol	1493	Cc1c(Br)oc2cocc12.Sc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(Sc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.Thiophenol
snar_thiol	1494	Cc1c(Br)oc2cocc12.Sc1occc1CCc1c(Br)oc2cocc12>>Cc1c(Sc2occc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1495	Cc1c(Br)oc2cocc12.Sc1ncccc1CCc1c(Br)oc2cocc12>>Cc1c(Sc2ncccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1496	Cc1c(Br)oc2ccncc12.SCCCCCc1c(Br)oc2ccncc12>>Cc1c(SCCCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.PrimaryThiolAliphatic
snar_thiol	1497	Cc1c(Br)oc2ccncc12.SCc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(SCc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.PrimaryThiolAromatic
snar_thiol	1498	Cc1c(Br)oc2ccncc12.CCC(S)CCCCc1c(Br)oc2ccncc12>>CCC(CCCCc1c(Br)oc2ccncc12)Sc1oc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1499	Cc1c(Br)oc2ccncc12.SC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccncc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)oc5ccncc45)CC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1500	Cc1c(Br)oc2ccncc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1501	Cc1c(Br)oc2ccncc12.SC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccncc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolAromaticCyclic
snar_thiol	1502	Cc1c(Br)oc2ccncc12.CCCC(S)c1ccccc1CCc1c(Br)oc2ccncc12>>CCCC(Sc1oc2ccncc2c1C)c1ccccc1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolMixAcyclic
snar_thiol	1503	Cc1c(Br)oc2ccncc12.SC1c2cc(Cc3c(Br)oc4ccncc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.SecondaryThiolMixCyclic
snar_thiol	1504	Cc1c(Br)oc2ccncc12.CC(Cc1c(Br)oc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.TertiaryThiolAcyclic
snar_thiol	1505	Cc1c(Br)oc2ccncc12.CC1(S)CCCC(Cc2c(Br)oc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)oc4ccncc34)C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.TertiaryThiolCyclic
snar_thiol	1506	Cc1c(Br)oc2ccncc12.Sc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(Sc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.Thiophenol
snar_thiol	1507	Cc1c(Br)oc2ccncc12.Sc1occc1CCc1c(Br)oc2ccncc12>>Cc1c(Sc2occc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1508	Cc1c(Br)oc2ccncc12.Sc1ncccc1CCc1c(Br)oc2ccncc12>>Cc1c(Sc2ncccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1509	Cc1c(Br)oc2ccccc12.SCCCCCc1c(Br)oc2ccccc12>>Cc1c(SCCCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.PrimaryThiolAliphatic
snar_thiol	1510	Cc1c(Br)oc2ccccc12.SCc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.PrimaryThiolAromatic
snar_thiol	1511	Cc1c(Br)oc2ccccc12.CCC(S)CCCCc1c(Br)oc2ccccc12>>CCC(CCCCc1c(Br)oc2ccccc12)Sc1oc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1512	Cc1c(Br)oc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)oc5ccccc45)CC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1513	Cc1c(Br)oc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1514	Cc1c(Br)oc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolAromaticCyclic
snar_thiol	1515	Cc1c(Br)oc2ccccc12.CCCC(S)c1ccccc1CCc1c(Br)oc2ccccc12>>CCCC(Sc1oc2ccccc2c1C)c1ccccc1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolMixAcyclic
snar_thiol	1516	Cc1c(Br)oc2ccccc12.SC1c2cc(Cc3c(Br)oc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.SecondaryThiolMixCyclic
snar_thiol	1517	Cc1c(Br)oc2ccccc12.CC(Cc1c(Br)oc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.TertiaryThiolAcyclic
snar_thiol	1518	Cc1c(Br)oc2ccccc12.CC1(S)CCCC(Cc2c(Br)oc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)oc4ccccc34)C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.TertiaryThiolCyclic
snar_thiol	1519	Cc1c(Br)oc2ccccc12.Sc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.Thiophenol
snar_thiol	1520	Cc1c(Br)oc2ccccc12.Sc1occc1CCc1c(Br)oc2ccccc12>>Cc1c(Sc2occc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1521	Cc1c(Br)oc2ccccc12.Sc1ncccc1CCc1c(Br)oc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het5Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1522	Cc1cnccc1Br.SCCCCCc1cnccc1Br>>Cc1cnccc1SCCCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.PrimaryThiolAliphatic
snar_thiol	1523	Cc1cnccc1Br.SCc1ccccc1CCc1cnccc1Br>>Cc1cnccc1SCc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.PrimaryThiolAromatic
snar_thiol	1524	Cc1cnccc1Br.CCC(S)CCCCc1cnccc1Br>>CCC(CCCCc1cnccc1Br)Sc1ccncc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1525	Cc1cnccc1Br.SC1C2CCCCC2C2CCC(Cc3cnccc3Br)CC12>>Cc1cnccc1SC1C2CCCCC2C2CCC(Cc3cnccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1526	Cc1cnccc1Br.SC(c1ccccc1)c1ccccc1CCc1cnccc1Br>>Cc1cnccc1SC(c1ccccc1)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1527	Cc1cnccc1Br.SC1c2ccccc2-c2ccc(Cc3cnccc3Br)cc21>>Cc1cnccc1SC1c2ccccc2c2ccc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolAromaticCyclic
snar_thiol	1528	Cc1cnccc1Br.CCCC(S)c1ccccc1CCc1cnccc1Br>>CCCC(Sc1ccncc1C)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolMixAcyclic
snar_thiol	1529	Cc1cnccc1Br.SC1c2cc(Cc3cnccc3Br)ccc2C2CCCCC12>>Cc1cnccc1SC1c2cc(Cc3cnccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.SecondaryThiolMixCyclic
snar_thiol	1530	Cc1cnccc1Br.CC(Cc1cnccc1Br)CC(C)(C)S>>Cc1cnccc1SC(C)(C)CC(C)Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.TertiaryThiolAcyclic
snar_thiol	1531	Cc1cnccc1Br.CC1(S)CCCC(Cc2cnccc2Br)C1>>Cc1cnccc1SC1(C)CCCC(Cc2cnccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.TertiaryThiolCyclic
snar_thiol	1532	Cc1cnccc1Br.Sc1ccccc1CCc1cnccc1Br>>Cc1cnccc1Sc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.Thiophenol
snar_thiol	1533	Cc1cnccc1Br.Sc1occc1CCc1cnccc1Br>>Cc1cnccc1Sc1occc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1534	Cc1cnccc1Br.Sc1ncccc1CCc1cnccc1Br>>Cc1cnccc1Sc1ncccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1535	Cc1nc2cocc2cc1Br.SCCCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1SCCCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.PrimaryThiolAliphatic
snar_thiol	1536	Cc1nc2cocc2cc1Br.SCc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1SCc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.PrimaryThiolAromatic
snar_thiol	1537	Cc1nc2cocc2cc1Br.CCC(S)CCCCc1nc2cocc2cc1Br>>CCC(CCCCc1nc2cocc2cc1Br)Sc1cc2cocc2nc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1538	Cc1nc2cocc2cc1Br.SC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC12>>Cc1nc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1539	Cc1nc2cocc2cc1Br.SC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1540	Cc1nc2cocc2cc1Br.SC1c2ccccc2-c2ccc(Cc3nc4cocc4cc3Br)cc21>>Cc1nc2cocc2cc1SC1c2ccccc2c2ccc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolAromaticCyclic
snar_thiol	1541	Cc1nc2cocc2cc1Br.CCCC(S)c1ccccc1CCc1nc2cocc2cc1Br>>CCCC(Sc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolMixAcyclic
snar_thiol	1542	Cc1nc2cocc2cc1Br.SC1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1nc2cocc2cc1SC1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.SecondaryThiolMixCyclic
snar_thiol	1543	Cc1nc2cocc2cc1Br.CC(Cc1nc2cocc2cc1Br)CC(C)(C)S>>Cc1nc2cocc2cc1SC(C)(C)CC(C)Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.TertiaryThiolAcyclic
snar_thiol	1544	Cc1nc2cocc2cc1Br.CC1(S)CCCC(Cc2nc3cocc3cc2Br)C1>>Cc1nc2cocc2cc1SC1(C)CCCC(Cc2nc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.TertiaryThiolCyclic
snar_thiol	1545	Cc1nc2cocc2cc1Br.Sc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Sc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.Thiophenol
snar_thiol	1546	Cc1nc2cocc2cc1Br.Sc1occc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Sc1occc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1547	Cc1nc2cocc2cc1Br.Sc1ncccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Sc1ncccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1548	Cc1c(Br)ncc2ccncc12.SCCCCCc1c(Br)ncc2ccncc12>>Cc1c(SCCCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.PrimaryThiolAliphatic
snar_thiol	1549	Cc1c(Br)ncc2ccncc12.SCc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(SCc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.PrimaryThiolAromatic
snar_thiol	1550	Cc1c(Br)ncc2ccncc12.CCC(S)CCCCc1c(Br)ncc2ccncc12>>CCC(CCCCc1c(Br)ncc2ccncc12)Sc1ncc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1551	Cc1c(Br)ncc2ccncc12.SC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccncc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccncc45)CC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1552	Cc1c(Br)ncc2ccncc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1553	Cc1c(Br)ncc2ccncc12.SC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccncc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolAromaticCyclic
snar_thiol	1554	Cc1c(Br)ncc2ccncc12.CCCC(S)c1ccccc1CCc1c(Br)ncc2ccncc12>>CCCC(Sc1ncc2ccncc2c1C)c1ccccc1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolMixAcyclic
snar_thiol	1555	Cc1c(Br)ncc2ccncc12.SC1c2cc(Cc3c(Br)ncc4ccncc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.SecondaryThiolMixCyclic
snar_thiol	1556	Cc1c(Br)ncc2ccncc12.CC(Cc1c(Br)ncc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.TertiaryThiolAcyclic
snar_thiol	1557	Cc1c(Br)ncc2ccncc12.CC1(S)CCCC(Cc2c(Br)ncc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)ncc4ccncc34)C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.TertiaryThiolCyclic
snar_thiol	1558	Cc1c(Br)ncc2ccncc12.Sc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Sc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.Thiophenol
snar_thiol	1559	Cc1c(Br)ncc2ccncc12.Sc1occc1CCc1c(Br)ncc2ccncc12>>Cc1c(Sc2occc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1560	Cc1c(Br)ncc2ccncc12.Sc1ncccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Sc2ncccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1561	Cc1c(Br)ncc2ccccc12.SCCCCCc1c(Br)ncc2ccccc12>>Cc1c(SCCCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.PrimaryThiolAliphatic
snar_thiol	1562	Cc1c(Br)ncc2ccccc12.SCc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.PrimaryThiolAromatic
snar_thiol	1563	Cc1c(Br)ncc2ccccc12.CCC(S)CCCCc1c(Br)ncc2ccccc12>>CCC(CCCCc1c(Br)ncc2ccccc12)Sc1ncc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1564	Cc1c(Br)ncc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccccc45)CC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1565	Cc1c(Br)ncc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1566	Cc1c(Br)ncc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolAromaticCyclic
snar_thiol	1567	Cc1c(Br)ncc2ccccc12.CCCC(S)c1ccccc1CCc1c(Br)ncc2ccccc12>>CCCC(Sc1ncc2ccccc2c1C)c1ccccc1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolMixAcyclic
snar_thiol	1568	Cc1c(Br)ncc2ccccc12.SC1c2cc(Cc3c(Br)ncc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(Br)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.SecondaryThiolMixCyclic
snar_thiol	1569	Cc1c(Br)ncc2ccccc12.CC(Cc1c(Br)ncc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.TertiaryThiolAcyclic
snar_thiol	1570	Cc1c(Br)ncc2ccccc12.CC1(S)CCCC(Cc2c(Br)ncc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(Br)ncc4ccccc34)C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.TertiaryThiolCyclic
snar_thiol	1571	Cc1c(Br)ncc2ccccc12.Sc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.Thiophenol
snar_thiol	1572	Cc1c(Br)ncc2ccccc12.Sc1occc1CCc1c(Br)ncc2ccccc12>>Cc1c(Sc2occc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1573	Cc1c(Br)ncc2ccccc12.Sc1ncccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_Het6Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1574	Cc1cc2cocc2cc1Br.SCCCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1SCCCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.PrimaryThiolAliphatic
snar_thiol	1575	Cc1cc2cocc2cc1Br.SCc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1SCc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.PrimaryThiolAromatic
snar_thiol	1576	Cc1cc2cocc2cc1Br.CCC(S)CCCCc1cc2cocc2cc1Br>>CCC(CCCCc1cc2cocc2cc1Br)Sc1cc2cocc2cc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolAliphaticAcyclic
snar_thiol	1577	Cc1cc2cocc2cc1Br.SC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC12>>Cc1cc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolAliphaticCyclic
snar_thiol	1578	Cc1cc2cocc2cc1Br.SC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolAromaticAcyclic
snar_thiol	1579	Cc1cc2cocc2cc1Br.SC1c2ccccc2-c2ccc(Cc3cc4cocc4cc3Br)cc21>>Cc1cc2cocc2cc1SC1c2ccccc2c2ccc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolAromaticCyclic
snar_thiol	1580	Cc1cc2cocc2cc1Br.CCCC(S)c1ccccc1CCc1cc2cocc2cc1Br>>CCCC(Sc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolMixAcyclic
snar_thiol	1581	Cc1cc2cocc2cc1Br.SC1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1cc2cocc2cc1SC1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.SecondaryThiolMixCyclic
snar_thiol	1582	Cc1cc2cocc2cc1Br.CC(Cc1cc2cocc2cc1Br)CC(C)(C)S>>Cc1cc2cocc2cc1SC(C)(C)CC(C)Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.TertiaryThiolAcyclic
snar_thiol	1583	Cc1cc2cocc2cc1Br.CC1(S)CCCC(Cc2cc3cocc3cc2Br)C1>>Cc1cc2cocc2cc1SC1(C)CCCC(Cc2cc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.TertiaryThiolCyclic
snar_thiol	1584	Cc1cc2cocc2cc1Br.Sc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Sc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.Thiophenol
snar_thiol	1585	Cc1cc2cocc2cc1Br.Sc1occc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Sc1occc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.ThiophenolHeteroaromatic5membered
snar_thiol	1586	Cc1cc2cocc2cc1Br.Sc1ncccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Sc1ncccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet5.ThiophenolHeteroaromatic6membered
snar_thiol	1587	CCc1c(Br)ccc2ccncc12.SCCCCCCc1c(Br)ccc2ccncc12>>CCc1c(SCCCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.PrimaryThiolAliphatic
snar_thiol	1588	CCc1c(Br)ccc2ccncc12.SCc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(SCc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.PrimaryThiolAromatic
snar_thiol	1589	CCc1c(Br)ccc2ccncc12.CCC(S)CCCCCc1c(Br)ccc2ccncc12>>CCc1c(SC(CC)CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolAliphaticAcyclic
snar_thiol	1590	CCc1c(Br)ccc2ccncc12.SC1C2CCCCC2C2CCC(CCc3c(Br)ccc4ccncc34)CC12>>CCc1c(SC2C3CCCCC3C3CCC(CCc4c(Br)ccc5ccncc45)CC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolAliphaticCyclic
snar_thiol	1591	CCc1c(Br)ccc2ccncc12.SC(c1ccccc1)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(SC(c2ccccc2)c2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolAromaticAcyclic
snar_thiol	1592	CCc1c(Br)ccc2ccncc12.SC1c2ccccc2-c2ccc(CCc3c(Br)ccc4ccncc34)cc21>>CCc1c(SC2c3ccccc3c3ccc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolAromaticCyclic
snar_thiol	1593	CCc1c(Br)ccc2ccncc12.CCCC(S)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCCC(Sc1ccc2ccncc2c1CC)c1ccccc1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolMixAcyclic
snar_thiol	1594	CCc1c(Br)ccc2ccncc12.SC1c2cc(CCc3c(Br)ccc4ccncc34)ccc2C2CCCCC12>>CCc1c(SC2c3cc(CCc4c(Br)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.SecondaryThiolMixCyclic
snar_thiol	1595	CCc1c(Br)ccc2ccncc12.CC(CCc1c(Br)ccc2ccncc12)CC(C)(C)S>>CCc1c(SC(C)(C)CC(C)CCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.TertiaryThiolAcyclic
snar_thiol	1596	CCc1c(Br)ccc2ccncc12.CC1(S)CCCC(CCc2c(Br)ccc3ccncc23)C1>>CCc1c(SC2(C)CCCC(CCc3c(Br)ccc4ccncc34)C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.TertiaryThiolCyclic
snar_thiol	1597	CCc1c(Br)ccc2ccncc12.Sc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Sc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.Thiophenol
snar_thiol	1598	CCc1c(Br)ccc2ccncc12.Sc1occc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Sc2occc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.ThiophenolHeteroaromatic5membered
snar_thiol	1599	CCc1c(Br)ccc2ccncc12.Sc1ncccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Sc2ncccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Bromide_PheHet6.ThiophenolHeteroaromatic6membered
snar_thiol	1600	Cc1cocc1I.SCCCCCc1cocc1I>>Cc1cocc1SCCCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.PrimaryThiolAliphatic
snar_thiol	1601	Cc1cocc1I.SCc1ccccc1CCc1cocc1I>>Cc1cocc1SCc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.PrimaryThiolAromatic
snar_thiol	1602	Cc1cocc1I.CCC(S)CCCCc1cocc1I>>CCC(CCCCc1cocc1I)Sc1cocc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1603	Cc1cocc1I.SC1C2CCCCC2C2CCC(Cc3cocc3I)CC12>>Cc1cocc1SC1C2CCCCC2C2CCC(Cc3cocc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1604	Cc1cocc1I.SC(c1ccccc1)c1ccccc1CCc1cocc1I>>Cc1cocc1SC(c1ccccc1)c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1605	Cc1cocc1I.SC1c2ccccc2-c2ccc(Cc3cocc3I)cc21>>Cc1cocc1SC1c2ccccc2c2ccc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolAromaticCyclic
snar_thiol	1606	Cc1cocc1I.CCCC(S)c1ccccc1CCc1cocc1I>>CCCC(Sc1cocc1C)c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolMixAcyclic
snar_thiol	1607	Cc1cocc1I.SC1c2cc(Cc3cocc3I)ccc2C2CCCCC12>>Cc1cocc1SC1c2cc(Cc3cocc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.SecondaryThiolMixCyclic
snar_thiol	1608	Cc1cocc1I.CC(Cc1cocc1I)CC(C)(C)S>>Cc1cocc1SC(C)(C)CC(C)Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.TertiaryThiolAcyclic
snar_thiol	1609	Cc1cocc1I.CC1(S)CCCC(Cc2cocc2I)C1>>Cc1cocc1SC1(C)CCCC(Cc2cocc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.TertiaryThiolCyclic
snar_thiol	1610	Cc1cocc1I.Sc1ccccc1CCc1cocc1I>>Cc1cocc1Sc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.Thiophenol
snar_thiol	1611	Cc1cocc1I.Sc1occc1CCc1cocc1I>>Cc1cocc1Sc1occc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1612	Cc1cocc1I.Sc1ncccc1CCc1cocc1I>>Cc1cocc1Sc1ncccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1613	Cc1c(I)oc2cocc12.SCCCCCc1c(I)oc2cocc12>>Cc1c(SCCCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.PrimaryThiolAliphatic
snar_thiol	1614	Cc1c(I)oc2cocc12.SCc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(SCc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.PrimaryThiolAromatic
snar_thiol	1615	Cc1c(I)oc2cocc12.CCC(S)CCCCc1c(I)oc2cocc12>>CCC(CCCCc1c(I)oc2cocc12)Sc1oc2cocc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1616	Cc1c(I)oc2cocc12.SC1C2CCCCC2C2CCC(Cc3c(I)oc4cocc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)oc5cocc45)CC32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1617	Cc1c(I)oc2cocc12.SC(c1ccccc1)c1ccccc1CCc1c(I)oc2cocc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1618	Cc1c(I)oc2cocc12.SC1c2ccccc2-c2ccc(Cc3c(I)oc4cocc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolAromaticCyclic
snar_thiol	1619	Cc1c(I)oc2cocc12.CCCC(S)c1ccccc1CCc1c(I)oc2cocc12>>CCCC(Sc1oc2cocc2c1C)c1ccccc1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolMixAcyclic
snar_thiol	1620	Cc1c(I)oc2cocc12.SC1c2cc(Cc3c(I)oc4cocc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.SecondaryThiolMixCyclic
snar_thiol	1621	Cc1c(I)oc2cocc12.CC(Cc1c(I)oc2cocc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.TertiaryThiolAcyclic
snar_thiol	1622	Cc1c(I)oc2cocc12.CC1(S)CCCC(Cc2c(I)oc3cocc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)oc4cocc34)C2)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.TertiaryThiolCyclic
snar_thiol	1623	Cc1c(I)oc2cocc12.Sc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(Sc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.Thiophenol
snar_thiol	1624	Cc1c(I)oc2cocc12.Sc1occc1CCc1c(I)oc2cocc12>>Cc1c(Sc2occc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1625	Cc1c(I)oc2cocc12.Sc1ncccc1CCc1c(I)oc2cocc12>>Cc1c(Sc2ncccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1626	Cc1c(I)oc2ccncc12.SCCCCCc1c(I)oc2ccncc12>>Cc1c(SCCCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.PrimaryThiolAliphatic
snar_thiol	1627	Cc1c(I)oc2ccncc12.SCc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(SCc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.PrimaryThiolAromatic
snar_thiol	1628	Cc1c(I)oc2ccncc12.CCC(S)CCCCc1c(I)oc2ccncc12>>CCC(CCCCc1c(I)oc2ccncc12)Sc1oc2ccncc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1629	Cc1c(I)oc2ccncc12.SC1C2CCCCC2C2CCC(Cc3c(I)oc4ccncc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)oc5ccncc45)CC32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1630	Cc1c(I)oc2ccncc12.SC(c1ccccc1)c1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1631	Cc1c(I)oc2ccncc12.SC1c2ccccc2-c2ccc(Cc3c(I)oc4ccncc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolAromaticCyclic
snar_thiol	1632	Cc1c(I)oc2ccncc12.CCCC(S)c1ccccc1CCc1c(I)oc2ccncc12>>CCCC(Sc1oc2ccncc2c1C)c1ccccc1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolMixAcyclic
snar_thiol	1633	Cc1c(I)oc2ccncc12.SC1c2cc(Cc3c(I)oc4ccncc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.SecondaryThiolMixCyclic
snar_thiol	1634	Cc1c(I)oc2ccncc12.CC(Cc1c(I)oc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.TertiaryThiolAcyclic
snar_thiol	1635	Cc1c(I)oc2ccncc12.CC1(S)CCCC(Cc2c(I)oc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)oc4ccncc34)C2)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.TertiaryThiolCyclic
snar_thiol	1636	Cc1c(I)oc2ccncc12.Sc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(Sc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.Thiophenol
snar_thiol	1637	Cc1c(I)oc2ccncc12.Sc1occc1CCc1c(I)oc2ccncc12>>Cc1c(Sc2occc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1638	Cc1c(I)oc2ccncc12.Sc1ncccc1CCc1c(I)oc2ccncc12>>Cc1c(Sc2ncccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1639	Cc1c(I)oc2ccccc12.SCCCCCc1c(I)oc2ccccc12>>Cc1c(SCCCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.PrimaryThiolAliphatic
snar_thiol	1640	Cc1c(I)oc2ccccc12.SCc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.PrimaryThiolAromatic
snar_thiol	1641	Cc1c(I)oc2ccccc12.CCC(S)CCCCc1c(I)oc2ccccc12>>CCC(CCCCc1c(I)oc2ccccc12)Sc1oc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1642	Cc1c(I)oc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(I)oc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)oc5ccccc45)CC32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1643	Cc1c(I)oc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1644	Cc1c(I)oc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(I)oc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolAromaticCyclic
snar_thiol	1645	Cc1c(I)oc2ccccc12.CCCC(S)c1ccccc1CCc1c(I)oc2ccccc12>>CCCC(Sc1oc2ccccc2c1C)c1ccccc1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolMixAcyclic
snar_thiol	1646	Cc1c(I)oc2ccccc12.SC1c2cc(Cc3c(I)oc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.SecondaryThiolMixCyclic
snar_thiol	1647	Cc1c(I)oc2ccccc12.CC(Cc1c(I)oc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.TertiaryThiolAcyclic
snar_thiol	1648	Cc1c(I)oc2ccccc12.CC1(S)CCCC(Cc2c(I)oc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)oc4ccccc34)C2)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.TertiaryThiolCyclic
snar_thiol	1649	Cc1c(I)oc2ccccc12.Sc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.Thiophenol
snar_thiol	1650	Cc1c(I)oc2ccccc12.Sc1occc1CCc1c(I)oc2ccccc12>>Cc1c(Sc2occc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1651	Cc1c(I)oc2ccccc12.Sc1ncccc1CCc1c(I)oc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het5Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1652	Cc1cnccc1I.SCCCCCc1cnccc1I>>Cc1cnccc1SCCCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.PrimaryThiolAliphatic
snar_thiol	1653	Cc1cnccc1I.SCc1ccccc1CCc1cnccc1I>>Cc1cnccc1SCc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.PrimaryThiolAromatic
snar_thiol	1654	Cc1cnccc1I.CCC(S)CCCCc1cnccc1I>>CCC(CCCCc1cnccc1I)Sc1ccncc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1655	Cc1cnccc1I.SC1C2CCCCC2C2CCC(Cc3cnccc3I)CC12>>Cc1cnccc1SC1C2CCCCC2C2CCC(Cc3cnccc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1656	Cc1cnccc1I.SC(c1ccccc1)c1ccccc1CCc1cnccc1I>>Cc1cnccc1SC(c1ccccc1)c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1657	Cc1cnccc1I.SC1c2ccccc2-c2ccc(Cc3cnccc3I)cc21>>Cc1cnccc1SC1c2ccccc2c2ccc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolAromaticCyclic
snar_thiol	1658	Cc1cnccc1I.CCCC(S)c1ccccc1CCc1cnccc1I>>CCCC(Sc1ccncc1C)c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolMixAcyclic
snar_thiol	1659	Cc1cnccc1I.SC1c2cc(Cc3cnccc3I)ccc2C2CCCCC12>>Cc1cnccc1SC1c2cc(Cc3cnccc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.SecondaryThiolMixCyclic
snar_thiol	1660	Cc1cnccc1I.CC(Cc1cnccc1I)CC(C)(C)S>>Cc1cnccc1SC(C)(C)CC(C)Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.TertiaryThiolAcyclic
snar_thiol	1661	Cc1cnccc1I.CC1(S)CCCC(Cc2cnccc2I)C1>>Cc1cnccc1SC1(C)CCCC(Cc2cnccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.TertiaryThiolCyclic
snar_thiol	1662	Cc1cnccc1I.Sc1ccccc1CCc1cnccc1I>>Cc1cnccc1Sc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.Thiophenol
snar_thiol	1663	Cc1cnccc1I.Sc1occc1CCc1cnccc1I>>Cc1cnccc1Sc1occc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1664	Cc1cnccc1I.Sc1ncccc1CCc1cnccc1I>>Cc1cnccc1Sc1ncccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1665	Cc1nc2cocc2cc1I.SCCCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1SCCCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.PrimaryThiolAliphatic
snar_thiol	1666	Cc1nc2cocc2cc1I.SCc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1SCc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.PrimaryThiolAromatic
snar_thiol	1667	Cc1nc2cocc2cc1I.CCC(S)CCCCc1nc2cocc2cc1I>>CCC(CCCCc1nc2cocc2cc1I)Sc1cc2cocc2nc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1668	Cc1nc2cocc2cc1I.SC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3I)CC12>>Cc1nc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1669	Cc1nc2cocc2cc1I.SC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1670	Cc1nc2cocc2cc1I.SC1c2ccccc2-c2ccc(Cc3nc4cocc4cc3I)cc21>>Cc1nc2cocc2cc1SC1c2ccccc2c2ccc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolAromaticCyclic
snar_thiol	1671	Cc1nc2cocc2cc1I.CCCC(S)c1ccccc1CCc1nc2cocc2cc1I>>CCCC(Sc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolMixAcyclic
snar_thiol	1672	Cc1nc2cocc2cc1I.SC1c2cc(Cc3nc4cocc4cc3I)ccc2C2CCCCC12>>Cc1nc2cocc2cc1SC1c2cc(Cc3nc4cocc4cc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.SecondaryThiolMixCyclic
snar_thiol	1673	Cc1nc2cocc2cc1I.CC(Cc1nc2cocc2cc1I)CC(C)(C)S>>Cc1nc2cocc2cc1SC(C)(C)CC(C)Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.TertiaryThiolAcyclic
snar_thiol	1674	Cc1nc2cocc2cc1I.CC1(S)CCCC(Cc2nc3cocc3cc2I)C1>>Cc1nc2cocc2cc1SC1(C)CCCC(Cc2nc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.TertiaryThiolCyclic
snar_thiol	1675	Cc1nc2cocc2cc1I.Sc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Sc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.Thiophenol
snar_thiol	1676	Cc1nc2cocc2cc1I.Sc1occc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Sc1occc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1677	Cc1nc2cocc2cc1I.Sc1ncccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Sc1ncccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1678	Cc1c(I)ncc2ccncc12.SCCCCCc1c(I)ncc2ccncc12>>Cc1c(SCCCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.PrimaryThiolAliphatic
snar_thiol	1679	Cc1c(I)ncc2ccncc12.SCc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(SCc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.PrimaryThiolAromatic
snar_thiol	1680	Cc1c(I)ncc2ccncc12.CCC(S)CCCCc1c(I)ncc2ccncc12>>CCC(CCCCc1c(I)ncc2ccncc12)Sc1ncc2ccncc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1681	Cc1c(I)ncc2ccncc12.SC1C2CCCCC2C2CCC(Cc3c(I)ncc4ccncc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)ncc5ccncc45)CC32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1682	Cc1c(I)ncc2ccncc12.SC(c1ccccc1)c1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1683	Cc1c(I)ncc2ccncc12.SC1c2ccccc2-c2ccc(Cc3c(I)ncc4ccncc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolAromaticCyclic
snar_thiol	1684	Cc1c(I)ncc2ccncc12.CCCC(S)c1ccccc1CCc1c(I)ncc2ccncc12>>CCCC(Sc1ncc2ccncc2c1C)c1ccccc1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolMixAcyclic
snar_thiol	1685	Cc1c(I)ncc2ccncc12.SC1c2cc(Cc3c(I)ncc4ccncc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.SecondaryThiolMixCyclic
snar_thiol	1686	Cc1c(I)ncc2ccncc12.CC(Cc1c(I)ncc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.TertiaryThiolAcyclic
snar_thiol	1687	Cc1c(I)ncc2ccncc12.CC1(S)CCCC(Cc2c(I)ncc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)ncc4ccncc34)C2)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.TertiaryThiolCyclic
snar_thiol	1688	Cc1c(I)ncc2ccncc12.Sc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(Sc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.Thiophenol
snar_thiol	1689	Cc1c(I)ncc2ccncc12.Sc1occc1CCc1c(I)ncc2ccncc12>>Cc1c(Sc2occc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1690	Cc1c(I)ncc2ccncc12.Sc1ncccc1CCc1c(I)ncc2ccncc12>>Cc1c(Sc2ncccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1691	Cc1c(I)ncc2ccccc12.SCCCCCc1c(I)ncc2ccccc12>>Cc1c(SCCCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.PrimaryThiolAliphatic
snar_thiol	1692	Cc1c(I)ncc2ccccc12.SCc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(SCc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.PrimaryThiolAromatic
snar_thiol	1693	Cc1c(I)ncc2ccccc12.CCC(S)CCCCc1c(I)ncc2ccccc12>>CCC(CCCCc1c(I)ncc2ccccc12)Sc1ncc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1694	Cc1c(I)ncc2ccccc12.SC1C2CCCCC2C2CCC(Cc3c(I)ncc4ccccc34)CC12>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(I)ncc5ccccc45)CC32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1695	Cc1c(I)ncc2ccccc12.SC(c1ccccc1)c1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1696	Cc1c(I)ncc2ccccc12.SC1c2ccccc2-c2ccc(Cc3c(I)ncc4ccccc34)cc21>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolAromaticCyclic
snar_thiol	1697	Cc1c(I)ncc2ccccc12.CCCC(S)c1ccccc1CCc1c(I)ncc2ccccc12>>CCCC(Sc1ncc2ccccc2c1C)c1ccccc1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolMixAcyclic
snar_thiol	1698	Cc1c(I)ncc2ccccc12.SC1c2cc(Cc3c(I)ncc4ccccc34)ccc2C2CCCCC12>>Cc1c(SC2c3cc(Cc4c(I)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.SecondaryThiolMixCyclic
snar_thiol	1699	Cc1c(I)ncc2ccccc12.CC(Cc1c(I)ncc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.TertiaryThiolAcyclic
snar_thiol	1700	Cc1c(I)ncc2ccccc12.CC1(S)CCCC(Cc2c(I)ncc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(I)ncc4ccccc34)C2)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.TertiaryThiolCyclic
snar_thiol	1701	Cc1c(I)ncc2ccccc12.Sc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(Sc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.Thiophenol
snar_thiol	1702	Cc1c(I)ncc2ccccc12.Sc1occc1CCc1c(I)ncc2ccccc12>>Cc1c(Sc2occc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1703	Cc1c(I)ncc2ccccc12.Sc1ncccc1CCc1c(I)ncc2ccccc12>>Cc1c(Sc2ncccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_Het6Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1704	Cc1cc2cocc2cc1I.SCCCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1SCCCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.PrimaryThiolAliphatic
snar_thiol	1705	Cc1cc2cocc2cc1I.SCc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1SCc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.PrimaryThiolAromatic
snar_thiol	1706	Cc1cc2cocc2cc1I.CCC(S)CCCCc1cc2cocc2cc1I>>CCC(CCCCc1cc2cocc2cc1I)Sc1cc2cocc2cc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolAliphaticAcyclic
snar_thiol	1707	Cc1cc2cocc2cc1I.SC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3I)CC12>>Cc1cc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolAliphaticCyclic
snar_thiol	1708	Cc1cc2cocc2cc1I.SC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolAromaticAcyclic
snar_thiol	1709	Cc1cc2cocc2cc1I.SC1c2ccccc2-c2ccc(Cc3cc4cocc4cc3I)cc21>>Cc1cc2cocc2cc1SC1c2ccccc2c2ccc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolAromaticCyclic
snar_thiol	1710	Cc1cc2cocc2cc1I.CCCC(S)c1ccccc1CCc1cc2cocc2cc1I>>CCCC(Sc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolMixAcyclic
snar_thiol	1711	Cc1cc2cocc2cc1I.SC1c2cc(Cc3cc4cocc4cc3I)ccc2C2CCCCC12>>Cc1cc2cocc2cc1SC1c2cc(Cc3cc4cocc4cc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.SecondaryThiolMixCyclic
snar_thiol	1712	Cc1cc2cocc2cc1I.CC(Cc1cc2cocc2cc1I)CC(C)(C)S>>Cc1cc2cocc2cc1SC(C)(C)CC(C)Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.TertiaryThiolAcyclic
snar_thiol	1713	Cc1cc2cocc2cc1I.CC1(S)CCCC(Cc2cc3cocc3cc2I)C1>>Cc1cc2cocc2cc1SC1(C)CCCC(Cc2cc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.TertiaryThiolCyclic
snar_thiol	1714	Cc1cc2cocc2cc1I.Sc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Sc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.Thiophenol
snar_thiol	1715	Cc1cc2cocc2cc1I.Sc1occc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Sc1occc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.ThiophenolHeteroaromatic5membered
snar_thiol	1716	Cc1cc2cocc2cc1I.Sc1ncccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Sc1ncccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet5.ThiophenolHeteroaromatic6membered
snar_thiol	1717	CCc1c(I)ccc2ccncc12.SCCCCCCc1c(I)ccc2ccncc12>>CCc1c(SCCCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.PrimaryThiolAliphatic
snar_thiol	1718	CCc1c(I)ccc2ccncc12.SCc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(SCc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.PrimaryThiolAromatic
snar_thiol	1719	CCc1c(I)ccc2ccncc12.CCC(S)CCCCCc1c(I)ccc2ccncc12>>CCc1c(SC(CC)CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolAliphaticAcyclic
snar_thiol	1720	CCc1c(I)ccc2ccncc12.SC1C2CCCCC2C2CCC(CCc3c(I)ccc4ccncc34)CC12>>CCc1c(SC2C3CCCCC3C3CCC(CCc4c(I)ccc5ccncc45)CC32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolAliphaticCyclic
snar_thiol	1721	CCc1c(I)ccc2ccncc12.SC(c1ccccc1)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(SC(c2ccccc2)c2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolAromaticAcyclic
snar_thiol	1722	CCc1c(I)ccc2ccncc12.SC1c2ccccc2-c2ccc(CCc3c(I)ccc4ccncc34)cc21>>CCc1c(SC2c3ccccc3c3ccc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolAromaticCyclic
snar_thiol	1723	CCc1c(I)ccc2ccncc12.CCCC(S)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCCC(Sc1ccc2ccncc2c1CC)c1ccccc1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolMixAcyclic
snar_thiol	1724	CCc1c(I)ccc2ccncc12.SC1c2cc(CCc3c(I)ccc4ccncc34)ccc2C2CCCCC12>>CCc1c(SC2c3cc(CCc4c(I)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.SecondaryThiolMixCyclic
snar_thiol	1725	CCc1c(I)ccc2ccncc12.CC(CCc1c(I)ccc2ccncc12)CC(C)(C)S>>CCc1c(SC(C)(C)CC(C)CCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.TertiaryThiolAcyclic
snar_thiol	1726	CCc1c(I)ccc2ccncc12.CC1(S)CCCC(CCc2c(I)ccc3ccncc23)C1>>CCc1c(SC2(C)CCCC(CCc3c(I)ccc4ccncc34)C2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.TertiaryThiolCyclic
snar_thiol	1727	CCc1c(I)ccc2ccncc12.Sc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Sc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.Thiophenol
snar_thiol	1728	CCc1c(I)ccc2ccncc12.Sc1occc1CCCc1c(I)ccc2ccncc12>>CCc1c(Sc2occc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.ThiophenolHeteroaromatic5membered
snar_thiol	1729	CCc1c(I)ccc2ccncc12.Sc1ncccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Sc2ncccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Iodide_PheHet6.ThiophenolHeteroaromatic6membered
snar_thiol	1730	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCCCCS)C(F)(F)F>>Cc1cocc1SCCCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.PrimaryThiolAliphatic
snar_thiol	1731	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1CS)C(F)(F)F>>Cc1cocc1SCc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.PrimaryThiolAromatic
snar_thiol	1732	Cc1cocc1OS(=O)(=O)C(F)(F)F.CCC(S)CCCCc1cocc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cocc1OS(=O)(=O)C(F)(F)F)Sc1cocc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1733	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1cocc1SC1C2CCCCC2C2CCC(Cc3cocc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1734	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1cocc1SC(c1ccccc1)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1735	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1cocc1SC1c2ccccc2c2ccc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolAromaticCyclic
snar_thiol	1736	Cc1cocc1OS(=O)(=O)C(F)(F)F.CCCC(S)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>CCCC(Sc1cocc1C)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolMixAcyclic
snar_thiol	1737	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1cocc1SC1c2cc(Cc3cocc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.SecondaryThiolMixCyclic
snar_thiol	1738	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC(Cc1cocc1OS(=O)(=O)C(F)(F)F)CC(C)(C)S>>Cc1cocc1SC(C)(C)CC(C)Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.TertiaryThiolAcyclic
snar_thiol	1739	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC1(S)CCCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cocc1SC1(C)CCCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.TertiaryThiolCyclic
snar_thiol	1740	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1S)C(F)(F)F>>Cc1cocc1Sc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.Thiophenol
snar_thiol	1741	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccoc1S)C(F)(F)F>>Cc1cocc1Sc1occc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1742	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1cccnc1S)C(F)(F)F>>Cc1cocc1Sc1ncccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1743	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.PrimaryThiolAliphatic
snar_thiol	1744	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.PrimaryThiolAromatic
snar_thiol	1745	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)Sc1oc2cocc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1746	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)CC32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1747	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1748	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolAromaticCyclic
snar_thiol	1749	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCCC(Sc1oc2cocc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolMixAcyclic
snar_thiol	1750	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.SecondaryThiolMixCyclic
snar_thiol	1751	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.TertiaryThiolAcyclic
snar_thiol	1752	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)C2)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.TertiaryThiolCyclic
snar_thiol	1753	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.Thiophenol
snar_thiol	1754	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1755	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1756	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.PrimaryThiolAliphatic
snar_thiol	1757	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.PrimaryThiolAromatic
snar_thiol	1758	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)Sc1oc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1759	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)CC32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1760	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1761	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolAromaticCyclic
snar_thiol	1762	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCCC(Sc1oc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolMixAcyclic
snar_thiol	1763	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.SecondaryThiolMixCyclic
snar_thiol	1764	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.TertiaryThiolAcyclic
snar_thiol	1765	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)C2)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.TertiaryThiolCyclic
snar_thiol	1766	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.Thiophenol
snar_thiol	1767	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1768	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1769	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.PrimaryThiolAliphatic
snar_thiol	1770	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.PrimaryThiolAromatic
snar_thiol	1771	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)Sc1oc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1772	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)CC32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1773	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1774	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolAromaticCyclic
snar_thiol	1775	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCCC(Sc1oc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolMixAcyclic
snar_thiol	1776	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.SecondaryThiolMixCyclic
snar_thiol	1777	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.TertiaryThiolAcyclic
snar_thiol	1778	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)C2)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.TertiaryThiolCyclic
snar_thiol	1779	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.Thiophenol
snar_thiol	1780	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1781	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het5Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1782	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCCCCS)C(F)(F)F>>Cc1cnccc1SCCCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.PrimaryThiolAliphatic
snar_thiol	1783	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1CS)C(F)(F)F>>Cc1cnccc1SCc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.PrimaryThiolAromatic
snar_thiol	1784	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CCC(S)CCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cnccc1OS(=O)(=O)C(F)(F)F)Sc1ccncc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1785	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1cnccc1SC1C2CCCCC2C2CCC(Cc3cnccc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1786	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1cnccc1SC(c1ccccc1)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1787	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1cnccc1SC1c2ccccc2c2ccc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolAromaticCyclic
snar_thiol	1788	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CCCC(S)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCCC(Sc1ccncc1C)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolMixAcyclic
snar_thiol	1789	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1cnccc1SC1c2cc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.SecondaryThiolMixCyclic
snar_thiol	1790	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC(Cc1cnccc1OS(=O)(=O)C(F)(F)F)CC(C)(C)S>>Cc1cnccc1SC(C)(C)CC(C)Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.TertiaryThiolAcyclic
snar_thiol	1791	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC1(S)CCCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cnccc1SC1(C)CCCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.TertiaryThiolCyclic
snar_thiol	1792	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1S)C(F)(F)F>>Cc1cnccc1Sc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.Thiophenol
snar_thiol	1793	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccoc1S)C(F)(F)F>>Cc1cnccc1Sc1occc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1794	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1cccnc1S)C(F)(F)F>>Cc1cnccc1Sc1ncccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1795	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCCCCS)C(F)(F)F>>Cc1nc2cocc2cc1SCCCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.PrimaryThiolAliphatic
snar_thiol	1796	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1CS)C(F)(F)F>>Cc1nc2cocc2cc1SCc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.PrimaryThiolAromatic
snar_thiol	1797	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCC(S)CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)Sc1cc2cocc2nc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolAliphaticAcyclic
snar_thiol	1798	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1nc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolAliphaticCyclic
snar_thiol	1799	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1nc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolAromaticAcyclic
snar_thiol	1800	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1nc2cocc2cc1SC1c2ccccc2c2ccc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolAromaticCyclic
snar_thiol	1801	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCCC(S)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCC(Sc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolMixAcyclic
snar_thiol	1802	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1nc2cocc2cc1SC1c2cc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.SecondaryThiolMixCyclic
snar_thiol	1803	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC(Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)CC(C)(C)S>>Cc1nc2cocc2cc1SC(C)(C)CC(C)Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.TertiaryThiolAcyclic
snar_thiol	1804	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(S)CCCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1nc2cocc2cc1SC1(C)CCCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.TertiaryThiolCyclic
snar_thiol	1805	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1S)C(F)(F)F>>Cc1nc2cocc2cc1Sc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.Thiophenol
snar_thiol	1806	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccoc1S)C(F)(F)F>>Cc1nc2cocc2cc1Sc1occc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.ThiophenolHeteroaromatic5membered
snar_thiol	1807	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1cccnc1S)C(F)(F)F>>Cc1nc2cocc2cc1Sc1ncccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het5.ThiophenolHeteroaromatic6membered
snar_thiol	1808	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.PrimaryThiolAliphatic
snar_thiol	1809	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.PrimaryThiolAromatic
snar_thiol	1810	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)Sc1ncc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolAliphaticAcyclic
snar_thiol	1811	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)CC32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolAliphaticCyclic
snar_thiol	1812	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolAromaticAcyclic
snar_thiol	1813	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolAromaticCyclic
snar_thiol	1814	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCCC(Sc1ncc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolMixAcyclic
snar_thiol	1815	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.SecondaryThiolMixCyclic
snar_thiol	1816	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.TertiaryThiolAcyclic
snar_thiol	1817	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)C2)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.TertiaryThiolCyclic
snar_thiol	1818	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.Thiophenol
snar_thiol	1819	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.ThiophenolHeteroaromatic5membered
snar_thiol	1820	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Het6.ThiophenolHeteroaromatic6membered
snar_thiol	1821	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.PrimaryThiolAliphatic
snar_thiol	1822	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.PrimaryThiolAromatic
snar_thiol	1823	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)Sc1ncc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolAliphaticAcyclic
snar_thiol	1824	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)CC32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolAliphaticCyclic
snar_thiol	1825	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolAromaticAcyclic
snar_thiol	1826	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolAromaticCyclic
snar_thiol	1827	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCCC(Sc1ncc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolMixAcyclic
snar_thiol	1828	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.SecondaryThiolMixCyclic
snar_thiol	1829	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.TertiaryThiolAcyclic
snar_thiol	1830	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)C2)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.TertiaryThiolCyclic
snar_thiol	1831	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.Thiophenol
snar_thiol	1832	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.ThiophenolHeteroaromatic5membered
snar_thiol	1833	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_Het6Phe.ThiophenolHeteroaromatic6membered
snar_thiol	1834	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCCCCS)C(F)(F)F>>Cc1cc2cocc2cc1SCCCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.PrimaryThiolAliphatic
snar_thiol	1835	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1CS)C(F)(F)F>>Cc1cc2cocc2cc1SCc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.PrimaryThiolAromatic
snar_thiol	1836	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCC(S)CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)Sc1cc2cocc2cc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolAliphaticAcyclic
snar_thiol	1837	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1cc2cocc2cc1SC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolAliphaticCyclic
snar_thiol	1838	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1cc2cocc2cc1SC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolAromaticAcyclic
snar_thiol	1839	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1cc2cocc2cc1SC1c2ccccc2c2ccc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolAromaticCyclic
snar_thiol	1840	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCCC(S)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCC(Sc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolMixAcyclic
snar_thiol	1841	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1cc2cocc2cc1SC1c2cc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.SecondaryThiolMixCyclic
snar_thiol	1842	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC(Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)CC(C)(C)S>>Cc1cc2cocc2cc1SC(C)(C)CC(C)Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.TertiaryThiolAcyclic
snar_thiol	1843	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(S)CCCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cc2cocc2cc1SC1(C)CCCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.TertiaryThiolCyclic
snar_thiol	1844	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1S)C(F)(F)F>>Cc1cc2cocc2cc1Sc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.Thiophenol
snar_thiol	1845	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccoc1S)C(F)(F)F>>Cc1cc2cocc2cc1Sc1occc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.ThiophenolHeteroaromatic5membered
snar_thiol	1846	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1cccnc1S)C(F)(F)F>>Cc1cc2cocc2cc1Sc1ncccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet5.ThiophenolHeteroaromatic6membered
snar_thiol	1847	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCCCCS)C(F)(F)F>>Cc1c(SCCCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2,D1;!$(C[a])]);!$(SC=*);!$(SC#*):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.PrimaryThiolAliphatic
snar_thiol	1848	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1CS)C(F)(F)F>>Cc1c(SCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;D2][a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.PrimaryThiolAromatic
snar_thiol	1849	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CCC(S)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)Sc1ccc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolAliphaticAcyclic
snar_thiol	1850	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCC2C(C1)C(S)C1CCCCC12)C(F)(F)F>>Cc1c(SC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)CC32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([A])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolAliphaticCyclic
snar_thiol	1851	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1C(S)c1ccccc1)C(F)(F)F>>Cc1c(SC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolAromaticAcyclic
snar_thiol	1852	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)C(S)c1ccccc1-2)C(F)(F)F>>Cc1c(SC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[a]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolAromaticCyclic
snar_thiol	1853	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CCCC(S)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCCC(Sc1ccc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolMixAcyclic
snar_thiol	1854	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)C(S)C1CCCCC21)C(F)(F)F>>Cc1c(SC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D3]([a])[A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.SecondaryThiolMixCyclic
snar_thiol	1855	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)CC(C)(C)S>>Cc1c(SC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.TertiaryThiolAcyclic
snar_thiol	1856	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC1(S)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)C1>>Cc1c(SC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)C2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(S[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.TertiaryThiolCyclic
snar_thiol	1857	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1S)C(F)(F)F>>Cc1c(Sc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;$(Sc1ccccc1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.Thiophenol
snar_thiol	1858	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccoc1S)C(F)(F)F>>Cc1c(Sc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.ThiophenolHeteroaromatic5membered
snar_thiol	1859	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1cccnc1S)C(F)(F)F>>Cc1c(Sc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):3][#6:4]>>[a:2][S:3][#6:4]	X-Triflate_PheHet6.ThiophenolHeteroaromatic6membered
reductive_amination_aldehyde	1860	CCC=O.NCCNCCCCCC=O>>CCCN(CCN)CCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1861	CCC=O.NC=CNCCCCCC=O>>CCCN(C=CN)CCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1862	CCC=O.NC=CNC=CCCCC=O>>CCCN(C=CN)C=CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1863	CCC=O.NC1CNCC(CCCC=O)C1>>CCCN1CC(N)CC(CCCC=O)C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1864	CCC=O.O=CCCCC1CC=CNC1>>CCCN1C=CCC(CCCC=O)C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1865	CCC=O.O=CCCCC1C=CNC=CC1>>CCCN1C=CCC(CCCC=O)C=C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1866	CCC=O.NCCNCCCCC=O>>CCCNCCNCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
reductive_amination_aldehyde	1867	CCC=O.NC=CNCCCCC=O>>CCCNC=CNCCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_aldehyde	1868	CCC=O.Nc1cccc(CCCC=O)c1Nc1ccccc1>>CCCN(c1ccccc1)c1c(N)cccc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1869	CCC=O.NCCNc1ccccc1CCCCC=O>>CCCN(CCN)c1ccccc1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1870	CCC=O.NC=CNc1ccccc1CCCC=O>>CCCN(C=CN)c1ccccc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1871	CCC=O.O=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCN1c2ccccc2CCC(CCC=O)Cc2ccccc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1872	CCC=O.O=CCCc1ccc2c(c1)NCCC2>>CCCN1CCCc2ccc(CCC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1873	CCC=O.O=CCCc1ccc2c(c1)NC=CC2>>CCCN1C=CCc2ccc(CCC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1874	CCC=O.Nc1cccc(CCCC=O)c1N>>CCCNc1cccc(CCCC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Phe
reductive_amination_aldehyde	1875	CCC=O.Nc1cc2ccc(CCCC=O)cc2cc1N>>CCCNc1cc2ccc(CCCC=O)cc2cc1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_PhePhe
reductive_amination_aldehyde	1876	CCC=O.Nc1cncc(CCCC=O)c1Nc1ccccc1>>CCCN(c1ccccc1)c1c(N)cncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1877	CCC=O.Nc1cncc(CCCC=O)c1Nc1cccnc1>>CCCN(c1cccnc1)c1c(N)cncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1878	CCC=O.NCCNc1ccncc1CCCC=O>>CCCN(CCN)c1ccncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1879	CCC=O.NC=CNc1ccncc1CCCC=O>>CCCN(C=CN)c1ccncc1CCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1880	CCC=O.O=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCN1c2cnccc2CCC(CCC=O)Cc2ccccc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1881	CCC=O.O=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCN1c2ccncc2CCC(CCC=O)Cc2ccncc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1882	CCC=O.O=CCCc1cnc2c(c1)NCCC2>>CCCN1CCCc2ncc(CCC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1883	CCC=O.O=CCCc1cnc2c(c1)NC=CC2>>CCCN1C=CCc2ncc(CCC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1884	CCC=O.Nc1occ(CCCC=O)c1N>>CCCNc1occ(CCCC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het5
reductive_amination_aldehyde	1885	CCC=O.Nc1oc2c(CCCC=O)occ2c1N>>CCCNc1oc2c(CCCC=O)occ2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het5Het5
reductive_amination_aldehyde	1886	CCC=O.Nc1oc2cc(CCCC=O)ncc2c1N>>CCCNc1oc2cc(CCCC=O)ncc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het5Het6
reductive_amination_aldehyde	1887	CCC=O.Nc1oc2ccc(CCCC=O)cc2c1N>>CCCNc1oc2ccc(CCCC=O)cc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het5Phe
reductive_amination_aldehyde	1888	CCC=O.Nc1nccc(CCCC=O)c1N>>CCCNc1nccc(CCCC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het6
reductive_amination_aldehyde	1889	CCC=O.Nc1c(CCC=O)nc2cocc2c1N>>CCCNc1c(CCC=O)nc2cocc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het6Het5
reductive_amination_aldehyde	1890	CCC=O.Nc1ncc2cc(CCCC=O)ncc2c1N>>CCCNc1ncc2cc(CCCC=O)ncc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het6Het6
reductive_amination_aldehyde	1891	CCC=O.Nc1ncc2ccc(CCCC=O)cc2c1N>>CCCNc1ncc2ccc(CCCC=O)cc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_Het6Phe
reductive_amination_aldehyde	1892	CCC=O.Nc1c(CCC=O)cc2cocc2c1N>>CCCNc1c(CCC=O)cc2cocc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_PheHet5
reductive_amination_aldehyde	1893	CCC=O.Nc1cc2cncc(CCCC=O)c2cc1N>>CCCNc1cc2cncc(CCCC=O)c2cc1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Amine_Primary_PheHet6
reductive_amination_aldehyde	1894	CCC=O.NCc1ccccc1CCCCC=O>>CCCNCc1ccccc1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.Benzylamine_primary
reductive_amination_aldehyde	1895	CCC=O.NCc1cnccc1CCCCC=O>>CCCNCc1cnccc1CCCCC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][A:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_SaturatedAliphatic.HeteroBenzylamine_primary
reductive_amination_aldehyde	1896	CCC=CC=O.NCCNCCCCCC=CC=O>>CCC=CCN(CCN)CCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1897	CCC=CC=O.NC=CNCCCCCC=CC=O>>CCC=CCN(C=CN)CCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1898	CCC=CC=O.NC=CNC=CCCCC=CC=O>>CCC=CCN(C=CN)C=CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1899	CCC=CC=O.NC1CNCC(CCCC=CC=O)C1>>CCC=CCN1CC(N)CC(CCCC=CC=O)C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1900	CCC=CC=O.O=CC=CCCCC1CC=CNC1>>CCC=CCN1C=CCC(CCCC=CC=O)C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1901	CCC=CC=O.O=CC=CCCCC1C=CNC=CC1>>CCC=CCN1C=CCC(CCCC=CC=O)C=C1	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1902	CCC=CC=O.NCCNCCCCC=CC=O>>CCC=CCNCCNCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
reductive_amination_aldehyde	1903	CCC=CC=O.NC=CNCCCCC=CC=O>>CCC=CCNC=CNCCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_aldehyde	1904	CCC=CC=O.Nc1cccc(CCCC=CC=O)c1Nc1ccccc1>>CCC=CCN(c1ccccc1)c1c(N)cccc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1905	CCC=CC=O.NCCNc1ccccc1CCCCC=CC=O>>CCC=CCN(CCN)c1ccccc1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1906	CCC=CC=O.NC=CNc1ccccc1CCCC=CC=O>>CCC=CCN(C=CN)c1ccccc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1907	CCC=CC=O.O=CC=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CCN1c2ccccc2CCC(CCC=CC=O)Cc2ccccc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1908	CCC=CC=O.O=CC=CCCc1ccc2c(c1)NCCC2>>CCC=CCN1CCCc2ccc(CCC=CC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1909	CCC=CC=O.O=CC=CCCc1ccc2c(c1)NC=CC2>>CCC=CCN1C=CCc2ccc(CCC=CC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1910	CCC=CC=O.Nc1cccc(CCCC=CC=O)c1N>>CCC=CCNc1cccc(CCCC=CC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Phe
reductive_amination_aldehyde	1911	CCC=CC=O.Nc1cc2ccc(CCCC=CC=O)cc2cc1N>>CCC=CCNc1cc2ccc(CCCC=CC=O)cc2cc1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_PhePhe
reductive_amination_aldehyde	1912	CCC=CC=O.Nc1cncc(CCCC=CC=O)c1Nc1ccccc1>>CCC=CCN(c1ccccc1)c1c(N)cncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1913	CCC=CC=O.Nc1cncc(CCCC=CC=O)c1Nc1cccnc1>>CCC=CCN(c1cccnc1)c1c(N)cncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1914	CCC=CC=O.NCCNc1ccncc1CCCC=CC=O>>CCC=CCN(CCN)c1ccncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1915	CCC=CC=O.NC=CNc1ccncc1CCCC=CC=O>>CCC=CCN(C=CN)c1ccncc1CCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1916	CCC=CC=O.O=CC=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CCN1c2cnccc2CCC(CCC=CC=O)Cc2ccccc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1917	CCC=CC=O.O=CC=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CCN1c2ccncc2CCC(CCC=CC=O)Cc2ccncc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1918	CCC=CC=O.O=CC=CCCc1cnc2c(c1)NCCC2>>CCC=CCN1CCCc2ncc(CCC=CC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1919	CCC=CC=O.O=CC=CCCc1cnc2c(c1)NC=CC2>>CCC=CCN1C=CCc2ncc(CCC=CC=O)cc21	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1920	CCC=CC=O.Nc1occ(CCCC=CC=O)c1N>>CCC=CCNc1occ(CCCC=CC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het5
reductive_amination_aldehyde	1921	CCC=CC=O.Nc1oc2c(CCCC=CC=O)occ2c1N>>CCC=CCNc1oc2c(CCCC=CC=O)occ2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het5Het5
reductive_amination_aldehyde	1922	CCC=CC=O.Nc1oc2cc(CCCC=CC=O)ncc2c1N>>CCC=CCNc1oc2cc(CCCC=CC=O)ncc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het5Het6
reductive_amination_aldehyde	1923	CCC=CC=O.Nc1oc2ccc(CCCC=CC=O)cc2c1N>>CCC=CCNc1oc2ccc(CCCC=CC=O)cc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het5Phe
reductive_amination_aldehyde	1924	CCC=CC=O.Nc1nccc(CCCC=CC=O)c1N>>CCC=CCNc1nccc(CCCC=CC=O)c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het6
reductive_amination_aldehyde	1925	CCC=CC=O.Nc1c(CCC=CC=O)nc2cocc2c1N>>CCC=CCNc1c(CCC=CC=O)nc2cocc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het6Het5
reductive_amination_aldehyde	1926	CCC=CC=O.Nc1ncc2cc(CCCC=CC=O)ncc2c1N>>CCC=CCNc1ncc2cc(CCCC=CC=O)ncc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het6Het6
reductive_amination_aldehyde	1927	CCC=CC=O.Nc1ncc2ccc(CCCC=CC=O)cc2c1N>>CCC=CCNc1ncc2ccc(CCCC=CC=O)cc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_Het6Phe
reductive_amination_aldehyde	1928	CCC=CC=O.Nc1c(CCC=CC=O)cc2cocc2c1N>>CCC=CCNc1c(CCC=CC=O)cc2cocc2c1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_PheHet5
reductive_amination_aldehyde	1929	CCC=CC=O.Nc1cc2cncc(CCCC=CC=O)c2cc1N>>CCC=CCNc1cc2cncc(CCCC=CC=O)c2cc1N	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Amine_Primary_PheHet6
reductive_amination_aldehyde	1930	CCC=CC=O.NCc1ccccc1CCCCC=CC=O>>CCC=CCNCc1ccccc1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.Benzylamine_primary
reductive_amination_aldehyde	1931	CCC=CC=O.NCc1cnccc1CCCCC=CC=O>>CCC=CCNCc1cnccc1CCCCC=CC=O	[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][A:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_UnsaturatedAliphatic.HeteroBenzylamine_primary
reductive_amination_aldehyde	1932	Cc1ccccc1C=O.NCCNCCCCc1ccccc1C=O>>Cc1ccccc1CN(CCN)CCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1933	Cc1ccccc1C=O.NC=CNCCCCc1ccccc1C=O>>Cc1ccccc1CN(C=CN)CCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1934	Cc1ccccc1C=O.NC=CNC=CCCc1ccccc1C=O>>Cc1ccccc1CN(C=CN)C=CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1935	Cc1ccccc1C=O.NC1CNCC(CCc2ccccc2C=O)C1>>Cc1ccccc1CN1CC(N)CC(CCc2ccccc2C=O)C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1936	Cc1ccccc1C=O.O=Cc1ccccc1CCC1CC=CNC1>>Cc1ccccc1CN1C=CCC(CCc2ccccc2C=O)C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1937	Cc1ccccc1C=O.O=Cc1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1CN1C=CCC(CCc2ccccc2C=O)C=C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1938	Cc1ccccc1C=O.NCCNCCCc1ccccc1C=O>>Cc1ccccc1CNCCNCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_SaturatedAliphatic
reductive_amination_aldehyde	1939	Cc1ccccc1C=O.NC=CNCCCc1ccccc1C=O>>Cc1ccccc1CNC=CNCCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_aldehyde	1940	Cc1ccccc1C=O.Nc1cccc(CCc2ccccc2C=O)c1Nc1ccccc1>>Cc1ccccc1CN(c1ccccc1)c1c(N)cccc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1941	Cc1ccccc1C=O.NCCNc1ccccc1CCCc1ccccc1C=O>>Cc1ccccc1CN(CCN)c1ccccc1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1942	Cc1ccccc1C=O.NC=CNc1ccccc1CCc1ccccc1C=O>>Cc1ccccc1CN(C=CN)c1ccccc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1943	Cc1ccccc1C=O.O=Cc1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1CN1c2ccccc2CCC(Cc2ccccc2C=O)Cc2ccccc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1944	Cc1ccccc1C=O.O=Cc1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1CN1CCCc2ccc(Cc3ccccc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1945	Cc1ccccc1C=O.O=Cc1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1CN1C=CCc2ccc(Cc3ccccc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1946	Cc1ccccc1C=O.Nc1cccc(CCc2ccccc2C=O)c1N>>Cc1ccccc1CNc1cccc(CCc2ccccc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Phe
reductive_amination_aldehyde	1947	Cc1ccccc1C=O.Nc1cc2ccc(CCc3ccccc3C=O)cc2cc1N>>Cc1ccccc1CNc1cc2ccc(CCc3ccccc3C=O)cc2cc1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_PhePhe
reductive_amination_aldehyde	1948	Cc1ccccc1C=O.Nc1cncc(CCc2ccccc2C=O)c1Nc1ccccc1>>Cc1ccccc1CN(c1ccccc1)c1c(N)cncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1949	Cc1ccccc1C=O.Nc1cncc(CCc2ccccc2C=O)c1Nc1cccnc1>>Cc1ccccc1CN(c1cccnc1)c1c(N)cncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1950	Cc1ccccc1C=O.NCCNc1ccncc1CCc1ccccc1C=O>>Cc1ccccc1CN(CCN)c1ccncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1951	Cc1ccccc1C=O.NC=CNc1ccncc1CCc1ccccc1C=O>>Cc1ccccc1CN(C=CN)c1ccncc1CCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1952	Cc1ccccc1C=O.O=Cc1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1CN1c2cnccc2CCC(Cc2ccccc2C=O)Cc2ccccc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1953	Cc1ccccc1C=O.O=Cc1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1CN1c2ccncc2CCC(Cc2ccccc2C=O)Cc2ccncc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1954	Cc1ccccc1C=O.O=Cc1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1CN1CCCc2ncc(Cc3ccccc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1955	Cc1ccccc1C=O.O=Cc1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1CN1C=CCc2ncc(Cc3ccccc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1956	Cc1ccccc1C=O.Nc1occ(CCc2ccccc2C=O)c1N>>Cc1ccccc1CNc1occ(CCc2ccccc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het5
reductive_amination_aldehyde	1957	Cc1ccccc1C=O.Nc1oc2c(CCc3ccccc3C=O)occ2c1N>>Cc1ccccc1CNc1oc2c(CCc3ccccc3C=O)occ2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het5Het5
reductive_amination_aldehyde	1958	Cc1ccccc1C=O.Nc1oc2cc(CCc3ccccc3C=O)ncc2c1N>>Cc1ccccc1CNc1oc2cc(CCc3ccccc3C=O)ncc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het5Het6
reductive_amination_aldehyde	1959	Cc1ccccc1C=O.Nc1oc2ccc(CCc3ccccc3C=O)cc2c1N>>Cc1ccccc1CNc1oc2ccc(CCc3ccccc3C=O)cc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het5Phe
reductive_amination_aldehyde	1960	Cc1ccccc1C=O.Nc1nccc(CCc2ccccc2C=O)c1N>>Cc1ccccc1CNc1nccc(CCc2ccccc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het6
reductive_amination_aldehyde	1961	Cc1ccccc1C=O.Nc1c(Cc2ccccc2C=O)nc2cocc2c1N>>Cc1ccccc1CNc1c(Cc2ccccc2C=O)nc2cocc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het6Het5
reductive_amination_aldehyde	1962	Cc1ccccc1C=O.Nc1ncc2cc(CCc3ccccc3C=O)ncc2c1N>>Cc1ccccc1CNc1ncc2cc(CCc3ccccc3C=O)ncc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het6Het6
reductive_amination_aldehyde	1963	Cc1ccccc1C=O.Nc1ncc2ccc(CCc3ccccc3C=O)cc2c1N>>Cc1ccccc1CNc1ncc2ccc(CCc3ccccc3C=O)cc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_Het6Phe
reductive_amination_aldehyde	1964	Cc1ccccc1C=O.Nc1c(Cc2ccccc2C=O)cc2cocc2c1N>>Cc1ccccc1CNc1c(Cc2ccccc2C=O)cc2cocc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_PheHet5
reductive_amination_aldehyde	1965	Cc1ccccc1C=O.Nc1cc2cncc(CCc3ccccc3C=O)c2cc1N>>Cc1ccccc1CNc1cc2cncc(CCc3ccccc3C=O)c2cc1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Amine_Primary_PheHet6
reductive_amination_aldehyde	1966	Cc1ccccc1C=O.NCc1ccccc1CCCc1ccccc1C=O>>Cc1ccccc1CNCc1ccccc1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.Benzylamine_primary
reductive_amination_aldehyde	1967	Cc1ccccc1C=O.NCc1cnccc1CCCc1ccccc1C=O>>Cc1ccccc1CNCc1cnccc1CCCc1ccccc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Aromatic.HeteroBenzylamine_primary
reductive_amination_aldehyde	1968	Cc1ccncc1C=O.NCCNCCCCc1ccncc1C=O>>Cc1ccncc1CN(CCN)CCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1969	Cc1ccncc1C=O.NC=CNCCCCc1ccncc1C=O>>Cc1ccncc1CN(C=CN)CCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1970	Cc1ccncc1C=O.NC=CNC=CCCc1ccncc1C=O>>Cc1ccncc1CN(C=CN)C=CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1971	Cc1ccncc1C=O.NC1CNCC(CCc2ccncc2C=O)C1>>Cc1ccncc1CN1CC(N)CC(CCc2ccncc2C=O)C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
reductive_amination_aldehyde	1972	Cc1ccncc1C=O.O=Cc1cnccc1CCC1CC=CNC1>>Cc1ccncc1CN1C=CCC(CCc2ccncc2C=O)C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1973	Cc1ccncc1C=O.O=Cc1cnccc1CCC1C=CNC=CC1>>Cc1ccncc1CN1C=CCC(CCc2ccncc2C=O)C=C1	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
reductive_amination_aldehyde	1974	Cc1ccncc1C=O.NCCNCCCc1ccncc1C=O>>Cc1ccncc1CNCCNCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_SaturatedAliphatic
reductive_amination_aldehyde	1975	Cc1ccncc1C=O.NC=CNCCCc1ccncc1C=O>>Cc1ccncc1CNC=CNCCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
reductive_amination_aldehyde	1976	Cc1ccncc1C=O.Nc1cccc(CCc2ccncc2C=O)c1Nc1ccccc1>>Cc1ccncc1CN(c1ccccc1)c1c(N)cccc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1977	Cc1ccncc1C=O.NCCNc1ccccc1CCCc1ccncc1C=O>>Cc1ccncc1CN(CCN)c1ccccc1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1978	Cc1ccncc1C=O.NC=CNc1ccccc1CCc1ccncc1C=O>>Cc1ccncc1CN(C=CN)c1ccccc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1979	Cc1ccncc1C=O.O=Cc1cnccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccncc1CN1c2ccccc2CCC(Cc2ccncc2C=O)Cc2ccccc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
reductive_amination_aldehyde	1980	Cc1ccncc1C=O.O=Cc1cnccc1Cc1ccc2c(c1)NCCC2>>Cc1ccncc1CN1CCCc2ccc(Cc3ccncc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1981	Cc1ccncc1C=O.O=Cc1cnccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccncc1CN1C=CCc2ccc(Cc3ccncc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
reductive_amination_aldehyde	1982	Cc1ccncc1C=O.Nc1cccc(CCc2ccncc2C=O)c1N>>Cc1ccncc1CNc1cccc(CCc2ccncc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Phe
reductive_amination_aldehyde	1983	Cc1ccncc1C=O.Nc1cc2ccc(CCc3ccncc3C=O)cc2cc1N>>Cc1ccncc1CNc1cc2ccc(CCc3ccncc3C=O)cc2cc1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_PhePhe
reductive_amination_aldehyde	1984	Cc1ccncc1C=O.Nc1cncc(CCc2ccncc2C=O)c1Nc1ccccc1>>Cc1ccncc1CN(c1ccccc1)c1c(N)cncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1985	Cc1ccncc1C=O.Nc1cncc(CCc2ccncc2C=O)c1Nc1cccnc1>>Cc1ccncc1CN(c1cccnc1)c1c(N)cncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1986	Cc1ccncc1C=O.NCCNc1ccncc1CCc1ccncc1C=O>>Cc1ccncc1CN(CCN)c1ccncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1987	Cc1ccncc1C=O.NC=CNc1ccncc1CCc1ccncc1C=O>>Cc1ccncc1CN(C=CN)c1ccncc1CCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1988	Cc1ccncc1C=O.O=Cc1cnccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccncc1CN1c2cnccc2CCC(Cc2ccncc2C=O)Cc2ccccc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
reductive_amination_aldehyde	1989	Cc1ccncc1C=O.O=Cc1cnccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccncc1CN1c2ccncc2CCC(Cc2ccncc2C=O)Cc2ccncc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
reductive_amination_aldehyde	1990	Cc1ccncc1C=O.O=Cc1cnccc1Cc1cnc2c(c1)NCCC2>>Cc1ccncc1CN1CCCc2ncc(Cc3ccncc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1991	Cc1ccncc1C=O.O=Cc1cnccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccncc1CN1C=CCc2ncc(Cc3ccncc3C=O)cc21	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]C[N:3]([#6:4])[#6:5]	Aldehyde_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
reductive_amination_aldehyde	1992	Cc1ccncc1C=O.Nc1occ(CCc2ccncc2C=O)c1N>>Cc1ccncc1CNc1occ(CCc2ccncc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het5
reductive_amination_aldehyde	1993	Cc1ccncc1C=O.Nc1oc2c(CCc3ccncc3C=O)occ2c1N>>Cc1ccncc1CNc1oc2c(CCc3ccncc3C=O)occ2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het5Het5
reductive_amination_aldehyde	1994	Cc1ccncc1C=O.Nc1oc2cc(CCc3ccncc3C=O)ncc2c1N>>Cc1ccncc1CNc1oc2cc(CCc3ccncc3C=O)ncc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het5Het6
reductive_amination_aldehyde	1995	Cc1ccncc1C=O.Nc1oc2ccc(CCc3ccncc3C=O)cc2c1N>>Cc1ccncc1CNc1oc2ccc(CCc3ccncc3C=O)cc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het5Phe
reductive_amination_aldehyde	1996	Cc1ccncc1C=O.Nc1nccc(CCc2ccncc2C=O)c1N>>Cc1ccncc1CNc1nccc(CCc2ccncc2C=O)c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het6
reductive_amination_aldehyde	1997	Cc1ccncc1C=O.Nc1c(Cc2ccncc2C=O)nc2cocc2c1N>>Cc1ccncc1CNc1c(Cc2ccncc2C=O)nc2cocc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het6Het5
reductive_amination_aldehyde	1998	Cc1ccncc1C=O.Nc1ncc2cc(CCc3ccncc3C=O)ncc2c1N>>Cc1ccncc1CNc1ncc2cc(CCc3ccncc3C=O)ncc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het6Het6
reductive_amination_aldehyde	1999	Cc1ccncc1C=O.Nc1ncc2ccc(CCc3ccncc3C=O)cc2c1N>>Cc1ccncc1CNc1ncc2ccc(CCc3ccncc3C=O)cc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_Het6Phe
reductive_amination_aldehyde	2000	Cc1ccncc1C=O.Nc1c(Cc2ccncc2C=O)cc2cocc2c1N>>Cc1ccncc1CNc1c(Cc2ccncc2C=O)cc2cocc2c1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_PheHet5
reductive_amination_aldehyde	2001	Cc1ccncc1C=O.Nc1cc2cncc(CCc3ccncc3C=O)c2cc1N>>Cc1ccncc1CNc1cc2cncc(CCc3ccncc3C=O)c2cc1N	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Amine_Primary_PheHet6
reductive_amination_aldehyde	2002	Cc1ccncc1C=O.NCc1ccccc1CCCc1ccncc1C=O>>Cc1ccncc1CNCc1ccccc1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.Benzylamine_primary
reductive_amination_aldehyde	2003	Cc1ccncc1C=O.NCc1cnccc1CCCc1ccncc1C=O>>Cc1ccncc1CNCc1cnccc1CCCc1ccncc1C=O	[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]C[N:3][#6:4]	Aldehyde_Heteroaromatic.HeteroBenzylamine_primary
ester_schotten_baumann	2004	CCCC(=O)Br.O=C(Br)CCCCCCCO>>CCCC(=O)OCCCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2005	CCCC(=O)Br.O=C(Br)CCCCc1ccccc1CO>>CCCC(=O)OCc1ccccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2006	CCCC(=O)Br.CCC(O)CCCCCCC(=O)Br>>CCCC(=O)OC(CC)CCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2007	CCCC(=O)Br.O=C(Br)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)Br)CC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2008	CCCC(=O)Br.O=C(Br)CCCCc1ccccc1C(O)c1ccccc1>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2009	CCCC(=O)Br.O=C(Br)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2010	CCCC(=O)Br.CCCC(O)c1ccccc1CCCCC(=O)Br>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2011	CCCC(=O)Br.O=C(Br)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCC(=O)OC1c2cc(CCCC(=O)Br)ccc2C2CCCCC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2012	CCCC(=O)Br.CC(CCCC(=O)Br)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2013	CCCC(=O)Br.CC1(O)CCCC(CCCC(=O)Br)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2014	CCCC(=O)Br.O=C(Br)CCCCc1ccccc1O>>CCCC(=O)Oc1ccccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Phenol
ester_schotten_baumann	2015	CCCC(=O)Br.O=C(Br)CCCCc1ccoc1O>>CCCC(=O)Oc1occc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2016	CCCC(=O)Br.O=C(Br)CCCCc1cccnc1O>>CCCC(=O)Oc1ncccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2017	CCC=CC(=O)Br.O=C(Br)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2018	CCC=CC(=O)Br.O=C(Br)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2019	CCC=CC(=O)Br.CCC(O)CCCCCC=CC(=O)Br>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2020	CCC=CC(=O)Br.O=C(Br)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)Br)CC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2021	CCC=CC(=O)Br.O=C(Br)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2022	CCC=CC(=O)Br.O=C(Br)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2023	CCC=CC(=O)Br.CCCC(O)c1ccccc1CCCC=CC(=O)Br>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2024	CCC=CC(=O)Br.O=C(Br)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)Br)ccc2C2CCCCC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2025	CCC=CC(=O)Br.CC(CCC=CC(=O)Br)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2026	CCC=CC(=O)Br.CC1(O)CCCC(CCC=CC(=O)Br)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2027	CCC=CC(=O)Br.O=C(Br)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Phenol
ester_schotten_baumann	2028	CCC=CC(=O)Br.O=C(Br)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2029	CCC=CC(=O)Br.O=C(Br)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2030	CCCC(=O)Cl.O=C(Cl)CCCCCCCO>>CCCC(=O)OCCCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2031	CCCC(=O)Cl.O=C(Cl)CCCCc1ccccc1CO>>CCCC(=O)OCc1ccccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2032	CCCC(=O)Cl.CCC(O)CCCCCCC(=O)Cl>>CCCC(=O)OC(CC)CCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2033	CCCC(=O)Cl.O=C(Cl)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)Cl)CC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2034	CCCC(=O)Cl.O=C(Cl)CCCCc1ccccc1C(O)c1ccccc1>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2035	CCCC(=O)Cl.O=C(Cl)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2036	CCCC(=O)Cl.CCCC(O)c1ccccc1CCCCC(=O)Cl>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2037	CCCC(=O)Cl.O=C(Cl)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCC(=O)OC1c2cc(CCCC(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2038	CCCC(=O)Cl.CC(CCCC(=O)Cl)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2039	CCCC(=O)Cl.CC1(O)CCCC(CCCC(=O)Cl)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2040	CCCC(=O)Cl.O=C(Cl)CCCCc1ccccc1O>>CCCC(=O)Oc1ccccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Phenol
ester_schotten_baumann	2041	CCCC(=O)Cl.O=C(Cl)CCCCc1ccoc1O>>CCCC(=O)Oc1occc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2042	CCCC(=O)Cl.O=C(Cl)CCCCc1cccnc1O>>CCCC(=O)Oc1ncccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2043	CCC=CC(=O)Cl.O=C(Cl)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2044	CCC=CC(=O)Cl.O=C(Cl)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2045	CCC=CC(=O)Cl.CCC(O)CCCCCC=CC(=O)Cl>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2046	CCC=CC(=O)Cl.O=C(Cl)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)Cl)CC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2047	CCC=CC(=O)Cl.O=C(Cl)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2048	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2049	CCC=CC(=O)Cl.CCCC(O)c1ccccc1CCCC=CC(=O)Cl>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2050	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2051	CCC=CC(=O)Cl.CC(CCC=CC(=O)Cl)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2052	CCC=CC(=O)Cl.CC1(O)CCCC(CCC=CC(=O)Cl)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2053	CCC=CC(=O)Cl.O=C(Cl)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Phenol
ester_schotten_baumann	2054	CCC=CC(=O)Cl.O=C(Cl)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2055	CCC=CC(=O)Cl.O=C(Cl)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2056	CCCC(=O)F.O=C(F)CCCCCCCO>>CCCC(=O)OCCCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2057	CCCC(=O)F.O=C(F)CCCCc1ccccc1CO>>CCCC(=O)OCc1ccccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2058	CCCC(=O)F.CCC(O)CCCCCCC(=O)F>>CCCC(=O)OC(CC)CCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2059	CCCC(=O)F.O=C(F)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)F)CC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2060	CCCC(=O)F.O=C(F)CCCCc1ccccc1C(O)c1ccccc1>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2061	CCCC(=O)F.O=C(F)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2062	CCCC(=O)F.CCCC(O)c1ccccc1CCCCC(=O)F>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2063	CCCC(=O)F.O=C(F)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCC(=O)OC1c2cc(CCCC(=O)F)ccc2C2CCCCC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2064	CCCC(=O)F.CC(CCCC(=O)F)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2065	CCCC(=O)F.CC1(O)CCCC(CCCC(=O)F)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2066	CCCC(=O)F.O=C(F)CCCCc1ccccc1O>>CCCC(=O)Oc1ccccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Phenol
ester_schotten_baumann	2067	CCCC(=O)F.O=C(F)CCCCc1ccoc1O>>CCCC(=O)Oc1occc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2068	CCCC(=O)F.O=C(F)CCCCc1cccnc1O>>CCCC(=O)Oc1ncccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2069	CCC=CC(=O)F.O=C(F)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2070	CCC=CC(=O)F.O=C(F)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2071	CCC=CC(=O)F.CCC(O)CCCCCC=CC(=O)F>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2072	CCC=CC(=O)F.O=C(F)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)F)CC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2073	CCC=CC(=O)F.O=C(F)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2074	CCC=CC(=O)F.O=C(F)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2075	CCC=CC(=O)F.CCCC(O)c1ccccc1CCCC=CC(=O)F>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2076	CCC=CC(=O)F.O=C(F)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)F)ccc2C2CCCCC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2077	CCC=CC(=O)F.CC(CCC=CC(=O)F)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2078	CCC=CC(=O)F.CC1(O)CCCC(CCC=CC(=O)F)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2079	CCC=CC(=O)F.O=C(F)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Phenol
ester_schotten_baumann	2080	CCC=CC(=O)F.O=C(F)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2081	CCC=CC(=O)F.O=C(F)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2082	CCCC(=O)I.O=C(I)CCCCCCCO>>CCCC(=O)OCCCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2083	CCCC(=O)I.O=C(I)CCCCc1ccccc1CO>>CCCC(=O)OCc1ccccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2084	CCCC(=O)I.CCC(O)CCCCCCC(=O)I>>CCCC(=O)OC(CC)CCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2085	CCCC(=O)I.O=C(I)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)I)CC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2086	CCCC(=O)I.O=C(I)CCCCc1ccccc1C(O)c1ccccc1>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2087	CCCC(=O)I.O=C(I)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2088	CCCC(=O)I.CCCC(O)c1ccccc1CCCCC(=O)I>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2089	CCCC(=O)I.O=C(I)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCC(=O)OC1c2cc(CCCC(=O)I)ccc2C2CCCCC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2090	CCCC(=O)I.CC(CCCC(=O)I)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2091	CCCC(=O)I.CC1(O)CCCC(CCCC(=O)I)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2092	CCCC(=O)I.O=C(I)CCCCc1ccccc1O>>CCCC(=O)Oc1ccccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Phenol
ester_schotten_baumann	2093	CCCC(=O)I.O=C(I)CCCCc1ccoc1O>>CCCC(=O)Oc1occc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2094	CCCC(=O)I.O=C(I)CCCCc1cccnc1O>>CCCC(=O)Oc1ncccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2095	CCC=CC(=O)I.O=C(I)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2096	CCC=CC(=O)I.O=C(I)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2097	CCC=CC(=O)I.CCC(O)CCCCCC=CC(=O)I>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2098	CCC=CC(=O)I.O=C(I)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)I)CC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2099	CCC=CC(=O)I.O=C(I)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2100	CCC=CC(=O)I.O=C(I)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2101	CCC=CC(=O)I.CCCC(O)c1ccccc1CCCC=CC(=O)I>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2102	CCC=CC(=O)I.O=C(I)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)I)ccc2C2CCCCC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2103	CCC=CC(=O)I.CC(CCC=CC(=O)I)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2104	CCC=CC(=O)I.CC1(O)CCCC(CCC=CC(=O)I)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2105	CCC=CC(=O)I.O=C(I)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Phenol
ester_schotten_baumann	2106	CCC=CC(=O)I.O=C(I)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2107	CCC=CC(=O)I.O=C(I)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2108	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCCCCO)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OCCCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2109	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCc1ccccc1CO)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OCc1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2110	CCCC(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC(CC)CCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2111	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCC1CCC2C(C1)C(O)C1CCCCC12)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2112	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCc1ccccc1C(O)c1ccccc1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2113	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1ccc2c(c1)C(O)c1ccccc1-2)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2114	CCCC(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2115	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1ccc2c(c1)C(O)C1CCCCC21)OS(=O)(=O)C(F)(F)F>>CCCC(=O)OC1c2cc(CCCC(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2116	CCCC(=O)OS(=O)(=O)C(F)(F)F.CC(CCCC(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2117	CCCC(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2118	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCc1ccccc1O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)Oc1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Phenol
ester_schotten_baumann	2119	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCc1ccoc1O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)Oc1occc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2120	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCc1cccnc1O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)Oc1ncccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2121	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCCCCO)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OCCCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2122	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCc1ccccc1CO)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2123	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2124	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCC1CCC2C(C1)C(O)C1CCCCC12)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2125	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCc1ccccc1C(O)c1ccccc1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2126	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1ccc2c(c1)C(O)c1ccccc1-2)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2127	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2128	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1ccc2c(c1)C(O)C1CCCCC21)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2129	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.CC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2130	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2131	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCc1ccccc1O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Phenol
ester_schotten_baumann	2132	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCc1ccoc1O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2133	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCc1cccnc1O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2134	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2135	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2136	Cc1ccccc1C(=O)Br.CCC(O)CCCCc1ccccc1C(=O)Br>>CCC(CCCCc1ccccc1C(=O)Br)OC(=O)c1ccccc1C	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2137	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)Br)CC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2138	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2139	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2140	Cc1ccccc1C(=O)Br.CCCC(O)c1ccccc1CCc1ccccc1C(=O)Br>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2141	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)Br)ccc2C2CCCCC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2142	Cc1ccccc1C(=O)Br.CC(Cc1ccccc1C(=O)Br)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2143	Cc1ccccc1C(=O)Br.CC1(O)CCCC(Cc2ccccc2C(=O)Br)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2144	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.Phenol
ester_schotten_baumann	2145	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2146	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Aromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2147	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2148	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2149	Cc1ccccc1C(=O)Cl.CCC(O)CCCCc1ccccc1C(=O)Cl>>CCC(CCCCc1ccccc1C(=O)Cl)OC(=O)c1ccccc1C	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2150	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)Cl)CC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2151	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2152	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2153	Cc1ccccc1C(=O)Cl.CCCC(O)c1ccccc1CCc1ccccc1C(=O)Cl>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2154	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2155	Cc1ccccc1C(=O)Cl.CC(Cc1ccccc1C(=O)Cl)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2156	Cc1ccccc1C(=O)Cl.CC1(O)CCCC(Cc2ccccc2C(=O)Cl)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2157	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.Phenol
ester_schotten_baumann	2158	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2159	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Aromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2160	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2161	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2162	Cc1ccccc1C(=O)F.CCC(O)CCCCc1ccccc1C(=O)F>>CCC(CCCCc1ccccc1C(=O)F)OC(=O)c1ccccc1C	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2163	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)F)CC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2164	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2165	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2166	Cc1ccccc1C(=O)F.CCCC(O)c1ccccc1CCc1ccccc1C(=O)F>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2167	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)F)ccc2C2CCCCC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2168	Cc1ccccc1C(=O)F.CC(Cc1ccccc1C(=O)F)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2169	Cc1ccccc1C(=O)F.CC1(O)CCCC(Cc2ccccc2C(=O)F)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2170	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.Phenol
ester_schotten_baumann	2171	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2172	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Aromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2173	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2174	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2175	Cc1ccccc1C(=O)I.CCC(O)CCCCc1ccccc1C(=O)I>>CCC(CCCCc1ccccc1C(=O)I)OC(=O)c1ccccc1C	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2176	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)I)CC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2177	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2178	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2179	Cc1ccccc1C(=O)I.CCCC(O)c1ccccc1CCc1ccccc1C(=O)I>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2180	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)I)ccc2C2CCCCC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2181	Cc1ccccc1C(=O)I.CC(Cc1ccccc1C(=O)I)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2182	Cc1ccccc1C(=O)I.CC1(O)CCCC(Cc2ccccc2C(=O)I)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2183	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.Phenol
ester_schotten_baumann	2184	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2185	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Aromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2186	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2187	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2188	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F)OC(=O)c1ccccc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2189	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2190	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2191	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2192	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2193	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2194	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.CC(Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2195	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2196	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.Phenol
ester_schotten_baumann	2197	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2198	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Aromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2199	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2200	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2201	Cc1cnccc1C(=O)Br.CCC(O)CCCCc1cnccc1C(=O)Br>>CCC(CCCCc1cnccc1C(=O)Br)OC(=O)c1ccncc1C	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2202	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)Br)CC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2203	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2204	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2205	Cc1cnccc1C(=O)Br.CCCC(O)c1ccccc1CCc1cnccc1C(=O)Br>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2206	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)Br)ccc2C2CCCCC21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2207	Cc1cnccc1C(=O)Br.CC(Cc1cnccc1C(=O)Br)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2208	Cc1cnccc1C(=O)Br.CC1(O)CCCC(Cc2cnccc2C(=O)Br)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2209	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.Phenol
ester_schotten_baumann	2210	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2211	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Bromide_Heteroaromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2212	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2213	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2214	Cc1cnccc1C(=O)Cl.CCC(O)CCCCc1cnccc1C(=O)Cl>>CCC(CCCCc1cnccc1C(=O)Cl)OC(=O)c1ccncc1C	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2215	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)Cl)CC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2216	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2217	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2218	Cc1cnccc1C(=O)Cl.CCCC(O)c1ccccc1CCc1cnccc1C(=O)Cl>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2219	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2220	Cc1cnccc1C(=O)Cl.CC(Cc1cnccc1C(=O)Cl)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2221	Cc1cnccc1C(=O)Cl.CC1(O)CCCC(Cc2cnccc2C(=O)Cl)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2222	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.Phenol
ester_schotten_baumann	2223	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2224	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Chloride_Heteroaromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2225	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2226	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2227	Cc1cnccc1C(=O)F.CCC(O)CCCCc1cnccc1C(=O)F>>CCC(CCCCc1cnccc1C(=O)F)OC(=O)c1ccncc1C	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2228	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)F)CC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2229	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2230	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2231	Cc1cnccc1C(=O)F.CCCC(O)c1ccccc1CCc1cnccc1C(=O)F>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2232	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)F)ccc2C2CCCCC21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2233	Cc1cnccc1C(=O)F.CC(Cc1cnccc1C(=O)F)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2234	Cc1cnccc1C(=O)F.CC1(O)CCCC(Cc2cnccc2C(=O)F)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2235	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Phenol
ester_schotten_baumann	2236	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2237	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Fluoride_Heteroaromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2238	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2239	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2240	Cc1cnccc1C(=O)I.CCC(O)CCCCc1cnccc1C(=O)I>>CCC(CCCCc1cnccc1C(=O)I)OC(=O)c1ccncc1C	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2241	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)I)CC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2242	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2243	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2244	Cc1cnccc1C(=O)I.CCCC(O)c1ccccc1CCc1cnccc1C(=O)I>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2245	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)I)ccc2C2CCCCC21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2246	Cc1cnccc1C(=O)I.CC(Cc1cnccc1C(=O)I)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2247	Cc1cnccc1C(=O)I.CC1(O)CCCC(Cc2cnccc2C(=O)I)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2248	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.Phenol
ester_schotten_baumann	2249	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2250	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Iodide_Heteroaromatic.PhenolHeteroaromatic6membered
ester_schotten_baumann	2251	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.PrimaryAlcoholAliphatic
ester_schotten_baumann	2252	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.PrimaryAlcoholAromatic
ester_schotten_baumann	2253	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F)OC(=O)c1ccncc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
ester_schotten_baumann	2254	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
ester_schotten_baumann	2255	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
ester_schotten_baumann	2256	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholAromaticCyclic
ester_schotten_baumann	2257	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholMixAcyclic
ester_schotten_baumann	2258	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.SecondaryAlcoholMixCyclic
ester_schotten_baumann	2259	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.CC(Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.TertiaryAlcoholAcyclic
ester_schotten_baumann	2260	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.TertiaryAlcoholCyclic
ester_schotten_baumann	2261	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.Phenol
ester_schotten_baumann	2262	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.PhenolHeteroaromatic5membered
ester_schotten_baumann	2263	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2][O:3][#6:4]	AcidX-Triflate_Heteroaromatic.PhenolHeteroaromatic6membered
heck	2264	Cc1ccccc1Br.C=CCCCc1ccccc1Br>>Cc1ccccc1C=CCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Phe.AlkeneTerminal
heck	2265	Cc1c(Br)ccc2ccccc12.C=CCCCc1c(Br)ccc2ccccc12>>Cc1c(C=CCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_PhePhe.AlkeneTerminal
heck	2266	Cc1ccccc1I.C=CCCCc1ccccc1I>>Cc1ccccc1C=CCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Phe.AlkeneTerminal
heck	2267	Cc1c(I)ccc2ccccc12.C=CCCCc1c(I)ccc2ccccc12>>Cc1c(C=CCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_PhePhe.AlkeneTerminal
heck	2268	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.C=CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(C=CCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Phe.AlkeneTerminal
heck	2269	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_PhePhe.AlkeneTerminal
heck	2270	Cc1cocc1Br.C=CCCCc1cocc1Br>>Cc1cocc1C=CCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het5.AlkeneTerminal
heck	2271	Cc1c(Br)oc2cocc12.C=CCCCc1c(Br)oc2cocc12>>Cc1c(C=CCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het5Het5.AlkeneTerminal
heck	2272	Cc1c(Br)oc2ccncc12.C=CCCCc1c(Br)oc2ccncc12>>Cc1c(C=CCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het5Het6.AlkeneTerminal
heck	2273	Cc1c(Br)oc2ccccc12.C=CCCCc1c(Br)oc2ccccc12>>Cc1c(C=CCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het5Phe.AlkeneTerminal
heck	2274	Cc1cnccc1Br.C=CCCCc1cnccc1Br>>Cc1cnccc1C=CCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het6.AlkeneTerminal
heck	2275	Cc1nc2cocc2cc1Br.C=CCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1C=CCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het6Het5.AlkeneTerminal
heck	2276	Cc1c(Br)ncc2ccncc12.C=CCCCc1c(Br)ncc2ccncc12>>Cc1c(C=CCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het6Het6.AlkeneTerminal
heck	2277	Cc1c(Br)ncc2ccccc12.C=CCCCc1c(Br)ncc2ccccc12>>Cc1c(C=CCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_Het6Phe.AlkeneTerminal
heck	2278	Cc1cc2cocc2cc1Br.C=CCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1C=CCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_PheHet5.AlkeneTerminal
heck	2279	CCc1c(Br)ccc2ccncc12.C=CCCCCc1c(Br)ccc2ccncc12>>CCc1c(C=CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Bromide_PheHet6.AlkeneTerminal
heck	2280	Cc1cocc1Cl.C=CCCCc1cocc1Cl>>Cc1cocc1C=CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het5.AlkeneTerminal
heck	2281	Cc1c(Cl)oc2cocc12.C=CCCCc1c(Cl)oc2cocc12>>Cc1c(C=CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het5Het5.AlkeneTerminal
heck	2282	Cc1c(Cl)oc2ccncc12.C=CCCCc1c(Cl)oc2ccncc12>>Cc1c(C=CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het5Het6.AlkeneTerminal
heck	2283	Cc1c(Cl)oc2ccccc12.C=CCCCc1c(Cl)oc2ccccc12>>Cc1c(C=CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het5Phe.AlkeneTerminal
heck	2284	Cc1cnccc1Cl.C=CCCCc1cnccc1Cl>>Cc1cnccc1C=CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het6.AlkeneTerminal
heck	2285	Cc1nc2cocc2cc1Cl.C=CCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1C=CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het6Het5.AlkeneTerminal
heck	2286	Cc1c(Cl)ncc2ccncc12.C=CCCCc1c(Cl)ncc2ccncc12>>Cc1c(C=CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het6Het6.AlkeneTerminal
heck	2287	Cc1c(Cl)ncc2ccccc12.C=CCCCc1c(Cl)ncc2ccccc12>>Cc1c(C=CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Chloride_Het6Phe.AlkeneTerminal
heck	2288	Cc1cocc1I.C=CCCCc1cocc1I>>Cc1cocc1C=CCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het5.AlkeneTerminal
heck	2289	Cc1c(I)oc2cocc12.C=CCCCc1c(I)oc2cocc12>>Cc1c(C=CCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het5Het5.AlkeneTerminal
heck	2290	Cc1c(I)oc2ccncc12.C=CCCCc1c(I)oc2ccncc12>>Cc1c(C=CCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het5Het6.AlkeneTerminal
heck	2291	Cc1c(I)oc2ccccc12.C=CCCCc1c(I)oc2ccccc12>>Cc1c(C=CCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het5Phe.AlkeneTerminal
heck	2292	Cc1cnccc1I.C=CCCCc1cnccc1I>>Cc1cnccc1C=CCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het6.AlkeneTerminal
heck	2293	Cc1nc2cocc2cc1I.C=CCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1C=CCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het6Het5.AlkeneTerminal
heck	2294	Cc1c(I)ncc2ccncc12.C=CCCCc1c(I)ncc2ccncc12>>Cc1c(C=CCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het6Het6.AlkeneTerminal
heck	2295	Cc1c(I)ncc2ccccc12.C=CCCCc1c(I)ncc2ccccc12>>Cc1c(C=CCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_Het6Phe.AlkeneTerminal
heck	2296	Cc1cc2cocc2cc1I.C=CCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1C=CCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_PheHet5.AlkeneTerminal
heck	2297	CCc1c(I)ccc2ccncc12.C=CCCCCc1c(I)ccc2ccncc12>>CCc1c(C=CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Iodide_PheHet6.AlkeneTerminal
heck	2298	Cc1cocc1OS(=O)(=O)C(F)(F)F.C=CCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1C=CCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het5.AlkeneTerminal
heck	2299	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het5Het5.AlkeneTerminal
heck	2300	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het5Het6.AlkeneTerminal
heck	2301	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het5Phe.AlkeneTerminal
heck	2302	Cc1cnccc1OS(=O)(=O)C(F)(F)F.C=CCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C=CCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het6.AlkeneTerminal
heck	2303	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.C=CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1C=CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het6Het5.AlkeneTerminal
heck	2304	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het6Het6.AlkeneTerminal
heck	2305	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_Het6Phe.AlkeneTerminal
heck	2306	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.C=CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1C=CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_PheHet5.AlkeneTerminal
heck	2307	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.C=CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(C=CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[a:2]C=[#6:4]	X-Triflate_PheHet6.AlkeneTerminal
horner_wadsworth_emmons	2308	CCCCP(=O)(OC)OCC.CCOP(=O)(CCCCCC=O)OC>>C=CCCCCCP(=O)(OC)OCC	[O;$([O;D2;$(OC);!$(OC=C);!$(OC#C);!$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][A:4]>>[*:2]=C[*:4]	PhosphoricEster_SaturatedAliphatic.Aldehyde_SaturatedAliphatic
horner_wadsworth_emmons	2309	CCCCP(=O)(OC)OCC.CCOP(=O)(CCCCCC=CC=O)OC>>C=CC=CCCCCCP(=O)(OC)OCC	[O;$([O;D2;$(OC);!$(OC=C);!$(OC#C);!$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][A:4]>>[*:2]=C[*:4]	PhosphoricEster_SaturatedAliphatic.Aldehyde_UnsaturatedAliphatic
horner_wadsworth_emmons	2310	CCCCP(=O)(OC)OCC.CCOP(=O)(CCCCc1ccccc1C=O)OC>>C=Cc1ccccc1CCCCP(=O)(OC)OCC	[O;$([O;D2;$(OC);!$(OC=C);!$(OC#C);!$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):3][a:4]>>[*:2]=C[*:4]	PhosphoricEster_SaturatedAliphatic.Aldehyde_Aromatic
horner_wadsworth_emmons	2311	CCCCP(=O)(OC)OCC.CCOP(=O)(CCCCc1ccncc1C=O)OC>>C=Cc1cnccc1CCCCP(=O)(OC)OCC	[O;$([O;D2;$(OC);!$(OC=C);!$(OC#C);!$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[*:2]=C[*:4]	PhosphoricEster_SaturatedAliphatic.Aldehyde_Heteroaromatic
horner_wadsworth_emmons	2312	C=COP(=O)(CCCC)OC.C=COP(=O)(CCCCCC=O)OC>>C=C=CCCCCCP(=O)(OC)OC=C	[O;$([O;D2;$(OC=C),$(OC#C),$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][A:4]>>[*:2]=C[*:4]	PhosphoricEster_UnsaturatedAliphatic.Aldehyde_SaturatedAliphatic
horner_wadsworth_emmons	2313	C=COP(=O)(CCCC)OC.C=COP(=O)(CCCCCC=CC=O)OC>>C=C=CC=CCCCCCP(=O)(OC)OC=C	[O;$([O;D2;$(OC=C),$(OC#C),$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;H1,H2]=O);!$(C(=O)[!#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][A:4]>>[*:2]=C[*:4]	PhosphoricEster_UnsaturatedAliphatic.Aldehyde_UnsaturatedAliphatic
horner_wadsworth_emmons	2314	C=COP(=O)(CCCC)OC.C=COP(=O)(CCCCc1ccccc1C=O)OC>>C=C=Cc1ccccc1CCCCP(=O)(OC)OC=C	[O;$([O;D2;$(OC=C),$(OC#C),$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[c;$(c1ccccc1)])]):3][a:4]>>[*:2]=C[*:4]	PhosphoricEster_UnsaturatedAliphatic.Aldehyde_Aromatic
horner_wadsworth_emmons	2315	C=COP(=O)(CCCC)OC.C=COP(=O)(CCCCc1ccncc1C=O)OC>>C=C=Cc1cnccc1CCCCP(=O)(OC)OC=C	[O;$([O;D2;$(OC=C),$(OC#C),$(OC#N)]P(=O)):1](P(=O)O)[*:2].[C;$([C;D1,D2;H1,H2]=O);!$(C(=O)[!#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[*:2]=C[*:4]	PhosphoricEster_UnsaturatedAliphatic.Aldehyde_Heteroaromatic
negishi_insitu	2316	CCCCl.ClCCCc1ccccc1Br>>CCCc1ccccc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Phe
negishi_insitu	2317	CCCCl.ClCCCc1c(Br)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PhePhe
negishi_insitu	2318	CCCCl.ClCCCc1ccccc1I>>CCCc1ccccc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Phe
negishi_insitu	2319	CCCCl.ClCCCc1c(I)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_PhePhe
negishi_insitu	2320	CCCCl.O=S(=O)(Oc1cccc(CCCCl)c1)C(F)(F)F>>CCCc1cccc(CCCCl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Phe
negishi_insitu	2321	CCCCl.O=S(=O)(Oc1ccc2ccccc2c1CCCCl)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_PhePhe
negishi_insitu	2322	CCCCl.ClCCCc1cocc1Br>>CCCc1cocc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5
negishi_insitu	2323	CCCCl.ClCCCc1c(Br)oc2cocc12>>CCCc1oc2cocc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Het5
negishi_insitu	2324	CCCCl.ClCCCc1c(Br)oc2ccncc12>>CCCc1oc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Het6
negishi_insitu	2325	CCCCl.ClCCCc1c(Br)oc2ccccc12>>CCCc1oc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Phe
negishi_insitu	2326	CCCCl.ClCCCc1cnccc1Br>>CCCc1ccncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6
negishi_insitu	2327	CCCCl.ClCCCc1nc2cocc2cc1Br>>CCCc1cc2cocc2nc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Het5
negishi_insitu	2328	CCCCl.ClCCCc1c(Br)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Het6
negishi_insitu	2329	CCCCl.ClCCCc1c(Br)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Phe
negishi_insitu	2330	CCCCl.ClCCCc1cc2cocc2cc1Br>>CCCc1cc2cocc2cc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PheHet5
negishi_insitu	2331	CCCCl.ClCCCCc1c(Br)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PheHet6
negishi_insitu	2332	CCCCl.ClCCCc1cocc1Cl>>CCCc1cocc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het5
negishi_insitu	2333	CCCCl.ClCCCc1c(Cl)oc2cocc12>>CCCc1oc2cocc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het5Het5
negishi_insitu	2334	CCCCl.ClCCCc1c(Cl)oc2ccncc12>>CCCc1oc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het5Het6
negishi_insitu	2335	CCCCl.ClCCCc1c(Cl)oc2ccccc12>>CCCc1oc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het5Phe
negishi_insitu	2336	CCCCl.ClCCCc1cnccc1Cl>>CCCc1ccncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het6
negishi_insitu	2337	CCCCl.ClCCCc1nc2cocc2cc1Cl>>CCCc1cc2cocc2nc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het6Het5
negishi_insitu	2338	CCCCl.ClCCCc1c(Cl)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het6Het6
negishi_insitu	2339	CCCCl.ClCCCc1c(Cl)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Chloride_Het6Phe
negishi_insitu	2340	CCCCl.ClCCCc1cocc1I>>CCCc1cocc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het5
negishi_insitu	2341	CCCCl.ClCCCc1c(I)oc2cocc12>>CCCc1oc2cocc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het5Het5
negishi_insitu	2342	CCCCl.ClCCCc1c(I)oc2ccncc12>>CCCc1oc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het5Het6
negishi_insitu	2343	CCCCl.ClCCCc1c(I)oc2ccccc12>>CCCc1oc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het5Phe
negishi_insitu	2344	CCCCl.ClCCCc1cnccc1I>>CCCc1ccncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het6
negishi_insitu	2345	CCCCl.ClCCCc1nc2cocc2cc1I>>CCCc1cc2cocc2nc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het6Het5
negishi_insitu	2346	CCCCl.ClCCCc1c(I)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het6Het6
negishi_insitu	2347	CCCCl.ClCCCc1c(I)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_Het6Phe
negishi_insitu	2348	CCCCl.ClCCCc1cc2cocc2cc1I>>CCCc1cc2cocc2cc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_PheHet5
negishi_insitu	2349	CCCCl.ClCCCCc1c(I)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Iodide_PheHet6
negishi_insitu	2350	CCCCl.O=S(=O)(Oc1cocc1CCCCl)C(F)(F)F>>CCCc1cocc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het5
negishi_insitu	2351	CCCCl.O=S(=O)(Oc1oc2cocc2c1CCCCl)C(F)(F)F>>CCCc1oc2cocc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het5Het5
negishi_insitu	2352	CCCCl.O=S(=O)(Oc1oc2ccncc2c1CCCCl)C(F)(F)F>>CCCc1oc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het5Het6
negishi_insitu	2353	CCCCl.O=S(=O)(Oc1oc2ccccc2c1CCCCl)C(F)(F)F>>CCCc1oc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het5Phe
negishi_insitu	2354	CCCCl.O=S(=O)(Oc1ccncc1CCCCl)C(F)(F)F>>CCCc1ccncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het6
negishi_insitu	2355	CCCCl.O=S(=O)(Oc1cc2cocc2nc1CCCCl)C(F)(F)F>>CCCc1cc2cocc2nc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het6Het5
negishi_insitu	2356	CCCCl.O=S(=O)(Oc1ncc2ccncc2c1CCCCl)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het6Het6
negishi_insitu	2357	CCCCl.O=S(=O)(Oc1ncc2ccccc2c1CCCCl)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_Het6Phe
negishi_insitu	2358	CCCCl.O=S(=O)(Oc1cc2cocc2cc1CCCCl)C(F)(F)F>>CCCc1cc2cocc2cc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_PheHet5
negishi_insitu	2359	CCCCl.O=S(=O)(Oc1ccc2ccncc2c1CCCCl)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Triflate_PheHet6
negishi_insitu	2360	CCCBr.BrCCCc1ccccc1Br>>CCCc1ccccc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Phe
negishi_insitu	2361	CCCBr.BrCCCc1c(Br)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PhePhe
negishi_insitu	2362	CCCBr.BrCCCc1ccccc1I>>CCCc1ccccc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Phe
negishi_insitu	2363	CCCBr.BrCCCc1c(I)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_PhePhe
negishi_insitu	2364	CCCBr.O=S(=O)(Oc1cccc(CCCBr)c1)C(F)(F)F>>CCCc1cccc(CCCBr)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Phe
negishi_insitu	2365	CCCBr.O=S(=O)(Oc1ccc2ccccc2c1CCCBr)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_PhePhe
negishi_insitu	2366	CCCBr.BrCCCc1cocc1Br>>CCCc1cocc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5
negishi_insitu	2367	CCCBr.BrCCCc1c(Br)oc2cocc12>>CCCc1oc2cocc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Het5
negishi_insitu	2368	CCCBr.BrCCCc1c(Br)oc2ccncc12>>CCCc1oc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Het6
negishi_insitu	2369	CCCBr.BrCCCc1c(Br)oc2ccccc12>>CCCc1oc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Phe
negishi_insitu	2370	CCCBr.BrCCCc1cnccc1Br>>CCCc1ccncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6
negishi_insitu	2371	CCCBr.BrCCCc1nc2cocc2cc1Br>>CCCc1cc2cocc2nc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Het5
negishi_insitu	2372	CCCBr.BrCCCc1c(Br)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Het6
negishi_insitu	2373	CCCBr.BrCCCc1c(Br)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Phe
negishi_insitu	2374	CCCBr.BrCCCc1cc2cocc2cc1Br>>CCCc1cc2cocc2cc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PheHet5
negishi_insitu	2375	CCCBr.BrCCCCc1c(Br)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PheHet6
negishi_insitu	2376	CCCBr.Clc1cocc1CCCBr>>CCCc1cocc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het5
negishi_insitu	2377	CCCBr.Clc1oc2cocc2c1CCCBr>>CCCc1oc2cocc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het5Het5
negishi_insitu	2378	CCCBr.Clc1oc2ccncc2c1CCCBr>>CCCc1oc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het5Het6
negishi_insitu	2379	CCCBr.Clc1oc2ccccc2c1CCCBr>>CCCc1oc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het5Phe
negishi_insitu	2380	CCCBr.Clc1ccncc1CCCBr>>CCCc1ccncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het6
negishi_insitu	2381	CCCBr.Clc1cc2cocc2nc1CCCBr>>CCCc1cc2cocc2nc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het6Het5
negishi_insitu	2382	CCCBr.Clc1ncc2ccncc2c1CCCBr>>CCCc1ncc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het6Het6
negishi_insitu	2383	CCCBr.Clc1ncc2ccccc2c1CCCBr>>CCCc1ncc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Chloride_Het6Phe
negishi_insitu	2384	CCCBr.BrCCCc1cocc1I>>CCCc1cocc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het5
negishi_insitu	2385	CCCBr.BrCCCc1c(I)oc2cocc12>>CCCc1oc2cocc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het5Het5
negishi_insitu	2386	CCCBr.BrCCCc1c(I)oc2ccncc12>>CCCc1oc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het5Het6
negishi_insitu	2387	CCCBr.BrCCCc1c(I)oc2ccccc12>>CCCc1oc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het5Phe
negishi_insitu	2388	CCCBr.BrCCCc1cnccc1I>>CCCc1ccncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het6
negishi_insitu	2389	CCCBr.BrCCCc1nc2cocc2cc1I>>CCCc1cc2cocc2nc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het6Het5
negishi_insitu	2390	CCCBr.BrCCCc1c(I)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het6Het6
negishi_insitu	2391	CCCBr.BrCCCc1c(I)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_Het6Phe
negishi_insitu	2392	CCCBr.BrCCCc1cc2cocc2cc1I>>CCCc1cc2cocc2cc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_PheHet5
negishi_insitu	2393	CCCBr.BrCCCCc1c(I)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Iodide_PheHet6
negishi_insitu	2394	CCCBr.O=S(=O)(Oc1cocc1CCCBr)C(F)(F)F>>CCCc1cocc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het5
negishi_insitu	2395	CCCBr.O=S(=O)(Oc1oc2cocc2c1CCCBr)C(F)(F)F>>CCCc1oc2cocc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het5Het5
negishi_insitu	2396	CCCBr.O=S(=O)(Oc1oc2ccncc2c1CCCBr)C(F)(F)F>>CCCc1oc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het5Het6
negishi_insitu	2397	CCCBr.O=S(=O)(Oc1oc2ccccc2c1CCCBr)C(F)(F)F>>CCCc1oc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het5Phe
negishi_insitu	2398	CCCBr.O=S(=O)(Oc1ccncc1CCCBr)C(F)(F)F>>CCCc1ccncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het6
negishi_insitu	2399	CCCBr.O=S(=O)(Oc1cc2cocc2nc1CCCBr)C(F)(F)F>>CCCc1cc2cocc2nc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het6Het5
negishi_insitu	2400	CCCBr.O=S(=O)(Oc1ncc2ccncc2c1CCCBr)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het6Het6
negishi_insitu	2401	CCCBr.O=S(=O)(Oc1ncc2ccccc2c1CCCBr)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_Het6Phe
negishi_insitu	2402	CCCBr.O=S(=O)(Oc1cc2cocc2cc1CCCBr)C(F)(F)F>>CCCc1cc2cocc2cc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_PheHet5
negishi_insitu	2403	CCCBr.O=S(=O)(Oc1ccc2ccncc2c1CCCBr)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Triflate_PheHet6
negishi_insitu	2404	CCCI.Brc1ccccc1CCCI>>CCCc1ccccc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Phe
negishi_insitu	2405	CCCI.Brc1ccc2ccccc2c1CCCI>>CCCc1ccc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_PhePhe
negishi_insitu	2406	CCCI.ICCCc1ccccc1I>>CCCc1ccccc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Phe
negishi_insitu	2407	CCCI.ICCCc1c(I)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_PhePhe
negishi_insitu	2408	CCCI.O=S(=O)(Oc1cccc(CCCI)c1)C(F)(F)F>>CCCc1cccc(CCCI)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Phe
negishi_insitu	2409	CCCI.O=S(=O)(Oc1ccc2ccccc2c1CCCI)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_PhePhe
negishi_insitu	2410	CCCI.Brc1cocc1CCCI>>CCCc1cocc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het5
negishi_insitu	2411	CCCI.Brc1oc2cocc2c1CCCI>>CCCc1oc2cocc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het5Het5
negishi_insitu	2412	CCCI.Brc1oc2ccncc2c1CCCI>>CCCc1oc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het5Het6
negishi_insitu	2413	CCCI.Brc1oc2ccccc2c1CCCI>>CCCc1oc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het5Phe
negishi_insitu	2414	CCCI.Brc1ccncc1CCCI>>CCCc1ccncc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het6
negishi_insitu	2415	CCCI.Brc1cc2cocc2nc1CCCI>>CCCc1cc2cocc2nc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het6Het5
negishi_insitu	2416	CCCI.Brc1ncc2ccncc2c1CCCI>>CCCc1ncc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het6Het6
negishi_insitu	2417	CCCI.Brc1ncc2ccccc2c1CCCI>>CCCc1ncc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_Het6Phe
negishi_insitu	2418	CCCI.Brc1cc2cocc2cc1CCCI>>CCCc1cc2cocc2cc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_PheHet5
negishi_insitu	2419	CCCI.Brc1ccc2ccncc2c1CCCCI>>CCCc1ccc2ccncc2c1CCCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Bromide_PheHet6
negishi_insitu	2420	CCCI.Clc1cocc1CCCI>>CCCc1cocc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het5
negishi_insitu	2421	CCCI.Clc1oc2cocc2c1CCCI>>CCCc1oc2cocc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het5Het5
negishi_insitu	2422	CCCI.Clc1oc2ccncc2c1CCCI>>CCCc1oc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het5Het6
negishi_insitu	2423	CCCI.Clc1oc2ccccc2c1CCCI>>CCCc1oc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het5Phe
negishi_insitu	2424	CCCI.Clc1ccncc1CCCI>>CCCc1ccncc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het6
negishi_insitu	2425	CCCI.Clc1cc2cocc2nc1CCCI>>CCCc1cc2cocc2nc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het6Het5
negishi_insitu	2426	CCCI.Clc1ncc2ccncc2c1CCCI>>CCCc1ncc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het6Het6
negishi_insitu	2427	CCCI.Clc1ncc2ccccc2c1CCCI>>CCCc1ncc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Chloride_Het6Phe
negishi_insitu	2428	CCCI.ICCCc1cocc1I>>CCCc1cocc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het5
negishi_insitu	2429	CCCI.ICCCc1c(I)oc2cocc12>>CCCc1oc2cocc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het5Het5
negishi_insitu	2430	CCCI.ICCCc1c(I)oc2ccncc12>>CCCc1oc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het5Het6
negishi_insitu	2431	CCCI.ICCCc1c(I)oc2ccccc12>>CCCc1oc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het5Phe
negishi_insitu	2432	CCCI.ICCCc1cnccc1I>>CCCc1ccncc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het6
negishi_insitu	2433	CCCI.ICCCc1nc2cocc2cc1I>>CCCc1cc2cocc2nc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het6Het5
negishi_insitu	2434	CCCI.ICCCc1c(I)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het6Het6
negishi_insitu	2435	CCCI.ICCCc1c(I)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_Het6Phe
negishi_insitu	2436	CCCI.ICCCc1cc2cocc2cc1I>>CCCc1cc2cocc2cc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_PheHet5
negishi_insitu	2437	CCCI.ICCCCc1c(I)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Iodide_PheHet6
negishi_insitu	2438	CCCI.O=S(=O)(Oc1cocc1CCCI)C(F)(F)F>>CCCc1cocc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het5
negishi_insitu	2439	CCCI.O=S(=O)(Oc1oc2cocc2c1CCCI)C(F)(F)F>>CCCc1oc2cocc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het5Het5
negishi_insitu	2440	CCCI.O=S(=O)(Oc1oc2ccncc2c1CCCI)C(F)(F)F>>CCCc1oc2ccncc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het5Het6
negishi_insitu	2441	CCCI.O=S(=O)(Oc1oc2ccccc2c1CCCI)C(F)(F)F>>CCCc1oc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het5Phe
negishi_insitu	2442	CCCI.O=S(=O)(Oc1ccncc1CCCI)C(F)(F)F>>CCCc1ccncc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het6
negishi_insitu	2443	CCCI.O=S(=O)(Oc1cc2cocc2nc1CCCI)C(F)(F)F>>CCCc1cc2cocc2nc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het6Het5
negishi_insitu	2444	CCCI.O=S(=O)(Oc1ncc2ccncc2c1CCCI)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het6Het6
negishi_insitu	2445	CCCI.O=S(=O)(Oc1ncc2ccccc2c1CCCI)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_Het6Phe
negishi_insitu	2446	CCCI.O=S(=O)(Oc1cc2cocc2cc1CCCI)C(F)(F)F>>CCCc1cc2cocc2cc1CCCI	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_PheHet5
negishi_insitu	2447	CCCI.O=S(=O)(Oc1ccc2ccncc2c1CCCI)C(F)(F)F>>CCCS(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Iodide_Aliph.X-Triflate_PheHet6
negishi_insitu	2448	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1ccccc1Br)C(F)(F)F>>CCCc1ccccc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Phe
negishi_insitu	2449	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)ccc2ccccc12)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_PhePhe
negishi_insitu	2450	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1ccccc1I)C(F)(F)F>>CCCc1ccccc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Phe
negishi_insitu	2451	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)ccc2ccccc12)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_PhePhe
negishi_insitu	2452	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>CCCc1cccc(CCCOS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Phe
negishi_insitu	2453	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>CCCc1ccc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_PhePhe
negishi_insitu	2454	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cocc1Br)C(F)(F)F>>CCCc1cocc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het5
negishi_insitu	2455	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)oc2cocc12)C(F)(F)F>>CCCc1oc2cocc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het5Het5
negishi_insitu	2456	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)oc2ccncc12)C(F)(F)F>>CCCc1oc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het5Het6
negishi_insitu	2457	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)oc2ccccc12)C(F)(F)F>>CCCc1oc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het5Phe
negishi_insitu	2458	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cnccc1Br)C(F)(F)F>>CCCc1ccncc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het6
negishi_insitu	2459	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1nc2cocc2cc1Br)C(F)(F)F>>CCCc1cc2cocc2nc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het6Het5
negishi_insitu	2460	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)ncc2ccncc12)C(F)(F)F>>CCCc1ncc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het6Het6
negishi_insitu	2461	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Br)ncc2ccccc12)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_Het6Phe
negishi_insitu	2462	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cc2cocc2cc1Br)C(F)(F)F>>CCCc1cc2cocc2cc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_PheHet5
negishi_insitu	2463	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCCc1ccc2ccncc2c1CCCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Bromide_PheHet6
negishi_insitu	2464	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cocc1Cl)C(F)(F)F>>CCCc1cocc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het5
negishi_insitu	2465	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Cl)oc2cocc12)C(F)(F)F>>CCCc1oc2cocc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het5Het5
negishi_insitu	2466	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Cl)oc2ccncc12)C(F)(F)F>>CCCc1oc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het5Het6
negishi_insitu	2467	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Cl)oc2ccccc12)C(F)(F)F>>CCCc1oc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het5Phe
negishi_insitu	2468	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cnccc1Cl)C(F)(F)F>>CCCc1ccncc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het6
negishi_insitu	2469	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1nc2cocc2cc1Cl)C(F)(F)F>>CCCc1cc2cocc2nc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het6Het5
negishi_insitu	2470	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Cl)ncc2ccncc12)C(F)(F)F>>CCCc1ncc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het6Het6
negishi_insitu	2471	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(Cl)ncc2ccccc12)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Chloride_Het6Phe
negishi_insitu	2472	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cocc1I)C(F)(F)F>>CCCc1cocc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het5
negishi_insitu	2473	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)oc2cocc12)C(F)(F)F>>CCCc1oc2cocc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het5Het5
negishi_insitu	2474	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)oc2ccncc12)C(F)(F)F>>CCCc1oc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het5Het6
negishi_insitu	2475	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)oc2ccccc12)C(F)(F)F>>CCCc1oc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het5Phe
negishi_insitu	2476	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cnccc1I)C(F)(F)F>>CCCc1ccncc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het6
negishi_insitu	2477	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1nc2cocc2cc1I)C(F)(F)F>>CCCc1cc2cocc2nc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het6Het5
negishi_insitu	2478	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)ncc2ccncc12)C(F)(F)F>>CCCc1ncc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het6Het6
negishi_insitu	2479	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(I)ncc2ccccc12)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_Het6Phe
negishi_insitu	2480	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cc2cocc2cc1I)C(F)(F)F>>CCCc1cc2cocc2cc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_PheHet5
negishi_insitu	2481	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCCc1c(I)ccc2ccncc12)C(F)(F)F>>CCCc1ccc2ccncc2c1CCCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Iodide_PheHet6
negishi_insitu	2482	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cocc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>CCCc1cocc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het5
negishi_insitu	2483	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>CCCc1oc2cocc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het5Het5
negishi_insitu	2484	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>CCCc1oc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het5Het6
negishi_insitu	2485	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>CCCc1oc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het5Phe
negishi_insitu	2486	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cnccc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>CCCc1ccncc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het6
negishi_insitu	2487	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>CCCc1cc2cocc2nc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het6Het5
negishi_insitu	2488	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>CCCc1ncc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het6Het6
negishi_insitu	2489	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>CCCc1ncc2ccccc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_Het6Phe
negishi_insitu	2490	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>CCCc1cc2cocc2cc1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_PheHet5
negishi_insitu	2491	CCCOS(=O)(=O)C(F)(F)F.O=S(=O)(OCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>CCCc1ccc2ccncc2c1CCCOS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][C:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Triflate_Aliph.X-Triflate_PheHet6
sonogashira	2492	Cc1ccccc1Br.C#Cc1ccccc1CCc1ccccc1Br>>Cc1ccccc1C#Cc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Phe.AlkyneTerminalAromatic
sonogashira	2493	Cc1ccccc1Br.C#CCCCc1ccccc1Br>>Cc1ccccc1C#CCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Phe.AlkyneTerminalAliphatic
sonogashira	2494	Cc1c(Br)ccc2ccccc12.C#Cc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_PhePhe.AlkyneTerminalAromatic
sonogashira	2495	Cc1c(Br)ccc2ccccc12.C#CCCCc1c(Br)ccc2ccccc12>>Cc1c(C#CCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_PhePhe.AlkyneTerminalAliphatic
sonogashira	2496	Cc1ccccc1I.C#Cc1ccccc1CCc1ccccc1I>>Cc1ccccc1C#Cc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Phe.AlkyneTerminalAromatic
sonogashira	2497	Cc1ccccc1I.C#CCCCc1ccccc1I>>Cc1ccccc1C#CCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Phe.AlkyneTerminalAliphatic
sonogashira	2498	Cc1c(I)ccc2ccccc12.C#Cc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_PhePhe.AlkyneTerminalAromatic
sonogashira	2499	Cc1c(I)ccc2ccccc12.C#CCCCc1c(I)ccc2ccccc12>>Cc1c(C#CCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_PhePhe.AlkyneTerminalAliphatic
sonogashira	2500	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.C#Cc1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(C#Cc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Phe.AlkyneTerminalAromatic
sonogashira	2501	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.C#CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(C#CCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Phe.AlkyneTerminalAliphatic
sonogashira	2502	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_PhePhe.AlkyneTerminalAromatic
sonogashira	2503	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_PhePhe.AlkyneTerminalAliphatic
sonogashira	2504	Cc1cocc1Br.C#Cc1ccccc1CCc1cocc1Br>>Cc1cocc1C#Cc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het5.AlkyneTerminalAromatic
sonogashira	2505	Cc1cocc1Br.C#CCCCc1cocc1Br>>Cc1cocc1C#CCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het5.AlkyneTerminalAliphatic
sonogashira	2506	Cc1c(Br)oc2cocc12.C#Cc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het5Het5.AlkyneTerminalAromatic
sonogashira	2507	Cc1c(Br)oc2cocc12.C#CCCCc1c(Br)oc2cocc12>>Cc1c(C#CCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het5Het5.AlkyneTerminalAliphatic
sonogashira	2508	Cc1c(Br)oc2ccncc12.C#Cc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het5Het6.AlkyneTerminalAromatic
sonogashira	2509	Cc1c(Br)oc2ccncc12.C#CCCCc1c(Br)oc2ccncc12>>Cc1c(C#CCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het5Het6.AlkyneTerminalAliphatic
sonogashira	2510	Cc1c(Br)oc2ccccc12.C#Cc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het5Phe.AlkyneTerminalAromatic
sonogashira	2511	Cc1c(Br)oc2ccccc12.C#CCCCc1c(Br)oc2ccccc12>>Cc1c(C#CCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het5Phe.AlkyneTerminalAliphatic
sonogashira	2512	Cc1cnccc1Br.C#Cc1ccccc1CCc1cnccc1Br>>Cc1cnccc1C#Cc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het6.AlkyneTerminalAromatic
sonogashira	2513	Cc1cnccc1Br.C#CCCCc1cnccc1Br>>Cc1cnccc1C#CCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het6.AlkyneTerminalAliphatic
sonogashira	2514	Cc1nc2cocc2cc1Br.C#Cc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1C#Cc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het6Het5.AlkyneTerminalAromatic
sonogashira	2515	Cc1nc2cocc2cc1Br.C#CCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1C#CCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het6Het5.AlkyneTerminalAliphatic
sonogashira	2516	Cc1c(Br)ncc2ccncc12.C#Cc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het6Het6.AlkyneTerminalAromatic
sonogashira	2517	Cc1c(Br)ncc2ccncc12.C#CCCCc1c(Br)ncc2ccncc12>>Cc1c(C#CCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het6Het6.AlkyneTerminalAliphatic
sonogashira	2518	Cc1c(Br)ncc2ccccc12.C#Cc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_Het6Phe.AlkyneTerminalAromatic
sonogashira	2519	Cc1c(Br)ncc2ccccc12.C#CCCCc1c(Br)ncc2ccccc12>>Cc1c(C#CCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_Het6Phe.AlkyneTerminalAliphatic
sonogashira	2520	Cc1cc2cocc2cc1Br.C#Cc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1C#Cc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_PheHet5.AlkyneTerminalAromatic
sonogashira	2521	Cc1cc2cocc2cc1Br.C#CCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1C#CCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_PheHet5.AlkyneTerminalAliphatic
sonogashira	2522	CCc1c(Br)ccc2ccncc12.C#Cc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(C#Cc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Bromide_PheHet6.AlkyneTerminalAromatic
sonogashira	2523	CCc1c(Br)ccc2ccncc12.C#CCCCCc1c(Br)ccc2ccncc12>>CCc1c(C#CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Bromide_PheHet6.AlkyneTerminalAliphatic
sonogashira	2524	Cc1cocc1Cl.C#Cc1ccccc1CCc1cocc1Cl>>Cc1cocc1C#Cc1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het5.AlkyneTerminalAromatic
sonogashira	2525	Cc1cocc1Cl.C#CCCCc1cocc1Cl>>Cc1cocc1C#CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het5.AlkyneTerminalAliphatic
sonogashira	2526	Cc1c(Cl)oc2cocc12.C#Cc1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c(C#Cc2ccccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het5Het5.AlkyneTerminalAromatic
sonogashira	2527	Cc1c(Cl)oc2cocc12.C#CCCCc1c(Cl)oc2cocc12>>Cc1c(C#CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het5Het5.AlkyneTerminalAliphatic
sonogashira	2528	Cc1c(Cl)oc2ccncc12.C#Cc1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het5Het6.AlkyneTerminalAromatic
sonogashira	2529	Cc1c(Cl)oc2ccncc12.C#CCCCc1c(Cl)oc2ccncc12>>Cc1c(C#CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het5Het6.AlkyneTerminalAliphatic
sonogashira	2530	Cc1c(Cl)oc2ccccc12.C#Cc1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het5Phe.AlkyneTerminalAromatic
sonogashira	2531	Cc1c(Cl)oc2ccccc12.C#CCCCc1c(Cl)oc2ccccc12>>Cc1c(C#CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het5Phe.AlkyneTerminalAliphatic
sonogashira	2532	Cc1cnccc1Cl.C#Cc1ccccc1CCc1cnccc1Cl>>Cc1cnccc1C#Cc1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het6.AlkyneTerminalAromatic
sonogashira	2533	Cc1cnccc1Cl.C#CCCCc1cnccc1Cl>>Cc1cnccc1C#CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het6.AlkyneTerminalAliphatic
sonogashira	2534	Cc1nc2cocc2cc1Cl.C#Cc1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1C#Cc1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het6Het5.AlkyneTerminalAromatic
sonogashira	2535	Cc1nc2cocc2cc1Cl.C#CCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1C#CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het6Het5.AlkyneTerminalAliphatic
sonogashira	2536	Cc1c(Cl)ncc2ccncc12.C#Cc1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het6Het6.AlkyneTerminalAromatic
sonogashira	2537	Cc1c(Cl)ncc2ccncc12.C#CCCCc1c(Cl)ncc2ccncc12>>Cc1c(C#CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het6Het6.AlkyneTerminalAliphatic
sonogashira	2538	Cc1c(Cl)ncc2ccccc12.C#Cc1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Chloride_Het6Phe.AlkyneTerminalAromatic
sonogashira	2539	Cc1c(Cl)ncc2ccccc12.C#CCCCc1c(Cl)ncc2ccccc12>>Cc1c(C#CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Chloride_Het6Phe.AlkyneTerminalAliphatic
sonogashira	2540	Cc1cocc1I.C#Cc1ccccc1CCc1cocc1I>>Cc1cocc1C#Cc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het5.AlkyneTerminalAromatic
sonogashira	2541	Cc1cocc1I.C#CCCCc1cocc1I>>Cc1cocc1C#CCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het5.AlkyneTerminalAliphatic
sonogashira	2542	Cc1c(I)oc2cocc12.C#Cc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(C#Cc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het5Het5.AlkyneTerminalAromatic
sonogashira	2543	Cc1c(I)oc2cocc12.C#CCCCc1c(I)oc2cocc12>>Cc1c(C#CCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het5Het5.AlkyneTerminalAliphatic
sonogashira	2544	Cc1c(I)oc2ccncc12.C#Cc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het5Het6.AlkyneTerminalAromatic
sonogashira	2545	Cc1c(I)oc2ccncc12.C#CCCCc1c(I)oc2ccncc12>>Cc1c(C#CCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het5Het6.AlkyneTerminalAliphatic
sonogashira	2546	Cc1c(I)oc2ccccc12.C#Cc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het5Phe.AlkyneTerminalAromatic
sonogashira	2547	Cc1c(I)oc2ccccc12.C#CCCCc1c(I)oc2ccccc12>>Cc1c(C#CCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het5Phe.AlkyneTerminalAliphatic
sonogashira	2548	Cc1cnccc1I.C#Cc1ccccc1CCc1cnccc1I>>Cc1cnccc1C#Cc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het6.AlkyneTerminalAromatic
sonogashira	2549	Cc1cnccc1I.C#CCCCc1cnccc1I>>Cc1cnccc1C#CCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het6.AlkyneTerminalAliphatic
sonogashira	2550	Cc1nc2cocc2cc1I.C#Cc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1C#Cc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het6Het5.AlkyneTerminalAromatic
sonogashira	2551	Cc1nc2cocc2cc1I.C#CCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1C#CCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het6Het5.AlkyneTerminalAliphatic
sonogashira	2552	Cc1c(I)ncc2ccncc12.C#Cc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het6Het6.AlkyneTerminalAromatic
sonogashira	2553	Cc1c(I)ncc2ccncc12.C#CCCCc1c(I)ncc2ccncc12>>Cc1c(C#CCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het6Het6.AlkyneTerminalAliphatic
sonogashira	2554	Cc1c(I)ncc2ccccc12.C#Cc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_Het6Phe.AlkyneTerminalAromatic
sonogashira	2555	Cc1c(I)ncc2ccccc12.C#CCCCc1c(I)ncc2ccccc12>>Cc1c(C#CCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_Het6Phe.AlkyneTerminalAliphatic
sonogashira	2556	Cc1cc2cocc2cc1I.C#Cc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1C#Cc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_PheHet5.AlkyneTerminalAromatic
sonogashira	2557	Cc1cc2cocc2cc1I.C#CCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1C#CCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_PheHet5.AlkyneTerminalAliphatic
sonogashira	2558	CCc1c(I)ccc2ccncc12.C#Cc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(C#Cc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Iodide_PheHet6.AlkyneTerminalAromatic
sonogashira	2559	CCc1c(I)ccc2ccncc12.C#CCCCCc1c(I)ccc2ccncc12>>CCc1c(C#CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Iodide_PheHet6.AlkyneTerminalAliphatic
sonogashira	2560	Cc1cocc1OS(=O)(=O)C(F)(F)F.C#Cc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1C#Cc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het5.AlkyneTerminalAromatic
sonogashira	2561	Cc1cocc1OS(=O)(=O)C(F)(F)F.C#CCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1C#CCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het5.AlkyneTerminalAliphatic
sonogashira	2562	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het5Het5.AlkyneTerminalAromatic
sonogashira	2563	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het5Het5.AlkyneTerminalAliphatic
sonogashira	2564	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het5Het6.AlkyneTerminalAromatic
sonogashira	2565	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het5Het6.AlkyneTerminalAliphatic
sonogashira	2566	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het5Phe.AlkyneTerminalAromatic
sonogashira	2567	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het5Phe.AlkyneTerminalAliphatic
sonogashira	2568	Cc1cnccc1OS(=O)(=O)C(F)(F)F.C#Cc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C#Cc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het6.AlkyneTerminalAromatic
sonogashira	2569	Cc1cnccc1OS(=O)(=O)C(F)(F)F.C#CCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C#CCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het6.AlkyneTerminalAliphatic
sonogashira	2570	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.C#Cc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1C#Cc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het6Het5.AlkyneTerminalAromatic
sonogashira	2571	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.C#CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1C#CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het6Het5.AlkyneTerminalAliphatic
sonogashira	2572	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het6Het6.AlkyneTerminalAromatic
sonogashira	2573	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het6Het6.AlkyneTerminalAliphatic
sonogashira	2574	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_Het6Phe.AlkyneTerminalAromatic
sonogashira	2575	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_Het6Phe.AlkyneTerminalAliphatic
sonogashira	2576	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.C#Cc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1C#Cc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_PheHet5.AlkyneTerminalAromatic
sonogashira	2577	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.C#CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1C#CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_PheHet5.AlkyneTerminalAliphatic
sonogashira	2578	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.C#Cc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(C#Cc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[a:2]C#C[a:4]	X-Triflate_PheHet6.AlkyneTerminalAromatic
sonogashira	2579	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.C#CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(C#CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[a:2]C#C[A:4]	X-Triflate_PheHet6.AlkyneTerminalAliphatic
sonogashira	2580	CCOS(C)(=O)=O.C#Cc1ccccc1CCCOS(C)(=O)=O>>CCC#Cc1ccccc1CCCOS(C)(=O)=O	[O;D2;$(O[S;D4](=O)(=O)[#6]);!$(O(S(=O)(=O))S(=O)(=O));!$(OS(=O)(=O)C(F)(F)F):1][*;!S:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[*;!S:2]C#C[a:4]	Mesylate.AlkyneTerminalAromatic
sonogashira	2581	CCOS(C)(=O)=O.C#CCCCCOS(C)(=O)=O>>CCC#CCCCCOS(C)(=O)=O	[O;D2;$(O[S;D4](=O)(=O)[#6]);!$(O(S(=O)(=O))S(=O)(=O));!$(OS(=O)(=O)C(F)(F)F):1][*;!S:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[*;!S:2]C#C[A:4]	Mesylate.AlkyneTerminalAliphatic
triazole_synthesis_2	2582	CCCC(=O)NN.N#CCCCCCC(=O)NN>>CCCc1nc(CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[C;$(C#N);$(C[#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]c1:[nH]:n:c(n:1)[#6:4]	HydrazineTerminalCarbamoyl.Nitrile_SaturatedAliphatic
triazole_synthesis_2	2583	CCCC(=O)NN.N#CC=CCCCCC(=O)NN>>CCCc1nc(C=CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[C;$(C#N);$(C[#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]c1:[nH]:n:c(n:1)[#6:4]	HydrazineTerminalCarbamoyl.Nitrile_UnsaturatedAliphatic
triazole_synthesis_2	2584	CCCC(=O)NN.N#Cc1ccccc1CCCCC(=O)NN>>CCCc1nc(c2ccccc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[C;$(C#N);$(C[#6]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[*:2]c1:[nH]:n:c(n:1)[#6:4]	HydrazineTerminalCarbamoyl.Nitrile_Aromatic
triazole_synthesis_2	2585	CCCC(=O)NN.N#Cc1ccncc1CCCCC(=O)NN>>CCCc1nc(c2ccncc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[C;$(C#N);$(C[#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[*:2]c1:[nH]:n:c(n:1)[#6:4]	HydrazineTerminalCarbamoyl.Nitrile_Heteroaromatic
triazole_synthesis_2	2586	CCCC(=O)NN.NNC(=O)CCCCCN=C=O>>CCCc1nc(CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.IsoCyanate_SaturatedAliphatic
triazole_synthesis_2	2587	CCCC(=O)NN.NNC(=O)CCCCC=CN=C=O>>CCCc1nc(C=CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.IsoCyanate_UnsaturatedAliphatic
triazole_synthesis_2	2588	CCCC(=O)NN.NNC(=O)CCCCc1ccccc1N=C=O>>CCCc1nc(c2ccccc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.IsoCyanate_Aromatic
triazole_synthesis_2	2589	CCCC(=O)NN.NNC(=O)CCCCc1cnccc1N=C=O>>CCCc1nc(c2ccncc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.IsoCyanate_Heteroaromatic
triazole_synthesis_2	2590	CCCC(=O)NN.NNC(=O)CCCCCN=C=S>>CCCc1nc(CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=S);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.ThioisoCyanate_SaturatedAliphatic
triazole_synthesis_2	2591	CCCC(=O)NN.NNC(=O)CCCCC=CN=C=S>>CCCc1nc(C=CCCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=S);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.ThioisoCyanate_UnsaturatedAliphatic
triazole_synthesis_2	2592	CCCC(=O)NN.NNC(=O)CCCCc1ccccc1N=C=S>>CCCc1nc(c2ccccc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=S);$([$(*[c;$(c1ccccc1)])]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.ThioisoCyanate_Aromatic
triazole_synthesis_2	2593	CCCC(=O)NN.NNC(=O)CCCCc1ccncc1N=C=S>>CCCc1nc(c2cnccc2CCCCC(=O)NN)n[nH]1	[N;D1;$(N[N;D2]C(=[O,S])):1]NC(=O)[*:2].[N;$(N=C=S);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][*:4]>>[*:2]c1:[nH]:n:c(n:1)[*:4]	HydrazineTerminalCarbamoyl.ThioisoCyanate_Heteroaromatic
urea_formation	2594	CCCN=C=O.NCCNCCCCCCN=C=O>>CCCNC(=O)N(CCN)CCCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2595	CCCN=C=O.NC=CNCCCCCCN=C=O>>CCCNC(=O)N(C=CN)CCCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2596	CCCN=C=O.NC=CNC=CCCCCN=C=O>>CCCNC(=O)N(C=CN)C=CCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2597	CCCN=C=O.NC1CNCC(CCCCN=C=O)C1>>CCCNC(=O)N1CC(N)CC(CCCCN=C=O)C1	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2598	CCCN=C=O.O=C=NCCCCC1CC=CNC1>>CCCNC(=O)N1C=CCC(CCCCN=C=O)C1	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2599	CCCN=C=O.O=C=NCCCCC1C=CNC=CC1>>CCCNC(=O)N1C=CCC(CCCCN=C=O)C=C1	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2600	CCCN=C=O.NCCNCCCCCN=C=O>>CCCNC(=O)NCCNCCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
urea_formation	2601	CCCN=C=O.NC=CNCCCCCN=C=O>>CCCNC(=O)NC=CNCCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
urea_formation	2602	CCCN=C=O.Nc1cccc(CCCCN=C=O)c1Nc1ccccc1>>CCCNC(=O)N(c1ccccc1)c1c(N)cccc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
urea_formation	2603	CCCN=C=O.NCCNc1ccccc1CCCCCN=C=O>>CCCNC(=O)N(CCN)c1ccccc1CCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2604	CCCN=C=O.NC=CNc1ccccc1CCCCN=C=O>>CCCNC(=O)N(C=CN)c1ccccc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2605	CCCN=C=O.O=C=NCCCC1CCc2ccccc2Nc2ccccc2C1>>CCCNC(=O)N1c2ccccc2CCC(CCCN=C=O)Cc2ccccc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
urea_formation	2606	CCCN=C=O.O=C=NCCCc1ccc2c(c1)NCCC2>>CCCNC(=O)N1CCCc2ccc(CCCN=C=O)cc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2607	CCCN=C=O.O=C=NCCCc1ccc2c(c1)NC=CC2>>CCCNC(=O)N1C=CCc2ccc(CCCN=C=O)cc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2608	CCCN=C=O.Nc1cccc(CCCCN=C=O)c1N>>CCCNC(=O)Nc1cccc(CCCCN=C=O)c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Phe
urea_formation	2609	CCCN=C=O.Nc1cc2ccc(CCCCN=C=O)cc2cc1N>>CCCNC(=O)Nc1cc2ccc(CCCCN=C=O)cc2cc1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_PhePhe
urea_formation	2610	CCCN=C=O.Nc1cncc(CCCCN=C=O)c1Nc1ccccc1>>CCCNC(=O)N(c1ccccc1)c1c(N)cncc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2611	CCCN=C=O.Nc1cncc(CCCCN=C=O)c1Nc1cccnc1>>CCCNC(=O)N(c1cccnc1)c1c(N)cncc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2612	CCCN=C=O.NCCNc1ccncc1CCCCN=C=O>>CCCNC(=O)N(CCN)c1ccncc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2613	CCCN=C=O.NC=CNc1ccncc1CCCCN=C=O>>CCCNC(=O)N(C=CN)c1ccncc1CCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2614	CCCN=C=O.O=C=NCCCC1CCc2ccncc2Nc2ccccc2C1>>CCCNC(=O)N1c2cnccc2CCC(CCCN=C=O)Cc2ccccc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2615	CCCN=C=O.O=C=NCCCC1CCc2cnccc2Nc2cnccc2C1>>CCCNC(=O)N1c2ccncc2CCC(CCCN=C=O)Cc2ccncc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2616	CCCN=C=O.O=C=NCCCc1cnc2c(c1)NCCC2>>CCCNC(=O)N1CCCc2ncc(CCCN=C=O)cc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2617	CCCN=C=O.O=C=NCCCc1cnc2c(c1)NC=CC2>>CCCNC(=O)N1C=CCc2ncc(CCCN=C=O)cc21	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2618	CCCN=C=O.Nc1occ(CCCCN=C=O)c1N>>CCCNC(=O)Nc1occ(CCCCN=C=O)c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het5
urea_formation	2619	CCCN=C=O.Nc1oc2c(CCCCN=C=O)occ2c1N>>CCCNC(=O)Nc1oc2c(CCCCN=C=O)occ2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het5Het5
urea_formation	2620	CCCN=C=O.Nc1oc2cc(CCCCN=C=O)ncc2c1N>>CCCNC(=O)Nc1oc2cc(CCCCN=C=O)ncc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het5Het6
urea_formation	2621	CCCN=C=O.Nc1oc2ccc(CCCCN=C=O)cc2c1N>>CCCNC(=O)Nc1oc2ccc(CCCCN=C=O)cc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het5Phe
urea_formation	2622	CCCN=C=O.Nc1nccc(CCCCN=C=O)c1N>>CCCNC(=O)Nc1nccc(CCCCN=C=O)c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het6
urea_formation	2623	CCCN=C=O.Nc1c(CCCN=C=O)nc2cocc2c1N>>CCCNC(=O)Nc1c(CCCN=C=O)nc2cocc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het6Het5
urea_formation	2624	CCCN=C=O.Nc1ncc2cc(CCCCN=C=O)ncc2c1N>>CCCNC(=O)Nc1ncc2cc(CCCCN=C=O)ncc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het6Het6
urea_formation	2625	CCCN=C=O.Nc1ncc2ccc(CCCCN=C=O)cc2c1N>>CCCNC(=O)Nc1ncc2ccc(CCCCN=C=O)cc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_Het6Phe
urea_formation	2626	CCCN=C=O.Nc1c(CCCN=C=O)cc2cocc2c1N>>CCCNC(=O)Nc1c(CCCN=C=O)cc2cocc2c1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_PheHet5
urea_formation	2627	CCCN=C=O.Nc1cc2cncc(CCCCN=C=O)c2cc1N>>CCCNC(=O)Nc1cc2cncc(CCCCN=C=O)c2cc1N	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Amine_Primary_PheHet6
urea_formation	2628	CCCN=C=O.NCc1ccccc1CCCCCN=C=O>>CCCNC(=O)NCc1ccccc1CCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.Benzylamine_primary
urea_formation	2629	CCCN=C=O.NCc1cnccc1CCCCCN=C=O>>CCCNC(=O)NCc1cnccc1CCCCCN=C=O	[N;$(N=C=O);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_SaturatedAliphatic.HeteroBenzylamine_primary
urea_formation	2630	CCC=CN=C=O.NCCNCCCCCC=CN=C=O>>CCC=CNC(=O)N(CCN)CCCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2631	CCC=CN=C=O.NC=CNCCCCCC=CN=C=O>>CCC=CNC(=O)N(C=CN)CCCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2632	CCC=CN=C=O.NC=CNC=CCCCC=CN=C=O>>CCC=CNC(=O)N(C=CN)C=CCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2633	CCC=CN=C=O.NC1CNCC(CCCC=CN=C=O)C1>>CCC=CNC(=O)N1CC(N)CC(CCCC=CN=C=O)C1	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2634	CCC=CN=C=O.O=C=NC=CCCCC1CC=CNC1>>CCC=CNC(=O)N1C=CCC(CCCC=CN=C=O)C1	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2635	CCC=CN=C=O.O=C=NC=CCCCC1C=CNC=CC1>>CCC=CNC(=O)N1C=CCC(CCCC=CN=C=O)C=C1	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2636	CCC=CN=C=O.NCCNCCCCC=CN=C=O>>CCC=CNC(=O)NCCNCCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
urea_formation	2637	CCC=CN=C=O.NC=CNCCCCC=CN=C=O>>CCC=CNC(=O)NC=CNCCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
urea_formation	2638	CCC=CN=C=O.Nc1cccc(CCCC=CN=C=O)c1Nc1ccccc1>>CCC=CNC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
urea_formation	2639	CCC=CN=C=O.NCCNc1ccccc1CCCCC=CN=C=O>>CCC=CNC(=O)N(CCN)c1ccccc1CCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2640	CCC=CN=C=O.NC=CNc1ccccc1CCCC=CN=C=O>>CCC=CNC(=O)N(C=CN)c1ccccc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2641	CCC=CN=C=O.O=C=NC=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CNC(=O)N1c2ccccc2CCC(CCC=CN=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
urea_formation	2642	CCC=CN=C=O.O=C=NC=CCCc1ccc2c(c1)NCCC2>>CCC=CNC(=O)N1CCCc2ccc(CCC=CN=C=O)cc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2643	CCC=CN=C=O.O=C=NC=CCCc1ccc2c(c1)NC=CC2>>CCC=CNC(=O)N1C=CCc2ccc(CCC=CN=C=O)cc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2644	CCC=CN=C=O.Nc1cccc(CCCC=CN=C=O)c1N>>CCC=CNC(=O)Nc1cccc(CCCC=CN=C=O)c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Phe
urea_formation	2645	CCC=CN=C=O.Nc1cc2ccc(CCCC=CN=C=O)cc2cc1N>>CCC=CNC(=O)Nc1cc2ccc(CCCC=CN=C=O)cc2cc1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_PhePhe
urea_formation	2646	CCC=CN=C=O.Nc1cncc(CCCC=CN=C=O)c1Nc1ccccc1>>CCC=CNC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2647	CCC=CN=C=O.Nc1cncc(CCCC=CN=C=O)c1Nc1cccnc1>>CCC=CNC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2648	CCC=CN=C=O.NCCNc1ccncc1CCCC=CN=C=O>>CCC=CNC(=O)N(CCN)c1ccncc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2649	CCC=CN=C=O.NC=CNc1ccncc1CCCC=CN=C=O>>CCC=CNC(=O)N(C=CN)c1ccncc1CCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2650	CCC=CN=C=O.O=C=NC=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CNC(=O)N1c2cnccc2CCC(CCC=CN=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2651	CCC=CN=C=O.O=C=NC=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CNC(=O)N1c2ccncc2CCC(CCC=CN=C=O)Cc2ccncc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2652	CCC=CN=C=O.O=C=NC=CCCc1cnc2c(c1)NCCC2>>CCC=CNC(=O)N1CCCc2ncc(CCC=CN=C=O)cc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2653	CCC=CN=C=O.O=C=NC=CCCc1cnc2c(c1)NC=CC2>>CCC=CNC(=O)N1C=CCc2ncc(CCC=CN=C=O)cc21	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2654	CCC=CN=C=O.Nc1occ(CCCC=CN=C=O)c1N>>CCC=CNC(=O)Nc1occ(CCCC=CN=C=O)c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het5
urea_formation	2655	CCC=CN=C=O.Nc1oc2c(CCCC=CN=C=O)occ2c1N>>CCC=CNC(=O)Nc1oc2c(CCCC=CN=C=O)occ2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het5Het5
urea_formation	2656	CCC=CN=C=O.Nc1oc2cc(CCCC=CN=C=O)ncc2c1N>>CCC=CNC(=O)Nc1oc2cc(CCCC=CN=C=O)ncc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het5Het6
urea_formation	2657	CCC=CN=C=O.Nc1oc2ccc(CCCC=CN=C=O)cc2c1N>>CCC=CNC(=O)Nc1oc2ccc(CCCC=CN=C=O)cc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het5Phe
urea_formation	2658	CCC=CN=C=O.Nc1nccc(CCCC=CN=C=O)c1N>>CCC=CNC(=O)Nc1nccc(CCCC=CN=C=O)c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het6
urea_formation	2659	CCC=CN=C=O.Nc1c(CCC=CN=C=O)nc2cocc2c1N>>CCC=CNC(=O)Nc1c(CCC=CN=C=O)nc2cocc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het6Het5
urea_formation	2660	CCC=CN=C=O.Nc1ncc2cc(CCCC=CN=C=O)ncc2c1N>>CCC=CNC(=O)Nc1ncc2cc(CCCC=CN=C=O)ncc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het6Het6
urea_formation	2661	CCC=CN=C=O.Nc1ncc2ccc(CCCC=CN=C=O)cc2c1N>>CCC=CNC(=O)Nc1ncc2ccc(CCCC=CN=C=O)cc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_Het6Phe
urea_formation	2662	CCC=CN=C=O.Nc1c(CCC=CN=C=O)cc2cocc2c1N>>CCC=CNC(=O)Nc1c(CCC=CN=C=O)cc2cocc2c1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_PheHet5
urea_formation	2663	CCC=CN=C=O.Nc1cc2cncc(CCCC=CN=C=O)c2cc1N>>CCC=CNC(=O)Nc1cc2cncc(CCCC=CN=C=O)c2cc1N	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Amine_Primary_PheHet6
urea_formation	2664	CCC=CN=C=O.NCc1ccccc1CCCCC=CN=C=O>>CCC=CNC(=O)NCc1ccccc1CCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.Benzylamine_primary
urea_formation	2665	CCC=CN=C=O.NCc1cnccc1CCCCC=CN=C=O>>CCC=CNC(=O)NCc1cnccc1CCCCC=CN=C=O	[N;$(N=C=O);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_UnsaturatedAliphatic.HeteroBenzylamine_primary
urea_formation	2666	CCc1ccccc1N=C=O.NCCNCCCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(CCN)CCCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2667	CCc1ccccc1N=C=O.NC=CNCCCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(C=CN)CCCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2668	CCc1ccccc1N=C=O.NC=CNC=CCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(C=CN)C=CCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2669	CCc1ccccc1N=C=O.NC1CNCC(CCCc2ccccc2N=C=O)C1>>CCc1ccccc1NC(=O)N1CC(N)CC(CCCc2ccccc2N=C=O)C1	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2670	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCCC1CC=CNC1>>CCc1ccccc1NC(=O)N1C=CCC(CCCc2ccccc2N=C=O)C1	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2671	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCCC1C=CNC=CC1>>CCc1ccccc1NC(=O)N1C=CCC(CCCc2ccccc2N=C=O)C=C1	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2672	CCc1ccccc1N=C=O.NCCNCCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)NCCNCCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_SaturatedAliphatic
urea_formation	2673	CCc1ccccc1N=C=O.NC=CNCCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)NC=CNCCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_UnsaturatedAliphatic
urea_formation	2674	CCc1ccccc1N=C=O.Nc1cccc(CCCc2ccccc2N=C=O)c1Nc1ccccc1>>CCc1ccccc1NC(=O)N(c1ccccc1)c1c(N)cccc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
urea_formation	2675	CCc1ccccc1N=C=O.NCCNc1ccccc1CCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(CCN)c1ccccc1CCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2676	CCc1ccccc1N=C=O.NC=CNc1ccccc1CCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(C=CN)c1ccccc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2677	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1ccccc1NC(=O)N1c2ccccc2CCC(CCc2ccccc2N=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
urea_formation	2678	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCc1ccc2c(c1)NCCC2>>CCc1ccccc1NC(=O)N1CCCc2ccc(CCc3ccccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2679	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCc1ccc2c(c1)NC=CC2>>CCc1ccccc1NC(=O)N1C=CCc2ccc(CCc3ccccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2680	CCc1ccccc1N=C=O.Nc1cccc(CCCc2ccccc2N=C=O)c1N>>CCc1ccccc1NC(=O)Nc1cccc(CCCc2ccccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Phe
urea_formation	2681	CCc1ccccc1N=C=O.Nc1cc2ccc(CCCc3ccccc3N=C=O)cc2cc1N>>CCc1ccccc1NC(=O)Nc1cc2ccc(CCCc3ccccc3N=C=O)cc2cc1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_PhePhe
urea_formation	2682	CCc1ccccc1N=C=O.Nc1cncc(CCCc2ccccc2N=C=O)c1Nc1ccccc1>>CCc1ccccc1NC(=O)N(c1ccccc1)c1c(N)cncc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2683	CCc1ccccc1N=C=O.Nc1cncc(CCCc2ccccc2N=C=O)c1Nc1cccnc1>>CCc1ccccc1NC(=O)N(c1cccnc1)c1c(N)cncc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2684	CCc1ccccc1N=C=O.NCCNc1ccncc1CCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(CCN)c1ccncc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2685	CCc1ccccc1N=C=O.NC=CNc1ccncc1CCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)N(C=CN)c1ccncc1CCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2686	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1ccccc1NC(=O)N1c2cnccc2CCC(CCc2ccccc2N=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2687	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1ccccc1NC(=O)N1c2ccncc2CCC(CCc2ccccc2N=C=O)Cc2ccncc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2688	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCc1cnc2c(c1)NCCC2>>CCc1ccccc1NC(=O)N1CCCc2ncc(CCc3ccccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2689	CCc1ccccc1N=C=O.O=C=Nc1ccccc1CCc1cnc2c(c1)NC=CC2>>CCc1ccccc1NC(=O)N1C=CCc2ncc(CCc3ccccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2690	CCc1ccccc1N=C=O.Nc1occ(CCCc2ccccc2N=C=O)c1N>>CCc1ccccc1NC(=O)Nc1occ(CCCc2ccccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het5
urea_formation	2691	CCc1ccccc1N=C=O.Nc1oc2c(CCCc3ccccc3N=C=O)occ2c1N>>CCc1ccccc1NC(=O)Nc1oc2c(CCCc3ccccc3N=C=O)occ2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het5Het5
urea_formation	2692	CCc1ccccc1N=C=O.Nc1oc2cc(CCCc3ccccc3N=C=O)ncc2c1N>>CCc1ccccc1NC(=O)Nc1oc2cc(CCCc3ccccc3N=C=O)ncc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het5Het6
urea_formation	2693	CCc1ccccc1N=C=O.Nc1oc2ccc(CCCc3ccccc3N=C=O)cc2c1N>>CCc1ccccc1NC(=O)Nc1oc2ccc(CCCc3ccccc3N=C=O)cc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het5Phe
urea_formation	2694	CCc1ccccc1N=C=O.Nc1nccc(CCCc2ccccc2N=C=O)c1N>>CCc1ccccc1NC(=O)Nc1nccc(CCCc2ccccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het6
urea_formation	2695	CCc1ccccc1N=C=O.Nc1c(CCc2ccccc2N=C=O)nc2cocc2c1N>>CCc1ccccc1NC(=O)Nc1c(CCc2ccccc2N=C=O)nc2cocc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het6Het5
urea_formation	2696	CCc1ccccc1N=C=O.Nc1ncc2cc(CCCc3ccccc3N=C=O)ncc2c1N>>CCc1ccccc1NC(=O)Nc1ncc2cc(CCCc3ccccc3N=C=O)ncc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het6Het6
urea_formation	2697	CCc1ccccc1N=C=O.Nc1ncc2ccc(CCCc3ccccc3N=C=O)cc2c1N>>CCc1ccccc1NC(=O)Nc1ncc2ccc(CCCc3ccccc3N=C=O)cc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_Het6Phe
urea_formation	2698	CCc1ccccc1N=C=O.Nc1c(CCc2ccccc2N=C=O)cc2cocc2c1N>>CCc1ccccc1NC(=O)Nc1c(CCc2ccccc2N=C=O)cc2cocc2c1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_PheHet5
urea_formation	2699	CCc1ccccc1N=C=O.Nc1cc2cncc(CCCc3ccccc3N=C=O)c2cc1N>>CCc1ccccc1NC(=O)Nc1cc2cncc(CCCc3ccccc3N=C=O)c2cc1N	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Amine_Primary_PheHet6
urea_formation	2700	CCc1ccccc1N=C=O.NCc1ccccc1CCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)NCc1ccccc1CCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.Benzylamine_primary
urea_formation	2701	CCc1ccccc1N=C=O.NCc1cnccc1CCCCc1ccccc1N=C=O>>CCc1ccccc1NC(=O)NCc1cnccc1CCCCc1ccccc1N=C=O	[N;$(N=C=O);$([$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Aromatic.HeteroBenzylamine_primary
urea_formation	2702	CCc1cnccc1N=C=O.NCCNCCCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(CCN)CCCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2703	CCc1cnccc1N=C=O.NC=CNCCCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(C=CN)CCCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2704	CCc1cnccc1N=C=O.NC=CNC=CCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(C=CN)C=CCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2705	CCc1cnccc1N=C=O.NC1CNCC(CCCc2cnccc2N=C=O)C1>>CCc1cnccc1NC(=O)N1CC(N)CC(CCCc2cnccc2N=C=O)C1	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
urea_formation	2706	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCCC1CC=CNC1>>CCc1cnccc1NC(=O)N1C=CCC(CCCc2cnccc2N=C=O)C1	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2707	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCCC1C=CNC=CC1>>CCc1cnccc1NC(=O)N1C=CCC(CCCc2cnccc2N=C=O)C=C1	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
urea_formation	2708	CCc1cnccc1N=C=O.NCCNCCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)NCCNCCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_SaturatedAliphatic
urea_formation	2709	CCc1cnccc1N=C=O.NC=CNCCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)NC=CNCCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
urea_formation	2710	CCc1cnccc1N=C=O.Nc1cccc(CCCc2cnccc2N=C=O)c1Nc1ccccc1>>CCc1cnccc1NC(=O)N(c1ccccc1)c1c(N)cccc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
urea_formation	2711	CCc1cnccc1N=C=O.NCCNc1ccccc1CCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(CCN)c1ccccc1CCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2712	CCc1cnccc1N=C=O.NC=CNc1ccccc1CCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(C=CN)c1ccccc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2713	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1cnccc1NC(=O)N1c2ccccc2CCC(CCc2cnccc2N=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
urea_formation	2714	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCc1ccc2c(c1)NCCC2>>CCc1cnccc1NC(=O)N1CCCc2ccc(CCc3cnccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
urea_formation	2715	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCc1ccc2c(c1)NC=CC2>>CCc1cnccc1NC(=O)N1C=CCc2ccc(CCc3cnccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
urea_formation	2716	CCc1cnccc1N=C=O.Nc1cccc(CCCc2cnccc2N=C=O)c1N>>CCc1cnccc1NC(=O)Nc1cccc(CCCc2cnccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Phe
urea_formation	2717	CCc1cnccc1N=C=O.Nc1cc2ccc(CCCc3cnccc3N=C=O)cc2cc1N>>CCc1cnccc1NC(=O)Nc1cc2ccc(CCCc3cnccc3N=C=O)cc2cc1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_PhePhe
urea_formation	2718	CCc1cnccc1N=C=O.Nc1cncc(CCCc2cnccc2N=C=O)c1Nc1ccccc1>>CCc1cnccc1NC(=O)N(c1ccccc1)c1c(N)cncc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2719	CCc1cnccc1N=C=O.Nc1cncc(CCCc2cnccc2N=C=O)c1Nc1cccnc1>>CCc1cnccc1NC(=O)N(c1cccnc1)c1c(N)cncc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2720	CCc1cnccc1N=C=O.NCCNc1ccncc1CCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(CCN)c1ccncc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2721	CCc1cnccc1N=C=O.NC=CNc1ccncc1CCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)N(C=CN)c1ccncc1CCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2722	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1cnccc1NC(=O)N1c2cnccc2CCC(CCc2cnccc2N=C=O)Cc2ccccc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
urea_formation	2723	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1cnccc1NC(=O)N1c2ccncc2CCC(CCc2cnccc2N=C=O)Cc2ccncc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
urea_formation	2724	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCc1cnc2c(c1)NCCC2>>CCc1cnccc1NC(=O)N1CCCc2ncc(CCc3cnccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
urea_formation	2725	CCc1cnccc1N=C=O.O=C=Nc1ccncc1CCc1cnc2c(c1)NC=CC2>>CCc1cnccc1NC(=O)N1C=CCc2ncc(CCc3cnccc3N=C=O)cc21	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2]NC(=O)N([#6:4])[#6:5]	IsoCyanate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
urea_formation	2726	CCc1cnccc1N=C=O.Nc1occ(CCCc2cnccc2N=C=O)c1N>>CCc1cnccc1NC(=O)Nc1occ(CCCc2cnccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het5
urea_formation	2727	CCc1cnccc1N=C=O.Nc1oc2c(CCCc3cnccc3N=C=O)occ2c1N>>CCc1cnccc1NC(=O)Nc1oc2c(CCCc3cnccc3N=C=O)occ2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het5Het5
urea_formation	2728	CCc1cnccc1N=C=O.Nc1oc2cc(CCCc3cnccc3N=C=O)ncc2c1N>>CCc1cnccc1NC(=O)Nc1oc2cc(CCCc3cnccc3N=C=O)ncc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het5Het6
urea_formation	2729	CCc1cnccc1N=C=O.Nc1oc2ccc(CCCc3cnccc3N=C=O)cc2c1N>>CCc1cnccc1NC(=O)Nc1oc2ccc(CCCc3cnccc3N=C=O)cc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het5Phe
urea_formation	2730	CCc1cnccc1N=C=O.Nc1nccc(CCCc2cnccc2N=C=O)c1N>>CCc1cnccc1NC(=O)Nc1nccc(CCCc2cnccc2N=C=O)c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het6
urea_formation	2731	CCc1cnccc1N=C=O.Nc1c(CCc2cnccc2N=C=O)nc2cocc2c1N>>CCc1cnccc1NC(=O)Nc1c(CCc2cnccc2N=C=O)nc2cocc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het6Het5
urea_formation	2732	CCc1cnccc1N=C=O.Nc1ncc2cc(CCCc3cnccc3N=C=O)ncc2c1N>>CCc1cnccc1NC(=O)Nc1ncc2cc(CCCc3cnccc3N=C=O)ncc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het6Het6
urea_formation	2733	CCc1cnccc1N=C=O.Nc1ncc2ccc(CCCc3cnccc3N=C=O)cc2c1N>>CCc1cnccc1NC(=O)Nc1ncc2ccc(CCCc3cnccc3N=C=O)cc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_Het6Phe
urea_formation	2734	CCc1cnccc1N=C=O.Nc1c(CCc2cnccc2N=C=O)cc2cocc2c1N>>CCc1cnccc1NC(=O)Nc1c(CCc2cnccc2N=C=O)cc2cocc2c1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_PheHet5
urea_formation	2735	CCc1cnccc1N=C=O.Nc1cc2cncc(CCCc3cnccc3N=C=O)c2cc1N>>CCc1cnccc1NC(=O)Nc1cc2cncc(CCCc3cnccc3N=C=O)c2cc1N	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Amine_Primary_PheHet6
urea_formation	2736	CCc1cnccc1N=C=O.NCc1ccccc1CCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)NCc1ccccc1CCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.Benzylamine_primary
urea_formation	2737	CCc1cnccc1N=C=O.NCc1cnccc1CCCCc1cnccc1N=C=O>>CCc1cnccc1NC(=O)NCc1cnccc1CCCCc1cnccc1N=C=O	[N;$(N=C=O);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2]NC(=O)N[#6:4]	IsoCyanate_Heteroaromatic.HeteroBenzylamine_primary
ART	2738	Cc1ccccc1Br.CC1(C)OB(CCCc2ccccc2Br)OC1(C)C>>Cc1ccccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Phe.Boronate_SaturatedAliphatic
ART	2739	Cc1c(Br)ccc2ccccc12.CC1(C)OB(CCCc2c(Br)ccc3ccccc23)OC1(C)C>>Cc1c(CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_PhePhe.Boronate_SaturatedAliphatic
ART	2740	Cc1cocc1Br.CC1(C)OB(CCCc2cocc2Br)OC1(C)C>>Cc1cocc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5.Boronate_SaturatedAliphatic
ART	2741	Cc1c(Br)oc2cocc12.CC1(C)OB(CCCc2c(Br)oc3cocc23)OC1(C)C>>Cc1c(CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.Boronate_SaturatedAliphatic
ART	2742	Cc1c(Br)oc2ccncc12.CC1(C)OB(CCCc2c(Br)oc3ccncc23)OC1(C)C>>Cc1c(CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.Boronate_SaturatedAliphatic
ART	2743	Cc1c(Br)oc2ccccc12.CC1(C)OB(CCCc2c(Br)oc3ccccc23)OC1(C)C>>Cc1c(CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.Boronate_SaturatedAliphatic
ART	2744	Cc1cnccc1Br.CC1(C)OB(CCCc2cnccc2Br)OC1(C)C>>Cc1cnccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6.Boronate_SaturatedAliphatic
ART	2745	Cc1nc2cocc2cc1Br.CC1(C)OB(CCCc2nc3cocc3cc2Br)OC1(C)C>>Cc1nc2cocc2cc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.Boronate_SaturatedAliphatic
ART	2746	Cc1c(Br)ncc2ccncc12.CC1(C)OB(CCCc2c(Br)ncc3ccncc23)OC1(C)C>>Cc1c(CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.Boronate_SaturatedAliphatic
ART	2747	Cc1c(Br)ncc2ccccc12.CC1(C)OB(CCCc2c(Br)ncc3ccccc23)OC1(C)C>>Cc1c(CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.Boronate_SaturatedAliphatic
ART	2748	Cc1cc2cocc2cc1Br.CC1(C)OB(CCCc2cc3cocc3cc2Br)OC1(C)C>>Cc1cc2cocc2cc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet5.Boronate_SaturatedAliphatic
ART	2749	CCc1c(Br)ccc2ccncc12.CC1(C)OB(CCCCc2c(Br)ccc3ccncc23)OC1(C)C>>CCc1c(CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(BB);!$([B;R]([O;R])([O;R])[N;R]);!$(B(O)(O)O);!$(B1OBOBO1):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet6.Boronate_SaturatedAliphatic
cross_electrophile_coupling	2750	CCCBr.BrCCCCCBr>>CCCCCCCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[C:2][C:4]	X-Bromide_Aliph.X-Bromide_Aliph
cross_electrophile_coupling	2751	CCCBr.ClCCCCCBr>>CCCCCCCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[C:2][C:4]	X-Bromide_Aliph.X-Chloride_Aliph
cross_electrophile_coupling	2752	CCCBr.BrCCCc1ccccc1Br>>CCCc1ccccc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Phe
cross_electrophile_coupling	2753	CCCBr.BrCCCc1c(Br)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PhePhe
cross_electrophile_coupling	2754	CCCBr.BrCCCc1cocc1Br>>CCCc1cocc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5
cross_electrophile_coupling	2755	CCCBr.BrCCCc1c(Br)oc2cocc12>>CCCc1oc2cocc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Het5
cross_electrophile_coupling	2756	CCCBr.BrCCCc1c(Br)oc2ccncc12>>CCCc1oc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Het6
cross_electrophile_coupling	2757	CCCBr.BrCCCc1c(Br)oc2ccccc12>>CCCc1oc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het5Phe
cross_electrophile_coupling	2758	CCCBr.BrCCCc1cnccc1Br>>CCCc1ccncc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6
cross_electrophile_coupling	2759	CCCBr.BrCCCc1nc2cocc2cc1Br>>CCCc1cc2cocc2nc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Het5
cross_electrophile_coupling	2760	CCCBr.BrCCCc1c(Br)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Het6
cross_electrophile_coupling	2761	CCCBr.BrCCCc1c(Br)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_Het6Phe
cross_electrophile_coupling	2762	CCCBr.BrCCCc1cc2cocc2cc1Br>>CCCc1cc2cocc2cc1CCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PheHet5
cross_electrophile_coupling	2763	CCCBr.BrCCCCc1c(Br)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCBr	[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Bromide_Aliph.X-Bromide_PheHet6
cross_electrophile_coupling	2764	CCCCl.ClCCCCCBr>>CCCCCCCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[C:2][C:4]	X-Chloride_Aliph.X-Bromide_Aliph
cross_electrophile_coupling	2765	CCCCl.ClCCCCCCl>>CCCCCCCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[C:2][C:4]	X-Chloride_Aliph.X-Chloride_Aliph
cross_electrophile_coupling	2766	CCCCl.ClCCCc1ccccc1Br>>CCCc1ccccc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Phe
cross_electrophile_coupling	2767	CCCCl.ClCCCc1c(Br)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PhePhe
cross_electrophile_coupling	2768	CCCCl.ClCCCc1cocc1Br>>CCCc1cocc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5
cross_electrophile_coupling	2769	CCCCl.ClCCCc1c(Br)oc2cocc12>>CCCc1oc2cocc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Het5
cross_electrophile_coupling	2770	CCCCl.ClCCCc1c(Br)oc2ccncc12>>CCCc1oc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Het6
cross_electrophile_coupling	2771	CCCCl.ClCCCc1c(Br)oc2ccccc12>>CCCc1oc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het5Phe
cross_electrophile_coupling	2772	CCCCl.ClCCCc1cnccc1Br>>CCCc1ccncc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6
cross_electrophile_coupling	2773	CCCCl.ClCCCc1nc2cocc2cc1Br>>CCCc1cc2cocc2nc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Het5
cross_electrophile_coupling	2774	CCCCl.ClCCCc1c(Br)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Het6
cross_electrophile_coupling	2775	CCCCl.ClCCCc1c(Br)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_Het6Phe
cross_electrophile_coupling	2776	CCCCl.ClCCCc1cc2cocc2cc1Br>>CCCc1cc2cocc2cc1CCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PheHet5
cross_electrophile_coupling	2777	CCCCl.ClCCCCc1c(Br)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCCl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):1][C@:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[C:2][a:4]	X-Chloride_Aliph.X-Bromide_PheHet6
cross_electrophile_coupling	2778	Cc1ccccc1Br.BrCCCc1ccccc1Br>>Cc1ccccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Phe.X-Bromide_Aliph
cross_electrophile_coupling	2779	Cc1ccccc1Br.ClCCCc1ccccc1Br>>Cc1ccccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Phe.X-Chloride_Aliph
cross_electrophile_coupling	2780	Cc1ccccc1Br.Brc1ccccc1Cc1ccccc1Br>>Cc1ccccc1c1ccccc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Phe
cross_electrophile_coupling	2781	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PhePhe
cross_electrophile_coupling	2782	Cc1ccccc1Br.Brc1ccccc1Cc1cocc1Br>>Cc1ccccc1c1cocc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5
cross_electrophile_coupling	2783	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Het5
cross_electrophile_coupling	2784	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Het6
cross_electrophile_coupling	2785	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Phe
cross_electrophile_coupling	2786	Cc1ccccc1Br.Brc1ccccc1Cc1cnccc1Br>>Cc1ccccc1c1ccncc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6
cross_electrophile_coupling	2787	Cc1ccccc1Br.Brc1ccccc1Cc1nc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Het5
cross_electrophile_coupling	2788	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Het6
cross_electrophile_coupling	2789	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Phe
cross_electrophile_coupling	2790	Cc1ccccc1Br.Brc1ccccc1Cc1cc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PheHet5
cross_electrophile_coupling	2791	Cc1ccccc1Br.Brc1ccccc1CCc1c(Br)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PheHet6
cross_electrophile_coupling	2792	Cc1c(Br)ccc2ccccc12.BrCCCc1c(Br)ccc2ccccc12>>Cc1c(CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PhePhe.X-Bromide_Aliph
cross_electrophile_coupling	2793	Cc1c(Br)ccc2ccccc12.ClCCCc1c(Br)ccc2ccccc12>>Cc1c(CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PhePhe.X-Chloride_Aliph
cross_electrophile_coupling	2794	Cc1c(Br)ccc2ccccc12.Brc1ccccc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Phe
cross_electrophile_coupling	2795	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PhePhe
cross_electrophile_coupling	2796	Cc1c(Br)ccc2ccccc12.Brc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5
cross_electrophile_coupling	2797	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Het5
cross_electrophile_coupling	2798	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Het6
cross_electrophile_coupling	2799	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Phe
cross_electrophile_coupling	2800	Cc1c(Br)ccc2ccccc12.Brc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6
cross_electrophile_coupling	2801	Cc1c(Br)ccc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Het5
cross_electrophile_coupling	2802	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Het6
cross_electrophile_coupling	2803	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Phe
cross_electrophile_coupling	2804	Cc1c(Br)ccc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PheHet5
cross_electrophile_coupling	2805	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PheHet6
cross_electrophile_coupling	2806	Cc1cocc1Br.BrCCCc1cocc1Br>>Cc1cocc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5.X-Bromide_Aliph
cross_electrophile_coupling	2807	Cc1cocc1Br.ClCCCc1cocc1Br>>Cc1cocc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5.X-Chloride_Aliph
cross_electrophile_coupling	2808	Cc1cocc1Br.Brc1ccccc1Cc1cocc1Br>>Cc1cocc1c1ccccc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Phe
cross_electrophile_coupling	2809	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PhePhe
cross_electrophile_coupling	2810	Cc1cocc1Br.Brc1cocc1Cc1cocc1Br>>Cc1cocc1c1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5
cross_electrophile_coupling	2811	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Het5
cross_electrophile_coupling	2812	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Het6
cross_electrophile_coupling	2813	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Phe
cross_electrophile_coupling	2814	Cc1cocc1Br.Brc1ccncc1Cc1cocc1Br>>Cc1cocc1c1ccncc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6
cross_electrophile_coupling	2815	Cc1cocc1Br.Brc1cocc1Cc1nc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Het5
cross_electrophile_coupling	2816	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Het6
cross_electrophile_coupling	2817	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Phe
cross_electrophile_coupling	2818	Cc1cocc1Br.Brc1cocc1Cc1cc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PheHet5
cross_electrophile_coupling	2819	Cc1cocc1Br.Brc1cocc1CCc1c(Br)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PheHet6
cross_electrophile_coupling	2820	Cc1c(Br)oc2cocc12.BrCCCc1c(Br)oc2cocc12>>Cc1c(CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Het5.X-Bromide_Aliph
cross_electrophile_coupling	2821	Cc1c(Br)oc2cocc12.ClCCCc1c(Br)oc2cocc12>>Cc1c(CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Het5.X-Chloride_Aliph
cross_electrophile_coupling	2822	Cc1c(Br)oc2cocc12.Brc1ccccc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Phe
cross_electrophile_coupling	2823	Cc1c(Br)oc2cocc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PhePhe
cross_electrophile_coupling	2824	Cc1c(Br)oc2cocc12.Brc1cocc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5
cross_electrophile_coupling	2825	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Het5
cross_electrophile_coupling	2826	Cc1c(Br)oc2cocc12.Brc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Het6
cross_electrophile_coupling	2827	Cc1c(Br)oc2cocc12.Brc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Phe
cross_electrophile_coupling	2828	Cc1c(Br)oc2cocc12.Brc1ccncc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6
cross_electrophile_coupling	2829	Cc1c(Br)oc2cocc12.Brc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Het5
cross_electrophile_coupling	2830	Cc1c(Br)oc2cocc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Het6
cross_electrophile_coupling	2831	Cc1c(Br)oc2cocc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Phe
cross_electrophile_coupling	2832	Cc1c(Br)oc2cocc12.Brc1cc2cocc2cc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PheHet5
cross_electrophile_coupling	2833	Cc1c(Br)oc2cocc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PheHet6
cross_electrophile_coupling	2834	Cc1c(Br)oc2ccncc12.BrCCCc1c(Br)oc2ccncc12>>Cc1c(CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Het6.X-Bromide_Aliph
cross_electrophile_coupling	2835	Cc1c(Br)oc2ccncc12.ClCCCc1c(Br)oc2ccncc12>>Cc1c(CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Het6.X-Chloride_Aliph
cross_electrophile_coupling	2836	Cc1c(Br)oc2ccncc12.Brc1ccccc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Phe
cross_electrophile_coupling	2837	Cc1c(Br)oc2ccncc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PhePhe
cross_electrophile_coupling	2838	Cc1c(Br)oc2ccncc12.Brc1cocc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5
cross_electrophile_coupling	2839	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Het5
cross_electrophile_coupling	2840	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Het6
cross_electrophile_coupling	2841	Cc1c(Br)oc2ccncc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Phe
cross_electrophile_coupling	2842	Cc1c(Br)oc2ccncc12.Brc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6
cross_electrophile_coupling	2843	Cc1c(Br)oc2ccncc12.Brc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Het5
cross_electrophile_coupling	2844	Cc1c(Br)oc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Het6
cross_electrophile_coupling	2845	Cc1c(Br)oc2ccncc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Phe
cross_electrophile_coupling	2846	Cc1c(Br)oc2ccncc12.Brc1cc2cocc2cc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PheHet5
cross_electrophile_coupling	2847	Cc1c(Br)oc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PheHet6
cross_electrophile_coupling	2848	Cc1c(Br)oc2ccccc12.BrCCCc1c(Br)oc2ccccc12>>Cc1c(CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Phe.X-Bromide_Aliph
cross_electrophile_coupling	2849	Cc1c(Br)oc2ccccc12.ClCCCc1c(Br)oc2ccccc12>>Cc1c(CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het5Phe.X-Chloride_Aliph
cross_electrophile_coupling	2850	Cc1c(Br)oc2ccccc12.Brc1ccccc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Phe
cross_electrophile_coupling	2851	Cc1c(Br)oc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PhePhe
cross_electrophile_coupling	2852	Cc1c(Br)oc2ccccc12.Brc1cocc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5
cross_electrophile_coupling	2853	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Het5
cross_electrophile_coupling	2854	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Het6
cross_electrophile_coupling	2855	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Phe
cross_electrophile_coupling	2856	Cc1c(Br)oc2ccccc12.Brc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6
cross_electrophile_coupling	2857	Cc1c(Br)oc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Het5
cross_electrophile_coupling	2858	Cc1c(Br)oc2ccccc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Het6
cross_electrophile_coupling	2859	Cc1c(Br)oc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Phe
cross_electrophile_coupling	2860	Cc1c(Br)oc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PheHet5
cross_electrophile_coupling	2861	Cc1c(Br)oc2ccccc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PheHet6
cross_electrophile_coupling	2862	Cc1cnccc1Br.BrCCCc1cnccc1Br>>Cc1cnccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6.X-Bromide_Aliph
cross_electrophile_coupling	2863	Cc1cnccc1Br.ClCCCc1cnccc1Br>>Cc1cnccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6.X-Chloride_Aliph
cross_electrophile_coupling	2864	Cc1cnccc1Br.Brc1ccccc1Cc1cnccc1Br>>Cc1cnccc1c1ccccc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Phe
cross_electrophile_coupling	2865	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PhePhe
cross_electrophile_coupling	2866	Cc1cnccc1Br.Brc1ccncc1Cc1cocc1Br>>Cc1cnccc1c1cocc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5
cross_electrophile_coupling	2867	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Het5
cross_electrophile_coupling	2868	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Het6
cross_electrophile_coupling	2869	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Phe
cross_electrophile_coupling	2870	Cc1cnccc1Br.Brc1ccncc1Cc1cnccc1Br>>Cc1cnccc1c1ccncc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6
cross_electrophile_coupling	2871	Cc1cnccc1Br.Brc1ccncc1Cc1nc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Het5
cross_electrophile_coupling	2872	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Het6
cross_electrophile_coupling	2873	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Phe
cross_electrophile_coupling	2874	Cc1cnccc1Br.Brc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PheHet5
cross_electrophile_coupling	2875	Cc1cnccc1Br.Brc1ccncc1CCc1c(Br)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PheHet6
cross_electrophile_coupling	2876	Cc1nc2cocc2cc1Br.BrCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Het5.X-Bromide_Aliph
cross_electrophile_coupling	2877	Cc1nc2cocc2cc1Br.ClCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Het5.X-Chloride_Aliph
cross_electrophile_coupling	2878	Cc1nc2cocc2cc1Br.Brc1ccccc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Phe
cross_electrophile_coupling	2879	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PhePhe
cross_electrophile_coupling	2880	Cc1nc2cocc2cc1Br.Brc1cocc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5
cross_electrophile_coupling	2881	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Het5
cross_electrophile_coupling	2882	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Het6
cross_electrophile_coupling	2883	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Phe
cross_electrophile_coupling	2884	Cc1nc2cocc2cc1Br.Brc1ccncc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6
cross_electrophile_coupling	2885	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Het5
cross_electrophile_coupling	2886	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Het6
cross_electrophile_coupling	2887	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Phe
cross_electrophile_coupling	2888	Cc1nc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PheHet5
cross_electrophile_coupling	2889	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PheHet6
cross_electrophile_coupling	2890	Cc1c(Br)ncc2ccncc12.BrCCCc1c(Br)ncc2ccncc12>>Cc1c(CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Het6.X-Bromide_Aliph
cross_electrophile_coupling	2891	Cc1c(Br)ncc2ccncc12.ClCCCc1c(Br)ncc2ccncc12>>Cc1c(CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Het6.X-Chloride_Aliph
cross_electrophile_coupling	2892	Cc1c(Br)ncc2ccncc12.Brc1ccccc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Phe
cross_electrophile_coupling	2893	Cc1c(Br)ncc2ccncc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PhePhe
cross_electrophile_coupling	2894	Cc1c(Br)ncc2ccncc12.Brc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5
cross_electrophile_coupling	2895	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Het5
cross_electrophile_coupling	2896	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Het6
cross_electrophile_coupling	2897	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Phe
cross_electrophile_coupling	2898	Cc1c(Br)ncc2ccncc12.Brc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6
cross_electrophile_coupling	2899	Cc1c(Br)ncc2ccncc12.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Het5
cross_electrophile_coupling	2900	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Het6
cross_electrophile_coupling	2901	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Phe
cross_electrophile_coupling	2902	Cc1c(Br)ncc2ccncc12.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PheHet5
cross_electrophile_coupling	2903	Cc1c(Br)ncc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PheHet6
cross_electrophile_coupling	2904	Cc1c(Br)ncc2ccccc12.BrCCCc1c(Br)ncc2ccccc12>>Cc1c(CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Phe.X-Bromide_Aliph
cross_electrophile_coupling	2905	Cc1c(Br)ncc2ccccc12.ClCCCc1c(Br)ncc2ccccc12>>Cc1c(CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_Het6Phe.X-Chloride_Aliph
cross_electrophile_coupling	2906	Cc1c(Br)ncc2ccccc12.Brc1ccccc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Phe
cross_electrophile_coupling	2907	Cc1c(Br)ncc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PhePhe
cross_electrophile_coupling	2908	Cc1c(Br)ncc2ccccc12.Brc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5
cross_electrophile_coupling	2909	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Het5
cross_electrophile_coupling	2910	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Het6
cross_electrophile_coupling	2911	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Phe
cross_electrophile_coupling	2912	Cc1c(Br)ncc2ccccc12.Brc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6
cross_electrophile_coupling	2913	Cc1c(Br)ncc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Het5
cross_electrophile_coupling	2914	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Het6
cross_electrophile_coupling	2915	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Phe
cross_electrophile_coupling	2916	Cc1c(Br)ncc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PheHet5
cross_electrophile_coupling	2917	Cc1c(Br)ncc2ccccc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PheHet6
cross_electrophile_coupling	2918	Cc1cc2cocc2cc1Br.BrCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PheHet5.X-Bromide_Aliph
cross_electrophile_coupling	2919	Cc1cc2cocc2cc1Br.ClCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PheHet5.X-Chloride_Aliph
cross_electrophile_coupling	2920	Cc1cc2cocc2cc1Br.Brc1ccccc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Phe
cross_electrophile_coupling	2921	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PhePhe
cross_electrophile_coupling	2922	Cc1cc2cocc2cc1Br.Brc1cocc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5
cross_electrophile_coupling	2923	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2cocc12>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Het5
cross_electrophile_coupling	2924	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2ccncc12>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Het6
cross_electrophile_coupling	2925	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2ccccc12>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Phe
cross_electrophile_coupling	2926	Cc1cc2cocc2cc1Br.Brc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6
cross_electrophile_coupling	2927	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1nc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Het5
cross_electrophile_coupling	2928	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Het6
cross_electrophile_coupling	2929	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Phe
cross_electrophile_coupling	2930	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PheHet5
cross_electrophile_coupling	2931	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PheHet6
cross_electrophile_coupling	2932	CCc1c(Br)ccc2ccncc12.BrCCCCc1c(Br)ccc2ccncc12>>CCc1c(CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PheHet6.X-Bromide_Aliph
cross_electrophile_coupling	2933	CCc1c(Br)ccc2ccncc12.ClCCCCc1c(Br)ccc2ccncc12>>CCc1c(CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[a:2][C:4]	X-Bromide_PheHet6.X-Chloride_Aliph
cross_electrophile_coupling	2934	CCc1c(Br)ccc2ccncc12.Brc1ccccc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Phe
cross_electrophile_coupling	2935	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PhePhe
cross_electrophile_coupling	2936	CCc1c(Br)ccc2ccncc12.Brc1cocc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5
cross_electrophile_coupling	2937	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2cocc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Het5
cross_electrophile_coupling	2938	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Het6
cross_electrophile_coupling	2939	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccccc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Phe
cross_electrophile_coupling	2940	CCc1c(Br)ccc2ccncc12.Brc1ccncc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6
cross_electrophile_coupling	2941	CCc1c(Br)ccc2ccncc12.Brc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Het5
cross_electrophile_coupling	2942	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Het6
cross_electrophile_coupling	2943	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Phe
cross_electrophile_coupling	2944	CCc1c(Br)ccc2ccncc12.Brc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PheHet5
cross_electrophile_coupling	2945	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccncc2c1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PheHet6
esterification	2946	CCCCC(=O)O.O=C(O)CCCCCCCCO>>CCCCC(=O)OCCCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.PrimaryAlcoholAliphatic
esterification	2947	CCCCC(=O)O.O=C(O)CCCCCc1ccccc1CO>>CCCCC(=O)OCc1ccccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.PrimaryAlcoholAromatic
esterification	2948	CCCCC(=O)O.CCC(O)CCCCCCCC(=O)O>>CCCCC(=O)OC(CC)CCCCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
esterification	2949	CCCCC(=O)O.O=C(O)CCCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCCC(=O)OC1C2CCCCC2C2CCC(CCCCC(=O)O)CC21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
esterification	2950	CCCCC(=O)O.O=C(O)CCCCCc1ccccc1C(O)c1ccccc1>>CCCCC(=O)OC(c1ccccc1)c1ccccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
esterification	2951	CCCCC(=O)O.O=C(O)CCCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCCC(=O)OC1c2ccccc2c2ccc(CCCCC(=O)O)cc21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
esterification	2952	CCCCC(=O)O.CCCC(O)c1ccccc1CCCCCC(=O)O>>CCCCC(=O)OC(CCC)c1ccccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
esterification	2953	CCCCC(=O)O.O=C(O)CCCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCCC(=O)OC1c2cc(CCCCC(=O)O)ccc2C2CCCCC21	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.SecondaryAlcoholMixCyclic
esterification	2954	CCCCC(=O)O.CC(CCCCC(=O)O)CC(C)(C)O>>CCCCC(=O)OC(C)(C)CC(C)CCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.TertiaryAlcoholAcyclic
esterification	2955	CCCCC(=O)O.CC1(O)CCCC(CCCCC(=O)O)C1>>CCCCC(=O)OC1(C)CCCC(CCCCC(=O)O)C1	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.TertiaryAlcoholCyclic
esterification	2956	CCCCC(=O)O.O=C(O)CCCCCc1ccccc1O>>CCCCC(=O)Oc1ccccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.Phenol
esterification	2957	CCCCC(=O)O.O=C(O)CCCCCc1ccoc1O>>CCCCC(=O)Oc1occc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.PhenolHeteroaromatic5membered
esterification	2958	CCCCC(=O)O.O=C(O)CCCCCc1cccnc1O>>CCCCC(=O)Oc1ncccc1CCCCCC(=O)O	[O;D1;!$(OC(=O)[N,O,S]);$(O[C;D2,D3;$(C(=O));!$(CC=,#C);!$(CC#N);!$(Ca)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_SaturatedAliphatic.PhenolHeteroaromatic6membered
esterification	2959	CCC=CC(=O)O.O=C(O)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
esterification	2960	CCC=CC(=O)O.O=C(O)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.PrimaryAlcoholAromatic
esterification	2961	CCC=CC(=O)O.CCC(O)CCCCCC=CC(=O)O>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
esterification	2962	CCC=CC(=O)O.O=C(O)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)O)CC21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
esterification	2963	CCC=CC(=O)O.O=C(O)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
esterification	2964	CCC=CC(=O)O.O=C(O)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)O)cc21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
esterification	2965	CCC=CC(=O)O.CCCC(O)c1ccccc1CCCC=CC(=O)O>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
esterification	2966	CCC=CC(=O)O.O=C(O)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)O)ccc2C2CCCCC21	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
esterification	2967	CCC=CC(=O)O.CC(CCC=CC(=O)O)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
esterification	2968	CCC=CC(=O)O.CC1(O)CCCC(CCC=CC(=O)O)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)O)C1	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.TertiaryAlcoholCyclic
esterification	2969	CCC=CC(=O)O.O=C(O)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.Phenol
esterification	2970	CCC=CC(=O)O.O=C(O)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
esterification	2971	CCC=CC(=O)O.O=C(O)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)O	[O;D1;$([$(OC(=O)C=C),$(OC(=O)C#C),$(OC(=O)C#N)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
esterification	2972	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.PrimaryAlcoholAliphatic
esterification	2973	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.PrimaryAlcoholAromatic
esterification	2974	Cc1ccccc1C(=O)O.CCC(O)CCCCc1ccccc1C(=O)O>>CCC(CCCCc1ccccc1C(=O)O)OC(=O)c1ccccc1C	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholAliphaticAcyclic
esterification	2975	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)O)CC21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholAliphaticCyclic
esterification	2976	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholAromaticAcyclic
esterification	2977	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholAromaticCyclic
esterification	2978	Cc1ccccc1C(=O)O.CCCC(O)c1ccccc1CCc1ccccc1C(=O)O>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholMixAcyclic
esterification	2979	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)O)ccc2C2CCCCC21	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.SecondaryAlcoholMixCyclic
esterification	2980	Cc1ccccc1C(=O)O.CC(Cc1ccccc1C(=O)O)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.TertiaryAlcoholAcyclic
esterification	2981	Cc1ccccc1C(=O)O.CC1(O)CCCC(Cc2ccccc2C(=O)O)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.TertiaryAlcoholCyclic
esterification	2982	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.Phenol
esterification	2983	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.PhenolHeteroaromatic5membered
esterification	2984	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)O	[O;D1;$(OC(=O)[c;$(c1ccccc1)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_Aromatic.PhenolHeteroaromatic6membered
esterification	2985	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.PrimaryAlcoholAliphatic
esterification	2986	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.PrimaryAlcoholAromatic
esterification	2987	Cc1cnccc1C(=O)O.CCC(O)CCCCc1cnccc1C(=O)O>>CCC(CCCCc1cnccc1C(=O)O)OC(=O)c1ccncc1C	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
esterification	2988	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)O)CC21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
esterification	2989	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
esterification	2990	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)O)cc21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholAromaticCyclic
esterification	2991	Cc1cnccc1C(=O)O.CCCC(O)c1ccccc1CCc1cnccc1C(=O)O>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholMixAcyclic
esterification	2992	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)O)ccc2C2CCCCC21	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.SecondaryAlcoholMixCyclic
esterification	2993	Cc1cnccc1C(=O)O.CC(Cc1cnccc1C(=O)O)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.TertiaryAlcoholAcyclic
esterification	2994	Cc1cnccc1C(=O)O.CC1(O)CCCC(Cc2cnccc2C(=O)O)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)O)C1	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.TertiaryAlcoholCyclic
esterification	2995	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.Phenol
esterification	2996	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.PhenolHeteroaromatic5membered
esterification	2997	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)O	[O;D1;$(OC(=O)[c;$(a1aaaaa1),$(a1aaaa1);!$(c1ccccc1)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Acid_Heteroaromatic.PhenolHeteroaromatic6membered
esterification	2998	CCCC(=O)S.O=C(S)CCCCCCCO>>CCCC(=O)OCCCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.PrimaryAlcoholAliphatic
esterification	2999	CCCC(=O)S.O=C(S)CCCCc1ccccc1CO>>CCCC(=O)OCc1ccccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.PrimaryAlcoholAromatic
esterification	3000	CCCC(=O)S.CCC(O)CCCCCCC(=O)S>>CCCC(=O)OC(CC)CCCCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
esterification	3001	CCCC(=O)S.O=C(S)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCC(=O)OC1C2CCCCC2C2CCC(CCCC(=O)S)CC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
esterification	3002	CCCC(=O)S.O=C(S)CCCCc1ccccc1C(O)c1ccccc1>>CCCC(=O)OC(c1ccccc1)c1ccccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
esterification	3003	CCCC(=O)S.O=C(S)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCC(=O)OC1c2ccccc2c2ccc(CCCC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholAromaticCyclic
esterification	3004	CCCC(=O)S.CCCC(O)c1ccccc1CCCCC(=O)S>>CCCC(=O)OC(CCC)c1ccccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholMixAcyclic
esterification	3005	CCCC(=O)S.O=C(S)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCC(=O)OC1c2cc(CCCC(=O)S)ccc2C2CCCCC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.SecondaryAlcoholMixCyclic
esterification	3006	CCCC(=O)S.CC(CCCC(=O)S)CC(C)(C)O>>CCCC(=O)OC(C)(C)CC(C)CCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.TertiaryAlcoholAcyclic
esterification	3007	CCCC(=O)S.CC1(O)CCCC(CCCC(=O)S)C1>>CCCC(=O)OC1(C)CCCC(CCCC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.TertiaryAlcoholCyclic
esterification	3008	CCCC(=O)S.O=C(S)CCCCc1ccccc1O>>CCCC(=O)Oc1ccccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.Phenol
esterification	3009	CCCC(=O)S.O=C(S)CCCCc1ccoc1O>>CCCC(=O)Oc1occc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.PhenolHeteroaromatic5membered
esterification	3010	CCCC(=O)S.O=C(S)CCCCc1cccnc1O>>CCCC(=O)Oc1ncccc1CCCCC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_SaturatedAliphatic.PhenolHeteroaromatic6membered
esterification	3011	CCC=CC(=O)S.O=C(S)C=CCCCCCCO>>CCC=CC(=O)OCCCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.PrimaryAlcoholAliphatic
esterification	3012	CCC=CC(=O)S.O=C(S)C=CCCCc1ccccc1CO>>CCC=CC(=O)OCc1ccccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.PrimaryAlcoholAromatic
esterification	3013	CCC=CC(=O)S.CCC(O)CCCCCC=CC(=O)S>>CCC=CC(=O)OC(CC)CCCCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholAliphaticAcyclic
esterification	3014	CCC=CC(=O)S.O=C(S)C=CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCC=CC(=O)OC1C2CCCCC2C2CCC(CCC=CC(=O)S)CC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholAliphaticCyclic
esterification	3015	CCC=CC(=O)S.O=C(S)C=CCCCc1ccccc1C(O)c1ccccc1>>CCC=CC(=O)OC(c1ccccc1)c1ccccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholAromaticAcyclic
esterification	3016	CCC=CC(=O)S.O=C(S)C=CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCC=CC(=O)OC1c2ccccc2c2ccc(CCC=CC(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholAromaticCyclic
esterification	3017	CCC=CC(=O)S.CCCC(O)c1ccccc1CCCC=CC(=O)S>>CCC=CC(=O)OC(CCC)c1ccccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholMixAcyclic
esterification	3018	CCC=CC(=O)S.O=C(S)C=CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCC=CC(=O)OC1c2cc(CCC=CC(=O)S)ccc2C2CCCCC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.SecondaryAlcoholMixCyclic
esterification	3019	CCC=CC(=O)S.CC(CCC=CC(=O)S)CC(C)(C)O>>CCC=CC(=O)OC(C)(C)CC(C)CCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.TertiaryAlcoholAcyclic
esterification	3020	CCC=CC(=O)S.CC1(O)CCCC(CCC=CC(=O)S)C1>>CCC=CC(=O)OC1(C)CCCC(CCC=CC(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.TertiaryAlcoholCyclic
esterification	3021	CCC=CC(=O)S.O=C(S)C=CCCCc1ccccc1O>>CCC=CC(=O)Oc1ccccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.Phenol
esterification	3022	CCC=CC(=O)S.O=C(S)C=CCCCc1ccoc1O>>CCC=CC(=O)Oc1occc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.PhenolHeteroaromatic5membered
esterification	3023	CCC=CC(=O)S.O=C(S)C=CCCCc1cccnc1O>>CCC=CC(=O)Oc1ncccc1CCCC=CC(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_UnsaturatedAliphatic.PhenolHeteroaromatic6membered
esterification	3024	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCCCCO>>Cc1ccccc1C(=O)OCCCCCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.PrimaryAlcoholAliphatic
esterification	3025	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCc1ccccc1CO>>Cc1ccccc1C(=O)OCc1ccccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.PrimaryAlcoholAromatic
esterification	3026	Cc1ccccc1C(=O)S.CCC(O)CCCCc1ccccc1C(=O)S>>CCC(CCCCc1ccccc1C(=O)S)OC(=O)c1ccccc1C	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholAliphaticAcyclic
esterification	3027	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1ccccc1C(=O)OC1C2CCCCC2C2CCC(Cc3ccccc3C(=O)S)CC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholAliphaticCyclic
esterification	3028	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCc1ccccc1C(O)c1ccccc1>>Cc1ccccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholAromaticAcyclic
esterification	3029	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1ccccc1C(=O)OC1c2ccccc2c2ccc(Cc3ccccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholAromaticCyclic
esterification	3030	Cc1ccccc1C(=O)S.CCCC(O)c1ccccc1CCc1ccccc1C(=O)S>>CCCC(OC(=O)c1ccccc1C)c1ccccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholMixAcyclic
esterification	3031	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1ccccc1C(=O)OC1c2cc(Cc3ccccc3C(=O)S)ccc2C2CCCCC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.SecondaryAlcoholMixCyclic
esterification	3032	Cc1ccccc1C(=O)S.CC(Cc1ccccc1C(=O)S)CC(C)(C)O>>Cc1ccccc1C(=O)OC(C)(C)CC(C)Cc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.TertiaryAlcoholAcyclic
esterification	3033	Cc1ccccc1C(=O)S.CC1(O)CCCC(Cc2ccccc2C(=O)S)C1>>Cc1ccccc1C(=O)OC1(C)CCCC(Cc2ccccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.TertiaryAlcoholCyclic
esterification	3034	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCc1ccccc1O>>Cc1ccccc1C(=O)Oc1ccccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.Phenol
esterification	3035	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCc1ccoc1O>>Cc1ccccc1C(=O)Oc1occc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.PhenolHeteroaromatic5membered
esterification	3036	Cc1ccccc1C(=O)S.O=C(S)c1ccccc1CCc1cccnc1O>>Cc1ccccc1C(=O)Oc1ncccc1CCc1ccccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Aromatic.PhenolHeteroaromatic6membered
esterification	3037	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCCCCO>>Cc1cnccc1C(=O)OCCCCCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.PrimaryAlcoholAliphatic
esterification	3038	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCc1ccccc1CO>>Cc1cnccc1C(=O)OCc1ccccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.PrimaryAlcoholAromatic
esterification	3039	Cc1cnccc1C(=O)S.CCC(O)CCCCc1cnccc1C(=O)S>>CCC(CCCCc1cnccc1C(=O)S)OC(=O)c1ccncc1C	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholAliphaticAcyclic
esterification	3040	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12>>Cc1cnccc1C(=O)OC1C2CCCCC2C2CCC(Cc3cnccc3C(=O)S)CC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholAliphaticCyclic
esterification	3041	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCc1ccccc1C(O)c1ccccc1>>Cc1cnccc1C(=O)OC(c1ccccc1)c1ccccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholAromaticAcyclic
esterification	3042	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2>>Cc1cnccc1C(=O)OC1c2ccccc2c2ccc(Cc3cnccc3C(=O)S)cc21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholAromaticCyclic
esterification	3043	Cc1cnccc1C(=O)S.CCCC(O)c1ccccc1CCc1cnccc1C(=O)S>>CCCC(OC(=O)c1ccncc1C)c1ccccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholMixAcyclic
esterification	3044	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21>>Cc1cnccc1C(=O)OC1c2cc(Cc3cnccc3C(=O)S)ccc2C2CCCCC21	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.SecondaryAlcoholMixCyclic
esterification	3045	Cc1cnccc1C(=O)S.CC(Cc1cnccc1C(=O)S)CC(C)(C)O>>Cc1cnccc1C(=O)OC(C)(C)CC(C)Cc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.TertiaryAlcoholAcyclic
esterification	3046	Cc1cnccc1C(=O)S.CC1(O)CCCC(Cc2cnccc2C(=O)S)C1>>Cc1cnccc1C(=O)OC1(C)CCCC(Cc2cnccc2C(=O)S)C1	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.TertiaryAlcoholCyclic
esterification	3047	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCc1ccccc1O>>Cc1cnccc1C(=O)Oc1ccccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.Phenol
esterification	3048	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCc1ccoc1O>>Cc1cnccc1C(=O)Oc1occc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.PhenolHeteroaromatic5membered
esterification	3049	Cc1cnccc1C(=O)S.O=C(S)c1ccncc1CCc1cccnc1O>>Cc1cnccc1C(=O)Oc1ncccc1CCc1cnccc1C(=O)S	[S,O;D1;$(SC(=[S,O])[#6]),$(OC(=S)[#6]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Thioacid_Heteroaromatic.PhenolHeteroaromatic6membered
imidazole_condensation_acid	3050	CCCCC(=O)O.NCCNCCCCCCCC(=O)O>>CCCCC1=NC=CN1CCCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_acid	3051	CCCCC(=O)O.NC=CNCCCCCCCC(=O)O>>CCCCC1=NC=CN1CCCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3052	CCCCC(=O)O.NC=CNC=CCCCCCC(=O)O>>CCCCC1=NC=CN1C=CCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3053	CCCCC(=O)O.NCCNCCCCCCC(=O)O>>CCCCC1=Nc=CN1CCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_acid	3054	CCCCC(=O)O.NC=CNCCCCCCC(=O)O>>CCCCC1=Nc=CN1CCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_acid	3055	CCCCC(=O)O.Nc1cccc(CCCCCC(=O)O)c1Nc1ccccc1>>CCCCC1=Nc2cccc(CCCCCC(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_acid	3056	CCCCC(=O)O.NCCNc1ccccc1CCCCCCC(=O)O>>CCCCC1=NC=CN1c1ccccc1CCCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_acid	3057	CCCCC(=O)O.NC=CNc1ccccc1CCCCCC(=O)O>>CCCCC1=NC=CN1c1ccccc1CCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_acid	3058	CCCCC(=O)O.Nc1cccc(CCCCCC(=O)O)c1N>>CCCCC1=Nc2cccc(CCCCCC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_SaturatedAliphatic.Amine_Primary_Phe
imidazole_condensation_acid	3059	CCCCC(=O)O.Nc1cncc(CCCCCC(=O)O)c1Nc1ccccc1>>CCCCC1=Nc2cncc(CCCCCC(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_acid	3060	CCCCC(=O)O.Nc1cncc(CCCCCC(=O)O)c1Nc1cccnc1>>CCCCC1=Nc2cncc(CCCCCC(=O)O)c=2N1c1cccnc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_acid	3061	CCCCC(=O)O.NCCNc1ccncc1CCCCCC(=O)O>>CCCCC1=NC=CN1c1ccncc1CCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3062	CCCCC(=O)O.NC=CNc1ccncc1CCCCCC(=O)O>>CCCCC1=NC=CN1c1ccncc1CCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3063	CCCCC(=O)O.Nc1occ(CCCCCC(=O)O)c1N>>CCCCC1=Nc2occ(CCCCCC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_SaturatedAliphatic.Amine_Primary_Het5
imidazole_condensation_acid	3064	CCCCC(=O)O.Nc1nccc(CCCCCC(=O)O)c1N>>CCCCC1=Nc2nccc(CCCCCC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_SaturatedAliphatic.Amine_Primary_Het6
imidazole_condensation_acid	3065	CCC=CC(=O)O.NCCNCCCCCC=CC(=O)O>>CCC=CC1=NC=CN1CCCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_acid	3066	CCC=CC(=O)O.NC=CNCCCCCC=CC(=O)O>>CCC=CC1=NC=CN1CCCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3067	CCC=CC(=O)O.NC=CNC=CCCCC=CC(=O)O>>CCC=CC1=NC=CN1C=CCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3068	CCC=CC(=O)O.NCCNCCCCC=CC(=O)O>>CCC=CC1=Nc=CN1CCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_acid	3069	CCC=CC(=O)O.NC=CNCCCCC=CC(=O)O>>CCC=CC1=Nc=CN1CCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_acid	3070	CCC=CC(=O)O.Nc1cccc(CCCC=CC(=O)O)c1Nc1ccccc1>>CCC=CC1=Nc2cccc(CCCC=CC(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_acid	3071	CCC=CC(=O)O.NCCNc1ccccc1CCCCC=CC(=O)O>>CCC=CC1=NC=CN1c1ccccc1CCCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_acid	3072	CCC=CC(=O)O.NC=CNc1ccccc1CCCC=CC(=O)O>>CCC=CC1=NC=CN1c1ccccc1CCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_acid	3073	CCC=CC(=O)O.Nc1cccc(CCCC=CC(=O)O)c1N>>CCC=CC1=Nc2cccc(CCCC=CC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_UnsaturatedAliphatic.Amine_Primary_Phe
imidazole_condensation_acid	3074	CCC=CC(=O)O.Nc1cncc(CCCC=CC(=O)O)c1Nc1ccccc1>>CCC=CC1=Nc2cncc(CCCC=CC(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_acid	3075	CCC=CC(=O)O.Nc1cncc(CCCC=CC(=O)O)c1Nc1cccnc1>>CCC=CC1=Nc2cncc(CCCC=CC(=O)O)c=2N1c1cccnc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_acid	3076	CCC=CC(=O)O.NCCNc1ccncc1CCCC=CC(=O)O>>CCC=CC1=NC=CN1c1ccncc1CCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3077	CCC=CC(=O)O.NC=CNc1ccncc1CCCC=CC(=O)O>>CCC=CC1=NC=CN1c1ccncc1CCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3078	CCC=CC(=O)O.Nc1occ(CCCC=CC(=O)O)c1N>>CCC=CC1=Nc2occ(CCCC=CC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_UnsaturatedAliphatic.Amine_Primary_Het5
imidazole_condensation_acid	3079	CCC=CC(=O)O.Nc1nccc(CCCC=CC(=O)O)c1N>>CCC=CC1=Nc2nccc(CCCC=CC(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_UnsaturatedAliphatic.Amine_Primary_Het6
imidazole_condensation_acid	3080	Cc1ccccc1C(=O)O.NCCNCCCCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1CCCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_acid	3081	Cc1ccccc1C(=O)O.NC=CNCCCCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1CCCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3082	Cc1ccccc1C(=O)O.NC=CNC=CCCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1C=CCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3083	Cc1ccccc1C(=O)O.NCCNCCCc1ccccc1C(=O)O>>Cc1ccccc1C1=Nc=CN1CCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Aromatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_acid	3084	Cc1ccccc1C(=O)O.NC=CNCCCc1ccccc1C(=O)O>>Cc1ccccc1C1=Nc=CN1CCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Aromatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_acid	3085	Cc1ccccc1C(=O)O.Nc1cccc(CCc2ccccc2C(=O)O)c1Nc1ccccc1>>Cc1ccccc1C1=Nc2cccc(CCc3ccccc3C(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_acid	3086	Cc1ccccc1C(=O)O.NCCNc1ccccc1CCCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1c1ccccc1CCCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_acid	3087	Cc1ccccc1C(=O)O.NC=CNc1ccccc1CCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1c1ccccc1CCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_acid	3088	Cc1ccccc1C(=O)O.Nc1cccc(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C1=Nc2cccc(CCc3ccccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Aromatic.Amine_Primary_Phe
imidazole_condensation_acid	3089	Cc1ccccc1C(=O)O.Nc1cncc(CCc2ccccc2C(=O)O)c1Nc1ccccc1>>Cc1ccccc1C1=Nc2cncc(CCc3ccccc3C(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_acid	3090	Cc1ccccc1C(=O)O.Nc1cncc(CCc2ccccc2C(=O)O)c1Nc1cccnc1>>Cc1ccccc1C1=Nc2cncc(CCc3ccccc3C(=O)O)c=2N1c1cccnc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_acid	3091	Cc1ccccc1C(=O)O.NCCNc1ccncc1CCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1c1ccncc1CCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3092	Cc1ccccc1C(=O)O.NC=CNc1ccncc1CCc1ccccc1C(=O)O>>Cc1ccccc1C1=NC=CN1c1ccncc1CCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3093	Cc1ccccc1C(=O)O.Nc1occ(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C1=Nc2occ(CCc3ccccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Aromatic.Amine_Primary_Het5
imidazole_condensation_acid	3094	Cc1ccccc1C(=O)O.Nc1nccc(CCc2ccccc2C(=O)O)c1N>>Cc1ccccc1C1=Nc2nccc(CCc3ccccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Aromatic.Amine_Primary_Het6
imidazole_condensation_acid	3095	Cc1cnccc1C(=O)O.NCCNCCCCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1CCCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
imidazole_condensation_acid	3096	Cc1cnccc1C(=O)O.NC=CNCCCCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1CCCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3097	Cc1cnccc1C(=O)O.NC=CNC=CCCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1C=CCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
imidazole_condensation_acid	3098	Cc1cnccc1C(=O)O.NCCNCCCc1cnccc1C(=O)O>>Cc1cnccc1C1=Nc=CN1CCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Heteroaromatic.Amine_Primary_SaturatedAliphatic
imidazole_condensation_acid	3099	Cc1cnccc1C(=O)O.NC=CNCCCc1cnccc1C(=O)O>>Cc1cnccc1C1=Nc=CN1CCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
imidazole_condensation_acid	3100	Cc1cnccc1C(=O)O.Nc1cccc(CCc2cnccc2C(=O)O)c1Nc1ccccc1>>Cc1cnccc1C1=Nc2cccc(CCc3cnccc3C(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
imidazole_condensation_acid	3101	Cc1cnccc1C(=O)O.NCCNc1ccccc1CCCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1c1ccccc1CCCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
imidazole_condensation_acid	3102	Cc1cnccc1C(=O)O.NC=CNc1ccccc1CCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1c1ccccc1CCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
imidazole_condensation_acid	3103	Cc1cnccc1C(=O)O.Nc1cccc(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C1=Nc2cccc(CCc3cnccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Heteroaromatic.Amine_Primary_Phe
imidazole_condensation_acid	3104	Cc1cnccc1C(=O)O.Nc1cncc(CCc2cnccc2C(=O)O)c1Nc1ccccc1>>Cc1cnccc1C1=Nc2cncc(CCc3cnccc3C(=O)O)c=2N1c1ccccc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
imidazole_condensation_acid	3105	Cc1cnccc1C(=O)O.Nc1cncc(CCc2cnccc2C(=O)O)c1Nc1cccnc1>>Cc1cnccc1C1=Nc2cncc(CCc3cnccc3C(=O)O)c=2N1c1cccnc1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
imidazole_condensation_acid	3106	Cc1cnccc1C(=O)O.NCCNc1ccncc1CCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1c1ccncc1CCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3107	Cc1cnccc1C(=O)O.NC=CNc1ccncc1CCc1cnccc1C(=O)O>>Cc1cnccc1C1=NC=CN1c1ccncc1CCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3]([#6:7])[#6:4]~[#6:5]~[ND1:6]>>[*:2]C1N([*:7])[C:4]=[C:5][N:6]=1	Acid_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
imidazole_condensation_acid	3108	Cc1cnccc1C(=O)O.Nc1occ(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C1=Nc2occ(CCc3cnccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Heteroaromatic.Amine_Primary_Het5
imidazole_condensation_acid	3109	Cc1cnccc1C(=O)O.Nc1nccc(CCc2cnccc2C(=O)O)c1N>>Cc1cnccc1C1=Nc2nccc(CCc3cnccc3C(=O)O)c=2N1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);$(N[#6]~[#6][N;!R;D1,D2;!$(NC=[*;!#6]);!$(NC#*);!$(N#,=*)]):3][#6:4]~[#6:5]~[N:6]>>[*:2]C1=N[c:4]=[C:5][N:6]1	Acid_Heteroaromatic.Amine_Primary_Het6
oxadiazole_condensation	3110	CCCCC(=O)O.NNC(=O)CCCCCCC(=O)O>>CCCCc1nnc(CCCCCCC(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;D1;$(N[N;D2]C(=[O,S])):3]NC(=O)[*:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_SaturatedAliphatic.HydrazineTerminalCarbamoyl
oxadiazole_condensation	3111	CCCCC(=O)O.NC(CCCCCCC(=O)O)=NO>>CCCCc1nnc(CCCCCCC(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;D1;$(ON=[C;D3][N;D1]):3]N=C(N)[#6:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_SaturatedAliphatic.HydroxyAmidine
oxadiazole_condensation	3112	CCC=CC(=O)O.NNC(=O)CCCCC=CC(=O)O>>CCC=Cc1nnc(CCCCC=CC(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[N;D1;$(N[N;D2]C(=[O,S])):3]NC(=O)[*:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_UnsaturatedAliphatic.HydrazineTerminalCarbamoyl
oxadiazole_condensation	3113	CCC=CC(=O)O.NC(CCCCC=CC(=O)O)=NO>>CCC=Cc1nnc(CCCCC=CC(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;D1;$(ON=[C;D3][N;D1]):3]N=C(N)[#6:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_UnsaturatedAliphatic.HydroxyAmidine
oxadiazole_condensation	3114	Cc1ccccc1C(=O)O.NNC(=O)CCCc1ccccc1C(=O)O>>Cc1ccccc1c1nnc(CCCc2ccccc2C(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;D1;$(N[N;D2]C(=[O,S])):3]NC(=O)[*:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_Aromatic.HydrazineTerminalCarbamoyl
oxadiazole_condensation	3115	Cc1ccccc1C(=O)O.NC(CCCc1ccccc1C(=O)O)=NO>>Cc1ccccc1c1nnc(CCCc2ccccc2C(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;D1;$(ON=[C;D3][N;D1]):3]N=C(N)[#6:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_Aromatic.HydroxyAmidine
oxadiazole_condensation	3116	Cc1cnccc1C(=O)O.NNC(=O)CCCc1cnccc1C(=O)O>>Cc1cnccc1c1nnc(CCCc2cnccc2C(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[N;D1;$(N[N;D2]C(=[O,S])):3]NC(=O)[*:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_Heteroaromatic.HydrazineTerminalCarbamoyl
oxadiazole_condensation	3117	Cc1cnccc1C(=O)O.NC(CCCc1cnccc1C(=O)O)=NO>>Cc1cnccc1c1nnc(CCCc2cnccc2C(=O)O)o1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;D1;$(ON=[C;D3][N;D1]):3]N=C(N)[#6:4]>>[*:2]c1:n:n:c(o:1)[*:4]	Acid_Heteroaromatic.HydroxyAmidine
tetrazole_synthesis	3118	CCCN=[N+]=[N-].N#CCCCCCN=[N+]=[N-]>>[N]=[N+]=NCCCCCc1nn[nH]n1	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$(C#N);$(C[#6]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>n1:n:[nH]:n:c:1[#6:4]	Azide.Nitrile_SaturatedAliphatic
tetrazole_synthesis	3119	CCCN=[N+]=[N-].N#CC=CCCCCN=[N+]=[N-]>>[N]=[N+]=NCCCCC=Cc1nn[nH]n1	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$(C#N);$(C[#6]);$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>n1:n:[nH]:n:c:1[#6:4]	Azide.Nitrile_UnsaturatedAliphatic
tetrazole_synthesis	3120	CCCN=[N+]=[N-].N#Cc1ccccc1CCCCN=[N+]=[N-]>>[N]=[N+]=NCCCCc1ccccc1c1nn[nH]n1	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$(C#N);$(C[#6]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>n1:n:[nH]:n:c:1[#6:4]	Azide.Nitrile_Aromatic
tetrazole_synthesis	3121	CCCN=[N+]=[N-].N#Cc1ccncc1CCCCN=[N+]=[N-]>>[N]=[N+]=NCCCCc1cnccc1c1nn[nH]n1	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$(C#N);$(C[#6]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>n1:n:[nH]:n:c:1[#6:4]	Azide.Nitrile_Heteroaromatic
ullmann_phenol	3122	Cc1ccccc1Br.Oc1ccccc1CCc1ccccc1Br>>Cc1ccccc1Oc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.Phenol
ullmann_phenol	3123	Cc1ccccc1Br.Oc1occc1CCc1ccccc1Br>>Cc1ccccc1Oc1occc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3124	Cc1ccccc1Br.Oc1ncccc1CCc1ccccc1Br>>Cc1ccccc1Oc1ncccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3125	Cc1c(Br)ccc2ccccc12.Oc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.Phenol
ullmann_phenol	3126	Cc1c(Br)ccc2ccccc12.Oc1occc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PhenolHeteroaromatic5membered
ullmann_phenol	3127	Cc1c(Br)ccc2ccccc12.Oc1ncccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PhenolHeteroaromatic6membered
ullmann_phenol	3128	Cc1ccccc1I.Oc1ccccc1CCc1ccccc1I>>Cc1ccccc1Oc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.Phenol
ullmann_phenol	3129	Cc1ccccc1I.Oc1occc1CCc1ccccc1I>>Cc1ccccc1Oc1occc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3130	Cc1ccccc1I.Oc1ncccc1CCc1ccccc1I>>Cc1ccccc1Oc1ncccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3131	Cc1c(I)ccc2ccccc12.Oc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.Phenol
ullmann_phenol	3132	Cc1c(I)ccc2ccccc12.Oc1occc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PhenolHeteroaromatic5membered
ullmann_phenol	3133	Cc1c(I)ccc2ccccc12.Oc1ncccc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PhenolHeteroaromatic6membered
ullmann_phenol	3134	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2O)c1)C(F)(F)F>>Cc1cccc(Oc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.Phenol
ullmann_phenol	3135	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccoc2O)c1)C(F)(F)F>>Cc1cccc(Oc2occc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3136	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2cccnc2O)c1)C(F)(F)F>>Cc1cccc(Oc2ncccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3137	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.Phenol
ullmann_phenol	3138	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PhenolHeteroaromatic5membered
ullmann_phenol	3139	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PhenolHeteroaromatic6membered
ullmann_phenol	3140	Cc1cocc1Br.Oc1ccccc1CCc1cocc1Br>>Cc1cocc1Oc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.Phenol
ullmann_phenol	3141	Cc1cocc1Br.Oc1occc1CCc1cocc1Br>>Cc1cocc1Oc1occc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3142	Cc1cocc1Br.Oc1ncccc1CCc1cocc1Br>>Cc1cocc1Oc1ncccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3143	Cc1c(Br)oc2cocc12.Oc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.Phenol
ullmann_phenol	3144	Cc1c(Br)oc2cocc12.Oc1occc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2occc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3145	Cc1c(Br)oc2cocc12.Oc1ncccc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3146	Cc1c(Br)oc2ccncc12.Oc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.Phenol
ullmann_phenol	3147	Cc1c(Br)oc2ccncc12.Oc1occc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2occc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3148	Cc1c(Br)oc2ccncc12.Oc1ncccc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3149	Cc1c(Br)oc2ccccc12.Oc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.Phenol
ullmann_phenol	3150	Cc1c(Br)oc2ccccc12.Oc1occc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3151	Cc1c(Br)oc2ccccc12.Oc1ncccc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3152	Cc1cnccc1Br.Oc1ccccc1CCc1cnccc1Br>>Cc1cnccc1Oc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.Phenol
ullmann_phenol	3153	Cc1cnccc1Br.Oc1occc1CCc1cnccc1Br>>Cc1cnccc1Oc1occc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3154	Cc1cnccc1Br.Oc1ncccc1CCc1cnccc1Br>>Cc1cnccc1Oc1ncccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3155	Cc1nc2cocc2cc1Br.Oc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.Phenol
ullmann_phenol	3156	Cc1nc2cocc2cc1Br.Oc1occc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3157	Cc1nc2cocc2cc1Br.Oc1ncccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3158	Cc1c(Br)ncc2ccncc12.Oc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.Phenol
ullmann_phenol	3159	Cc1c(Br)ncc2ccncc12.Oc1occc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2occc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3160	Cc1c(Br)ncc2ccncc12.Oc1ncccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3161	Cc1c(Br)ncc2ccccc12.Oc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.Phenol
ullmann_phenol	3162	Cc1c(Br)ncc2ccccc12.Oc1occc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3163	Cc1c(Br)ncc2ccccc12.Oc1ncccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3164	Cc1cc2cocc2cc1Br.Oc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.Phenol
ullmann_phenol	3165	Cc1cc2cocc2cc1Br.Oc1occc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PhenolHeteroaromatic5membered
ullmann_phenol	3166	Cc1cc2cocc2cc1Br.Oc1ncccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PhenolHeteroaromatic6membered
ullmann_phenol	3167	CCc1c(Br)ccc2ccncc12.Oc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.Phenol
ullmann_phenol	3168	CCc1c(Br)ccc2ccncc12.Oc1occc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2occc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PhenolHeteroaromatic5membered
ullmann_phenol	3169	CCc1c(Br)ccc2ccncc12.Oc1ncccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2ncccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PhenolHeteroaromatic6membered
ullmann_phenol	3170	Cc1cocc1Cl.Oc1ccccc1CCc1cocc1Cl>>Cc1cocc1Oc1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5.Phenol
ullmann_phenol	3171	Cc1cocc1Cl.Oc1occc1CCc1cocc1Cl>>Cc1cocc1Oc1occc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3172	Cc1cocc1Cl.Oc1ncccc1CCc1cocc1Cl>>Cc1cocc1Oc1ncccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3173	Cc1c(Cl)oc2cocc12.Oc1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c(Oc2ccccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het5.Phenol
ullmann_phenol	3174	Cc1c(Cl)oc2cocc12.Oc1occc1CCc1c(Cl)oc2cocc12>>Cc1c(Oc2occc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3175	Cc1c(Cl)oc2cocc12.Oc1ncccc1CCc1c(Cl)oc2cocc12>>Cc1c(Oc2ncccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3176	Cc1c(Cl)oc2ccncc12.Oc1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het6.Phenol
ullmann_phenol	3177	Cc1c(Cl)oc2ccncc12.Oc1occc1CCc1c(Cl)oc2ccncc12>>Cc1c(Oc2occc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3178	Cc1c(Cl)oc2ccncc12.Oc1ncccc1CCc1c(Cl)oc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3179	Cc1c(Cl)oc2ccccc12.Oc1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Phe.Phenol
ullmann_phenol	3180	Cc1c(Cl)oc2ccccc12.Oc1occc1CCc1c(Cl)oc2ccccc12>>Cc1c(Oc2occc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3181	Cc1c(Cl)oc2ccccc12.Oc1ncccc1CCc1c(Cl)oc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het5Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3182	Cc1cnccc1Cl.Oc1ccccc1CCc1cnccc1Cl>>Cc1cnccc1Oc1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6.Phenol
ullmann_phenol	3183	Cc1cnccc1Cl.Oc1occc1CCc1cnccc1Cl>>Cc1cnccc1Oc1occc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3184	Cc1cnccc1Cl.Oc1ncccc1CCc1cnccc1Cl>>Cc1cnccc1Oc1ncccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3185	Cc1nc2cocc2cc1Cl.Oc1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het5.Phenol
ullmann_phenol	3186	Cc1nc2cocc2cc1Cl.Oc1occc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3187	Cc1nc2cocc2cc1Cl.Oc1ncccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3188	Cc1c(Cl)ncc2ccncc12.Oc1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het6.Phenol
ullmann_phenol	3189	Cc1c(Cl)ncc2ccncc12.Oc1occc1CCc1c(Cl)ncc2ccncc12>>Cc1c(Oc2occc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3190	Cc1c(Cl)ncc2ccncc12.Oc1ncccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3191	Cc1c(Cl)ncc2ccccc12.Oc1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Phe.Phenol
ullmann_phenol	3192	Cc1c(Cl)ncc2ccccc12.Oc1occc1CCc1c(Cl)ncc2ccccc12>>Cc1c(Oc2occc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3193	Cc1c(Cl)ncc2ccccc12.Oc1ncccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Chloride_Het6Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3194	Cc1cocc1I.Oc1ccccc1CCc1cocc1I>>Cc1cocc1Oc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.Phenol
ullmann_phenol	3195	Cc1cocc1I.Oc1occc1CCc1cocc1I>>Cc1cocc1Oc1occc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3196	Cc1cocc1I.Oc1ncccc1CCc1cocc1I>>Cc1cocc1Oc1ncccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3197	Cc1c(I)oc2cocc12.Oc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.Phenol
ullmann_phenol	3198	Cc1c(I)oc2cocc12.Oc1occc1CCc1c(I)oc2cocc12>>Cc1c(Oc2occc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3199	Cc1c(I)oc2cocc12.Oc1ncccc1CCc1c(I)oc2cocc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3200	Cc1c(I)oc2ccncc12.Oc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.Phenol
ullmann_phenol	3201	Cc1c(I)oc2ccncc12.Oc1occc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2occc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3202	Cc1c(I)oc2ccncc12.Oc1ncccc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3203	Cc1c(I)oc2ccccc12.Oc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.Phenol
ullmann_phenol	3204	Cc1c(I)oc2ccccc12.Oc1occc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3205	Cc1c(I)oc2ccccc12.Oc1ncccc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3206	Cc1cnccc1I.Oc1ccccc1CCc1cnccc1I>>Cc1cnccc1Oc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.Phenol
ullmann_phenol	3207	Cc1cnccc1I.Oc1occc1CCc1cnccc1I>>Cc1cnccc1Oc1occc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3208	Cc1cnccc1I.Oc1ncccc1CCc1cnccc1I>>Cc1cnccc1Oc1ncccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3209	Cc1nc2cocc2cc1I.Oc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.Phenol
ullmann_phenol	3210	Cc1nc2cocc2cc1I.Oc1occc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3211	Cc1nc2cocc2cc1I.Oc1ncccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3212	Cc1c(I)ncc2ccncc12.Oc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.Phenol
ullmann_phenol	3213	Cc1c(I)ncc2ccncc12.Oc1occc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2occc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3214	Cc1c(I)ncc2ccncc12.Oc1ncccc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3215	Cc1c(I)ncc2ccccc12.Oc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.Phenol
ullmann_phenol	3216	Cc1c(I)ncc2ccccc12.Oc1occc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3217	Cc1c(I)ncc2ccccc12.Oc1ncccc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3218	Cc1cc2cocc2cc1I.Oc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.Phenol
ullmann_phenol	3219	Cc1cc2cocc2cc1I.Oc1occc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PhenolHeteroaromatic5membered
ullmann_phenol	3220	Cc1cc2cocc2cc1I.Oc1ncccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PhenolHeteroaromatic6membered
ullmann_phenol	3221	CCc1c(I)ccc2ccncc12.Oc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.Phenol
ullmann_phenol	3222	CCc1c(I)ccc2ccncc12.Oc1occc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2occc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PhenolHeteroaromatic5membered
ullmann_phenol	3223	CCc1c(I)ccc2ccncc12.Oc1ncccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2ncccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PhenolHeteroaromatic6membered
ullmann_phenol	3224	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1O)C(F)(F)F>>Cc1cocc1Oc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.Phenol
ullmann_phenol	3225	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccoc1O)C(F)(F)F>>Cc1cocc1Oc1occc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3226	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1cccnc1O)C(F)(F)F>>Cc1cocc1Oc1ncccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3227	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.Phenol
ullmann_phenol	3228	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3229	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3230	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.Phenol
ullmann_phenol	3231	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3232	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3233	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.Phenol
ullmann_phenol	3234	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3235	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3236	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1O)C(F)(F)F>>Cc1cnccc1Oc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.Phenol
ullmann_phenol	3237	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccoc1O)C(F)(F)F>>Cc1cnccc1Oc1occc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3238	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1cccnc1O)C(F)(F)F>>Cc1cnccc1Oc1ncccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3239	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.Phenol
ullmann_phenol	3240	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccoc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PhenolHeteroaromatic5membered
ullmann_phenol	3241	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1cccnc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PhenolHeteroaromatic6membered
ullmann_phenol	3242	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.Phenol
ullmann_phenol	3243	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PhenolHeteroaromatic5membered
ullmann_phenol	3244	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PhenolHeteroaromatic6membered
ullmann_phenol	3245	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.Phenol
ullmann_phenol	3246	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PhenolHeteroaromatic5membered
ullmann_phenol	3247	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PhenolHeteroaromatic6membered
ullmann_phenol	3248	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.Phenol
ullmann_phenol	3249	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccoc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PhenolHeteroaromatic5membered
ullmann_phenol	3250	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1cccnc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PhenolHeteroaromatic6membered
ullmann_phenol	3251	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.Phenol
ullmann_phenol	3252	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PhenolHeteroaromatic5membered
ullmann_phenol	3253	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PhenolHeteroaromatic6membered
williamson	3254	CCCCCO.OCCCCCCCBr>>CCCCCOCCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Bromide_Aliph
williamson	3255	CCCCCO.OCCCCCCC[N+]#CBr>>CCCCCOC#[N+]CCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Bromide_Nitrile
williamson	3256	CCCCCO.OCCCCCCCCl>>CCCCCOCCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Chloride_Aliph
williamson	3257	CCCCCO.OCCCCCCC[N+]#CCl>>CCCCCOC#[N+]CCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Chloride_Nitrile
williamson	3258	CCCCCO.OCCCCCCCI>>CCCCCOCCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Iodide_Aliph
williamson	3259	CCCCCO.OCCCCCCC[N+]#CI>>CCCCCOC#[N+]CCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Iodide_Nitrile
williamson	3260	CCCCCO.O=S(=O)(OCCCCCCCO)C(F)(F)F>>CCCCCOCCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Triflate_Aliph
williamson	3261	CCCCCO.O=S(=O)(OC#[N+]CCCCCCCO)C(F)(F)F>>CCCCCOC#[N+]CCCCCCCO	[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAliphatic.X-Triflate_Nitrile
williamson	3262	CCc1ccccc1CO.OCc1ccccc1CCCCBr>>CCc1ccccc1COCCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Bromide_Aliph
williamson	3263	CCc1ccccc1CO.OCc1ccccc1CCCC[N+]#CBr>>CCc1ccccc1COC#[N+]CCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Bromide_Nitrile
williamson	3264	CCc1ccccc1CO.OCc1ccccc1CCCCCl>>CCc1ccccc1COCCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Chloride_Aliph
williamson	3265	CCc1ccccc1CO.OCc1ccccc1CCCC[N+]#CCl>>CCc1ccccc1COC#[N+]CCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Chloride_Nitrile
williamson	3266	CCc1ccccc1CO.OCc1ccccc1CCCCI>>CCc1ccccc1COCCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Iodide_Aliph
williamson	3267	CCc1ccccc1CO.OCc1ccccc1CCCC[N+]#CI>>CCc1ccccc1COC#[N+]CCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Iodide_Nitrile
williamson	3268	CCc1ccccc1CO.O=S(=O)(OCCCCc1ccccc1CO)C(F)(F)F>>CCc1ccccc1COCCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Triflate_Aliph
williamson	3269	CCc1ccccc1CO.O=S(=O)(OC#[N+]CCCCc1ccccc1CO)C(F)(F)F>>CCc1ccccc1COC#[N+]CCCCc1ccccc1CO	[O;H1;D1;$(O[C;D2][a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PrimaryAlcoholAromatic.X-Triflate_Nitrile
williamson	3270	CCCCC(O)CC.CCC(O)CCCCCCBr>>CCCCC(CC)OCCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Bromide_Aliph
williamson	3271	CCCCC(O)CC.CCC(O)CCCCCC[N+]#CBr>>CCCCC(CC)OC#[N+]CCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Bromide_Nitrile
williamson	3272	CCCCC(O)CC.CCC(O)CCCCCCCl>>CCCCC(CC)OCCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Chloride_Aliph
williamson	3273	CCCCC(O)CC.CCC(O)CCCCCC[N+]#CCl>>CCCCC(CC)OC#[N+]CCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Chloride_Nitrile
williamson	3274	CCCCC(O)CC.CCC(O)CCCCCCI>>CCCCC(CC)OCCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Iodide_Aliph
williamson	3275	CCCCC(O)CC.CCC(O)CCCCCC[N+]#CI>>CCCCC(CC)OC#[N+]CCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Iodide_Nitrile
williamson	3276	CCCCC(O)CC.CCC(O)CCCCCCOS(=O)(=O)C(F)(F)F>>CCCCC(CC)OCCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Triflate_Aliph
williamson	3277	CCCCC(O)CC.CCC(O)CCCCCC[N+]#COS(=O)(=O)C(F)(F)F>>CCCCC(CC)OC#[N+]CCCCCCC(O)CC	[O;H1;D1;$(O[C;!R;D3]([A])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticAcyclic.X-Triflate_Nitrile
williamson	3278	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCCBr)CC12>>CC1CCC2C3CCCCC3C(OCCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Bromide_Aliph
williamson	3279	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCC[N+]#CBr)CC12>>CC1CCC2C3CCCCC3C(OC#[N+]CCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Bromide_Nitrile
williamson	3280	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCCCl)CC12>>CC1CCC2C3CCCCC3C(OCCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Chloride_Aliph
williamson	3281	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCC[N+]#CCl)CC12>>CC1CCC2C3CCCCC3C(OC#[N+]CCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Chloride_Nitrile
williamson	3282	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCCI)CC12>>CC1CCC2C3CCCCC3C(OCCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Iodide_Aliph
williamson	3283	CC1CCC2C(C1)C(O)C1CCCCC12.OC1C2CCCCC2C2CCC(CCC[N+]#CI)CC12>>CC1CCC2C3CCCCC3C(OC#[N+]CCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Iodide_Nitrile
williamson	3284	CC1CCC2C(C1)C(O)C1CCCCC12.O=S(=O)(OCCCC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>CC1CCC2C3CCCCC3C(OCCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Triflate_Aliph
williamson	3285	CC1CCC2C(C1)C(O)C1CCCCC12.O=S(=O)(OC#[N+]CCCC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>CC1CCC2C3CCCCC3C(OC#[N+]CCCC3CCC4C(C3)C(O)C3CCCCC34)C2C1	[O;H1;D1;$(O[C;R;D3]([A])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAliphaticCyclic.X-Triflate_Nitrile
williamson	3286	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCCBr>>CCc1ccccc1C(OCCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Bromide_Aliph
williamson	3287	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCC[N+]#CBr>>CCc1ccccc1C(OC#[N+]CCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Bromide_Nitrile
williamson	3288	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCCCl>>CCc1ccccc1C(OCCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Chloride_Aliph
williamson	3289	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCC[N+]#CCl>>CCc1ccccc1C(OC#[N+]CCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Chloride_Nitrile
williamson	3290	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCCI>>CCc1ccccc1C(OCCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Iodide_Aliph
williamson	3291	CCc1ccccc1C(O)c1ccccc1.OC(c1ccccc1)c1ccccc1CCCC[N+]#CI>>CCc1ccccc1C(OC#[N+]CCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Iodide_Nitrile
williamson	3292	CCc1ccccc1C(O)c1ccccc1.O=S(=O)(OCCCCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>CCc1ccccc1C(OCCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Triflate_Aliph
williamson	3293	CCc1ccccc1C(O)c1ccccc1.O=S(=O)(OC#[N+]CCCCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>CCc1ccccc1C(OC#[N+]CCCCc1ccccc1C(O)c1ccccc1)c1ccccc1	[O;H1;D1;$(O[C;!R;D3]([a])[a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticAcyclic.X-Triflate_Nitrile
williamson	3294	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCCBr)cc21>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Bromide_Aliph
williamson	3295	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCC[N+]#CBr)cc21>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Bromide_Nitrile
williamson	3296	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCCCl)cc21>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Chloride_Aliph
williamson	3297	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCC[N+]#CCl)cc21>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Chloride_Nitrile
williamson	3298	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCCI)cc21>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Iodide_Aliph
williamson	3299	Cc1ccc2c(c1)C(O)c1ccccc1-2.OC1c2ccccc2-c2ccc(CCC[N+]#CI)cc21>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Iodide_Nitrile
williamson	3300	Cc1ccc2c(c1)C(O)c1ccccc1-2.O=S(=O)(OCCCc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Triflate_Aliph
williamson	3301	Cc1ccc2c(c1)C(O)c1ccccc1-2.O=S(=O)(OC#[N+]CCCc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)c1ccccc1-3)c1ccccc1-2	[O;H1;D1;$(O[C;R;D3]([a])[a]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholAromaticCyclic.X-Triflate_Nitrile
williamson	3302	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCCBr>>CCCC(O)c1ccccc1CCCCOC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Bromide_Aliph
williamson	3303	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCC[N+]#CBr>>CCCC(O)c1ccccc1CCCC[N+]#COC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Bromide_Nitrile
williamson	3304	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCCCl>>CCCC(O)c1ccccc1CCCCOC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Chloride_Aliph
williamson	3305	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCC[N+]#CCl>>CCCC(O)c1ccccc1CCCC[N+]#COC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Chloride_Nitrile
williamson	3306	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCCI>>CCCC(O)c1ccccc1CCCCOC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Iodide_Aliph
williamson	3307	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCC[N+]#CI>>CCCC(O)c1ccccc1CCCC[N+]#COC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Iodide_Nitrile
williamson	3308	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCCOS(=O)(=O)C(F)(F)F>>CCCC(O)c1ccccc1CCCCOC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Triflate_Aliph
williamson	3309	CCCC(O)c1ccccc1CC.CCCC(O)c1ccccc1CCCC[N+]#COS(=O)(=O)C(F)(F)F>>CCCC(O)c1ccccc1CCCC[N+]#COC(CCC)c1ccccc1CC	[O;H1;D1;$(O[C;!R;D3]([a])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixAcyclic.X-Triflate_Nitrile
williamson	3310	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCCBr)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Bromide_Aliph
williamson	3311	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCC[N+]#CBr)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Bromide_Nitrile
williamson	3312	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCCCl)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Chloride_Aliph
williamson	3313	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCC[N+]#CCl)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Chloride_Nitrile
williamson	3314	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCCI)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Iodide_Aliph
williamson	3315	Cc1ccc2c(c1)C(O)C1CCCCC21.OC1c2cc(CCC[N+]#CI)ccc2C2CCCCC12>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Iodide_Nitrile
williamson	3316	Cc1ccc2c(c1)C(O)C1CCCCC21.O=S(=O)(OCCCc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1ccc2c(c1)C(OCCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Triflate_Aliph
williamson	3317	Cc1ccc2c(c1)C(O)C1CCCCC21.O=S(=O)(OC#[N+]CCCc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1ccc2c(c1)C(OC#[N+]CCCc1ccc3c(c1)C(O)C1CCCCC31)C1CCCCC21	[O;H1;D1;$(O[C;R;D3]([a])[A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	SecondaryAlcoholMixCyclic.X-Triflate_Nitrile
williamson	3318	CC(C)CC(C)(C)O.CC(CCCBr)CC(C)(C)O>>CC(C)CC(C)(C)OCCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Bromide_Aliph
williamson	3319	CC(C)CC(C)(C)O.CC(CCC[N+]#CBr)CC(C)(C)O>>CC(C)CC(C)(C)OC#[N+]CCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Bromide_Nitrile
williamson	3320	CC(C)CC(C)(C)O.CC(CCCCl)CC(C)(C)O>>CC(C)CC(C)(C)OCCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Chloride_Aliph
williamson	3321	CC(C)CC(C)(C)O.CC(CCC[N+]#CCl)CC(C)(C)O>>CC(C)CC(C)(C)OC#[N+]CCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Chloride_Nitrile
williamson	3322	CC(C)CC(C)(C)O.CC(CCCI)CC(C)(C)O>>CC(C)CC(C)(C)OCCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Iodide_Aliph
williamson	3323	CC(C)CC(C)(C)O.CC(CCC[N+]#CI)CC(C)(C)O>>CC(C)CC(C)(C)OC#[N+]CCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Iodide_Nitrile
williamson	3324	CC(C)CC(C)(C)O.CC(CCCOS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CC(C)CC(C)(C)OCCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Triflate_Aliph
williamson	3325	CC(C)CC(C)(C)O.CC(CCC[N+]#COS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CC(C)CC(C)(C)OC#[N+]CCCC(C)CC(C)(C)O	[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholAcyclic.X-Triflate_Nitrile
williamson	3326	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCCBr)C1>>CC1CCCC(C)(OCCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Bromide_Aliph
williamson	3327	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCC[N+]#CBr)C1>>CC1CCCC(C)(OC#[N+]CCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Bromide_Nitrile
williamson	3328	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCCCl)C1>>CC1CCCC(C)(OCCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Chloride_Aliph
williamson	3329	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCC[N+]#CCl)C1>>CC1CCCC(C)(OC#[N+]CCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Chloride_Nitrile
williamson	3330	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCCI)C1>>CC1CCCC(C)(OCCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Iodide_Aliph
williamson	3331	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCC[N+]#CI)C1>>CC1CCCC(C)(OC#[N+]CCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Iodide_Nitrile
williamson	3332	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCCOS(=O)(=O)C(F)(F)F)C1>>CC1CCCC(C)(OCCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Triflate_Aliph
williamson	3333	CC1CCCC(C)(O)C1.CC1(O)CCCC(CCC[N+]#COS(=O)(=O)C(F)(F)F)C1>>CC1CCCC(C)(OC#[N+]CCCC2CCCC(C)(O)C2)C1	[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	TertiaryAlcoholCyclic.X-Triflate_Nitrile
williamson	3334	CCc1ccccc1O.Oc1ccccc1CCCCBr>>CCc1ccccc1OCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Bromide_Aliph
williamson	3335	CCc1ccccc1O.Oc1ccccc1CCCC[N+]#CBr>>CCc1ccccc1OC#[N+]CCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Bromide_Nitrile
williamson	3336	CCc1ccccc1O.Oc1ccccc1CCCCCl>>CCc1ccccc1OCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Chloride_Aliph
williamson	3337	CCc1ccccc1O.Oc1ccccc1CCCC[N+]#CCl>>CCc1ccccc1OC#[N+]CCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Chloride_Nitrile
williamson	3338	CCc1ccccc1O.Oc1ccccc1CCCCI>>CCc1ccccc1OCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Iodide_Aliph
williamson	3339	CCc1ccccc1O.Oc1ccccc1CCCC[N+]#CI>>CCc1ccccc1OC#[N+]CCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Iodide_Nitrile
williamson	3340	CCc1ccccc1O.O=S(=O)(OCCCCc1ccccc1O)C(F)(F)F>>CCc1ccccc1OCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Triflate_Aliph
williamson	3341	CCc1ccccc1O.O=S(=O)(OC#[N+]CCCCc1ccccc1O)C(F)(F)F>>CCc1ccccc1OC#[N+]CCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	Phenol.X-Triflate_Nitrile
williamson	3342	CCc1ccoc1O.Oc1occc1CCCCBr>>CCc1ccoc1OCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Bromide_Aliph
williamson	3343	CCc1ccoc1O.Oc1occc1CCCC[N+]#CBr>>CCc1ccoc1OC#[N+]CCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Bromide_Nitrile
williamson	3344	CCc1ccoc1O.Oc1occc1CCCCCl>>CCc1ccoc1OCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Chloride_Aliph
williamson	3345	CCc1ccoc1O.Oc1occc1CCCC[N+]#CCl>>CCc1ccoc1OC#[N+]CCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Chloride_Nitrile
williamson	3346	CCc1ccoc1O.Oc1occc1CCCCI>>CCc1ccoc1OCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Iodide_Aliph
williamson	3347	CCc1ccoc1O.Oc1occc1CCCC[N+]#CI>>CCc1ccoc1OC#[N+]CCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Iodide_Nitrile
williamson	3348	CCc1ccoc1O.O=S(=O)(OCCCCc1ccoc1O)C(F)(F)F>>CCc1ccoc1OCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Triflate_Aliph
williamson	3349	CCc1ccoc1O.O=S(=O)(OC#[N+]CCCCc1ccoc1O)C(F)(F)F>>CCc1ccoc1OC#[N+]CCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic5membered.X-Triflate_Nitrile
williamson	3350	CCc1cccnc1O.Oc1ncccc1CCCCBr>>CCc1cccnc1OCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Br[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Bromide_Aliph
williamson	3351	CCc1cccnc1O.Oc1ncccc1CCCC[N+]#CBr>>CCc1cccnc1OC#[N+]CCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Bromide_Nitrile
williamson	3352	CCc1cccnc1O.Oc1ncccc1CCCCCl>>CCc1cccnc1OCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(Cl[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Chloride_Aliph
williamson	3353	CCc1cccnc1O.Oc1ncccc1CCCC[N+]#CCl>>CCc1cccnc1OC#[N+]CCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Chloride_Nitrile
williamson	3354	CCc1cccnc1O.Oc1ncccc1CCCCI>>CCc1cccnc1OCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]);!$(I[C;D2][C;D3](=[O,S])):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Iodide_Aliph
williamson	3355	CCc1cccnc1O.Oc1ncccc1CCCC[N+]#CI>>CCc1cccnc1OC#[N+]CCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Iodide_Nitrile
williamson	3356	CCc1cccnc1O.O=S(=O)(OCCCCc1cccnc1O)C(F)(F)F>>CCc1cccnc1OCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);!$(O[C;D2][C;D3](=[O,S]));$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Triflate_Aliph
williamson	3357	CCc1cccnc1O.O=S(=O)(OC#[N+]CCCCc1cccnc1O)C(F)(F)F>>CCc1cccnc1OC#[N+]CCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*C#N)]):3][C@:4]>>[#6:2][O:1][C@@:4]	PhenolHeteroaromatic6membered.X-Triflate_Nitrile
deoxygenative_coupling	3358	Cc1ccccc1Br.OCCCCCc1ccccc1Br>>Cc1ccccc1CCCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.PrimaryAlcoholAliphatic
deoxygenative_coupling	3359	Cc1ccccc1Br.OCc1ccccc1CCc1ccccc1Br>>Cc1ccccc1Cc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.PrimaryAlcoholAromatic
deoxygenative_coupling	3360	Cc1ccccc1Br.CCC(O)CCCCc1ccccc1Br>>CCC(CCCCc1ccccc1Br)c1ccccc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3361	Cc1ccccc1Br.OC1C2CCCCC2C2CCC(Cc3ccccc3Br)CC12>>Cc1ccccc1C1C2CCCCC2C2CCC(Cc3ccccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3362	Cc1ccccc1Br.OC(c1ccccc1)c1ccccc1CCc1ccccc1Br>>Cc1ccccc1C(c1ccccc1)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3363	Cc1ccccc1Br.OC1c2ccccc2-c2ccc(Cc3ccccc3Br)cc21>>Cc1ccccc1C1c2ccccc2c2ccc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3364	Cc1ccccc1Br.CCCC(O)c1ccccc1CCc1ccccc1Br>>CCCC(c1ccccc1C)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3365	Cc1ccccc1Br.OC1c2cc(Cc3ccccc3Br)ccc2C2CCCCC12>>Cc1ccccc1C1c2cc(Cc3ccccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3366	Cc1ccccc1Br.CC(Cc1ccccc1Br)CC(C)(C)O>>Cc1ccccc1C(C)(C)CC(C)Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.TertiaryAlcoholAcyclic
deoxygenative_coupling	3367	Cc1ccccc1Br.CC1(O)CCCC(Cc2ccccc2Br)C1>>Cc1ccccc1C1(C)CCCC(Cc2ccccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Phe.TertiaryAlcoholCyclic
deoxygenative_coupling	3368	Cc1c(Br)ccc2ccccc12.OCCCCCc1c(Br)ccc2ccccc12>>Cc1c(CCCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.PrimaryAlcoholAliphatic
deoxygenative_coupling	3369	Cc1c(Br)ccc2ccccc12.OCc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Cc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.PrimaryAlcoholAromatic
deoxygenative_coupling	3370	Cc1c(Br)ccc2ccccc12.CCC(O)CCCCc1c(Br)ccc2ccccc12>>CCC(CCCCc1c(Br)ccc2ccccc12)c1ccc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3371	Cc1c(Br)ccc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ccc4ccccc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)ccc5ccccc45)CC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3372	Cc1c(Br)ccc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3373	Cc1c(Br)ccc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ccc4ccccc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3374	Cc1c(Br)ccc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)ccc2ccccc12>>CCCC(c1ccccc1CCc1c(Br)ccc2ccccc12)c1ccc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3375	Cc1c(Br)ccc2ccccc12.OC1c2cc(Cc3c(Br)ccc4ccccc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3376	Cc1c(Br)ccc2ccccc12.CC(Cc1c(Br)ccc2ccccc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.TertiaryAlcoholAcyclic
deoxygenative_coupling	3377	Cc1c(Br)ccc2ccccc12.CC1(O)CCCC(Cc2c(Br)ccc3ccccc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)ccc4ccccc34)C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PhePhe.TertiaryAlcoholCyclic
deoxygenative_coupling	3378	Cc1cocc1Br.OCCCCCc1cocc1Br>>Cc1cocc1CCCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.PrimaryAlcoholAliphatic
deoxygenative_coupling	3379	Cc1cocc1Br.OCc1ccccc1CCc1cocc1Br>>Cc1cocc1Cc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.PrimaryAlcoholAromatic
deoxygenative_coupling	3380	Cc1cocc1Br.CCC(O)CCCCc1cocc1Br>>CCC(CCCCc1cocc1Br)c1cocc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3381	Cc1cocc1Br.OC1C2CCCCC2C2CCC(Cc3cocc3Br)CC12>>Cc1cocc1C1C2CCCCC2C2CCC(Cc3cocc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3382	Cc1cocc1Br.OC(c1ccccc1)c1ccccc1CCc1cocc1Br>>Cc1cocc1C(c1ccccc1)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3383	Cc1cocc1Br.OC1c2ccccc2-c2ccc(Cc3cocc3Br)cc21>>Cc1cocc1C1c2ccccc2c2ccc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3384	Cc1cocc1Br.CCCC(O)c1ccccc1CCc1cocc1Br>>CCCC(c1cocc1C)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3385	Cc1cocc1Br.OC1c2cc(Cc3cocc3Br)ccc2C2CCCCC12>>Cc1cocc1C1c2cc(Cc3cocc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3386	Cc1cocc1Br.CC(Cc1cocc1Br)CC(C)(C)O>>Cc1cocc1C(C)(C)CC(C)Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.TertiaryAlcoholAcyclic
deoxygenative_coupling	3387	Cc1cocc1Br.CC1(O)CCCC(Cc2cocc2Br)C1>>Cc1cocc1C1(C)CCCC(Cc2cocc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5.TertiaryAlcoholCyclic
deoxygenative_coupling	3388	Cc1c(Br)oc2cocc12.OCCCCCc1c(Br)oc2cocc12>>Cc1c(CCCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.PrimaryAlcoholAliphatic
deoxygenative_coupling	3389	Cc1c(Br)oc2cocc12.OCc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(Cc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.PrimaryAlcoholAromatic
deoxygenative_coupling	3390	Cc1c(Br)oc2cocc12.CCC(O)CCCCc1c(Br)oc2cocc12>>CCC(CCCCc1c(Br)oc2cocc12)c1oc2cocc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3391	Cc1c(Br)oc2cocc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4cocc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)oc5cocc45)CC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3392	Cc1c(Br)oc2cocc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3393	Cc1c(Br)oc2cocc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4cocc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3394	Cc1c(Br)oc2cocc12.CCCC(O)c1ccccc1CCc1c(Br)oc2cocc12>>CCCC(c1ccccc1CCc1c(Br)oc2cocc12)c1oc2cocc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3395	Cc1c(Br)oc2cocc12.OC1c2cc(Cc3c(Br)oc4cocc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3396	Cc1c(Br)oc2cocc12.CC(Cc1c(Br)oc2cocc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.TertiaryAlcoholAcyclic
deoxygenative_coupling	3397	Cc1c(Br)oc2cocc12.CC1(O)CCCC(Cc2c(Br)oc3cocc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)oc4cocc34)C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.TertiaryAlcoholCyclic
deoxygenative_coupling	3398	Cc1c(Br)oc2ccncc12.OCCCCCc1c(Br)oc2ccncc12>>Cc1c(CCCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.PrimaryAlcoholAliphatic
deoxygenative_coupling	3399	Cc1c(Br)oc2ccncc12.OCc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(Cc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.PrimaryAlcoholAromatic
deoxygenative_coupling	3400	Cc1c(Br)oc2ccncc12.CCC(O)CCCCc1c(Br)oc2ccncc12>>CCC(CCCCc1c(Br)oc2ccncc12)c1oc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3401	Cc1c(Br)oc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccncc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)oc5ccncc45)CC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3402	Cc1c(Br)oc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3403	Cc1c(Br)oc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccncc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3404	Cc1c(Br)oc2ccncc12.CCCC(O)c1ccccc1CCc1c(Br)oc2ccncc12>>CCCC(c1ccccc1CCc1c(Br)oc2ccncc12)c1oc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3405	Cc1c(Br)oc2ccncc12.OC1c2cc(Cc3c(Br)oc4ccncc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3406	Cc1c(Br)oc2ccncc12.CC(Cc1c(Br)oc2ccncc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.TertiaryAlcoholAcyclic
deoxygenative_coupling	3407	Cc1c(Br)oc2ccncc12.CC1(O)CCCC(Cc2c(Br)oc3ccncc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)oc4ccncc34)C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.TertiaryAlcoholCyclic
deoxygenative_coupling	3408	Cc1c(Br)oc2ccccc12.OCCCCCc1c(Br)oc2ccccc12>>Cc1c(CCCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.PrimaryAlcoholAliphatic
deoxygenative_coupling	3409	Cc1c(Br)oc2ccccc12.OCc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(Cc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.PrimaryAlcoholAromatic
deoxygenative_coupling	3410	Cc1c(Br)oc2ccccc12.CCC(O)CCCCc1c(Br)oc2ccccc12>>CCC(CCCCc1c(Br)oc2ccccc12)c1oc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3411	Cc1c(Br)oc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccccc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)oc5ccccc45)CC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3412	Cc1c(Br)oc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3413	Cc1c(Br)oc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccccc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3414	Cc1c(Br)oc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)oc2ccccc12>>CCCC(c1ccccc1CCc1c(Br)oc2ccccc12)c1oc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3415	Cc1c(Br)oc2ccccc12.OC1c2cc(Cc3c(Br)oc4ccccc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3416	Cc1c(Br)oc2ccccc12.CC(Cc1c(Br)oc2ccccc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.TertiaryAlcoholAcyclic
deoxygenative_coupling	3417	Cc1c(Br)oc2ccccc12.CC1(O)CCCC(Cc2c(Br)oc3ccccc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)oc4ccccc34)C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.TertiaryAlcoholCyclic
deoxygenative_coupling	3418	Cc1cnccc1Br.OCCCCCc1cnccc1Br>>Cc1cnccc1CCCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.PrimaryAlcoholAliphatic
deoxygenative_coupling	3419	Cc1cnccc1Br.OCc1ccccc1CCc1cnccc1Br>>Cc1cnccc1Cc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.PrimaryAlcoholAromatic
deoxygenative_coupling	3420	Cc1cnccc1Br.CCC(O)CCCCc1cnccc1Br>>CCC(CCCCc1cnccc1Br)c1ccncc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3421	Cc1cnccc1Br.OC1C2CCCCC2C2CCC(Cc3cnccc3Br)CC12>>Cc1cnccc1C1C2CCCCC2C2CCC(Cc3cnccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3422	Cc1cnccc1Br.OC(c1ccccc1)c1ccccc1CCc1cnccc1Br>>Cc1cnccc1C(c1ccccc1)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3423	Cc1cnccc1Br.OC1c2ccccc2-c2ccc(Cc3cnccc3Br)cc21>>Cc1cnccc1C1c2ccccc2c2ccc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3424	Cc1cnccc1Br.CCCC(O)c1ccccc1CCc1cnccc1Br>>CCCC(c1ccncc1C)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3425	Cc1cnccc1Br.OC1c2cc(Cc3cnccc3Br)ccc2C2CCCCC12>>Cc1cnccc1C1c2cc(Cc3cnccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3426	Cc1cnccc1Br.CC(Cc1cnccc1Br)CC(C)(C)O>>Cc1cnccc1C(C)(C)CC(C)Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.TertiaryAlcoholAcyclic
deoxygenative_coupling	3427	Cc1cnccc1Br.CC1(O)CCCC(Cc2cnccc2Br)C1>>Cc1cnccc1C1(C)CCCC(Cc2cnccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6.TertiaryAlcoholCyclic
deoxygenative_coupling	3428	Cc1nc2cocc2cc1Br.OCCCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1CCCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.PrimaryAlcoholAliphatic
deoxygenative_coupling	3429	Cc1nc2cocc2cc1Br.OCc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Cc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.PrimaryAlcoholAromatic
deoxygenative_coupling	3430	Cc1nc2cocc2cc1Br.CCC(O)CCCCc1nc2cocc2cc1Br>>CCC(CCCCc1nc2cocc2cc1Br)c1cc2cocc2nc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3431	Cc1nc2cocc2cc1Br.OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC12>>Cc1nc2cocc2cc1C1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3432	Cc1nc2cocc2cc1Br.OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1C(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3433	Cc1nc2cocc2cc1Br.OC1c2ccccc2-c2ccc(Cc3nc4cocc4cc3Br)cc21>>Cc1nc2cocc2cc1C1c2ccccc2c2ccc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3434	Cc1nc2cocc2cc1Br.CCCC(O)c1ccccc1CCc1nc2cocc2cc1Br>>CCCC(c1ccccc1CCc1nc2cocc2cc1Br)c1cc2cocc2nc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3435	Cc1nc2cocc2cc1Br.OC1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1nc2cocc2cc1C1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3436	Cc1nc2cocc2cc1Br.CC(Cc1nc2cocc2cc1Br)CC(C)(C)O>>Cc1nc2cocc2cc1C(C)(C)CC(C)Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.TertiaryAlcoholAcyclic
deoxygenative_coupling	3437	Cc1nc2cocc2cc1Br.CC1(O)CCCC(Cc2nc3cocc3cc2Br)C1>>Cc1nc2cocc2cc1C1(C)CCCC(Cc2nc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.TertiaryAlcoholCyclic
deoxygenative_coupling	3438	Cc1c(Br)ncc2ccncc12.OCCCCCc1c(Br)ncc2ccncc12>>Cc1c(CCCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.PrimaryAlcoholAliphatic
deoxygenative_coupling	3439	Cc1c(Br)ncc2ccncc12.OCc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Cc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.PrimaryAlcoholAromatic
deoxygenative_coupling	3440	Cc1c(Br)ncc2ccncc12.CCC(O)CCCCc1c(Br)ncc2ccncc12>>CCC(CCCCc1c(Br)ncc2ccncc12)c1ncc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3441	Cc1c(Br)ncc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccncc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccncc45)CC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3442	Cc1c(Br)ncc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3443	Cc1c(Br)ncc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccncc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3444	Cc1c(Br)ncc2ccncc12.CCCC(O)c1ccccc1CCc1c(Br)ncc2ccncc12>>CCCC(c1ccccc1CCc1c(Br)ncc2ccncc12)c1ncc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3445	Cc1c(Br)ncc2ccncc12.OC1c2cc(Cc3c(Br)ncc4ccncc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3446	Cc1c(Br)ncc2ccncc12.CC(Cc1c(Br)ncc2ccncc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.TertiaryAlcoholAcyclic
deoxygenative_coupling	3447	Cc1c(Br)ncc2ccncc12.CC1(O)CCCC(Cc2c(Br)ncc3ccncc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)ncc4ccncc34)C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.TertiaryAlcoholCyclic
deoxygenative_coupling	3448	Cc1c(Br)ncc2ccccc12.OCCCCCc1c(Br)ncc2ccccc12>>Cc1c(CCCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.PrimaryAlcoholAliphatic
deoxygenative_coupling	3449	Cc1c(Br)ncc2ccccc12.OCc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Cc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.PrimaryAlcoholAromatic
deoxygenative_coupling	3450	Cc1c(Br)ncc2ccccc12.CCC(O)CCCCc1c(Br)ncc2ccccc12>>CCC(CCCCc1c(Br)ncc2ccccc12)c1ncc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3451	Cc1c(Br)ncc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccccc34)CC12>>Cc1c(C2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccccc45)CC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3452	Cc1c(Br)ncc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(C(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3453	Cc1c(Br)ncc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccccc34)cc21>>Cc1c(C2c3ccccc3c3ccc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3454	Cc1c(Br)ncc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)ncc2ccccc12>>CCCC(c1ccccc1CCc1c(Br)ncc2ccccc12)c1ncc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3455	Cc1c(Br)ncc2ccccc12.OC1c2cc(Cc3c(Br)ncc4ccccc34)ccc2C2CCCCC12>>Cc1c(C2c3cc(Cc4c(Br)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3456	Cc1c(Br)ncc2ccccc12.CC(Cc1c(Br)ncc2ccccc12)CC(C)(C)O>>Cc1c(C(C)(C)CC(C)Cc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.TertiaryAlcoholAcyclic
deoxygenative_coupling	3457	Cc1c(Br)ncc2ccccc12.CC1(O)CCCC(Cc2c(Br)ncc3ccccc23)C1>>Cc1c(C2(C)CCCC(Cc3c(Br)ncc4ccccc34)C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.TertiaryAlcoholCyclic
deoxygenative_coupling	3458	Cc1cc2cocc2cc1Br.OCCCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1CCCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.PrimaryAlcoholAliphatic
deoxygenative_coupling	3459	Cc1cc2cocc2cc1Br.OCc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Cc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.PrimaryAlcoholAromatic
deoxygenative_coupling	3460	Cc1cc2cocc2cc1Br.CCC(O)CCCCc1cc2cocc2cc1Br>>CCC(CCCCc1cc2cocc2cc1Br)c1cc2cocc2cc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3461	Cc1cc2cocc2cc1Br.OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC12>>Cc1cc2cocc2cc1C1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3462	Cc1cc2cocc2cc1Br.OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1C(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3463	Cc1cc2cocc2cc1Br.OC1c2ccccc2-c2ccc(Cc3cc4cocc4cc3Br)cc21>>Cc1cc2cocc2cc1C1c2ccccc2c2ccc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3464	Cc1cc2cocc2cc1Br.CCCC(O)c1ccccc1CCc1cc2cocc2cc1Br>>CCCC(c1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3465	Cc1cc2cocc2cc1Br.OC1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1cc2cocc2cc1C1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3466	Cc1cc2cocc2cc1Br.CC(Cc1cc2cocc2cc1Br)CC(C)(C)O>>Cc1cc2cocc2cc1C(C)(C)CC(C)Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.TertiaryAlcoholAcyclic
deoxygenative_coupling	3467	Cc1cc2cocc2cc1Br.CC1(O)CCCC(Cc2cc3cocc3cc2Br)C1>>Cc1cc2cocc2cc1C1(C)CCCC(Cc2cc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet5.TertiaryAlcoholCyclic
deoxygenative_coupling	3468	CCc1c(Br)ccc2ccncc12.OCCCCCCc1c(Br)ccc2ccncc12>>CCc1c(CCCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.PrimaryAlcoholAliphatic
deoxygenative_coupling	3469	CCc1c(Br)ccc2ccncc12.OCc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Cc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.PrimaryAlcoholAromatic
deoxygenative_coupling	3470	CCc1c(Br)ccc2ccncc12.CCC(O)CCCCCc1c(Br)ccc2ccncc12>>CCc1c(C(CC)CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAliphaticAcyclic
deoxygenative_coupling	3471	CCc1c(Br)ccc2ccncc12.OC1C2CCCCC2C2CCC(CCc3c(Br)ccc4ccncc34)CC12>>CCc1c(C2C3CCCCC3C3CCC(CCc4c(Br)ccc5ccncc45)CC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAliphaticCyclic
deoxygenative_coupling	3472	CCc1c(Br)ccc2ccncc12.OC(c1ccccc1)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(C(c2ccccc2)c2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAromaticAcyclic
deoxygenative_coupling	3473	CCc1c(Br)ccc2ccncc12.OC1c2ccccc2-c2ccc(CCc3c(Br)ccc4ccncc34)cc21>>CCc1c(C2c3ccccc3c3ccc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAromaticCyclic
deoxygenative_coupling	3474	CCc1c(Br)ccc2ccncc12.CCCC(O)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCCC(c1ccccc1CCCc1c(Br)ccc2ccncc12)c1ccc2ccncc2c1CC	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholMixAcyclic
deoxygenative_coupling	3475	CCc1c(Br)ccc2ccncc12.OC1c2cc(CCc3c(Br)ccc4ccncc34)ccc2C2CCCCC12>>CCc1c(C2c3cc(CCc4c(Br)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholMixCyclic
deoxygenative_coupling	3476	CCc1c(Br)ccc2ccncc12.CC(CCc1c(Br)ccc2ccncc12)CC(C)(C)O>>CCc1c(C(C)(C)CC(C)CCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.TertiaryAlcoholAcyclic
deoxygenative_coupling	3477	CCc1c(Br)ccc2ccncc12.CC1(O)CCCC(CCc2c(Br)ccc3ccncc23)C1>>CCc1c(C2(C)CCCC(CCc3c(Br)ccc4ccncc34)C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[a:2][#6:4]	X-Bromide_PheHet6.TertiaryAlcoholCyclic
suzuki	3478	Cc1ccccc1Br.OB1CCCC(Cc2ccccc2Br)O1>>Cc1ccccc1CCCC(O)Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Phe.BoronicCyclic
suzuki	3479	Cc1ccccc1Br.OB(O)c1ccccc1CCc1ccccc1Br>>Cc1ccccc1c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Phe.Boronic_Aromatic
suzuki	3480	Cc1ccccc1Br.OB(O)c1ccncc1CCc1ccccc1Br>>Cc1ccccc1c1ccncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Phe.Boronic_Heteroaromatic
suzuki	3481	Cc1ccccc1Br.CC1(C)OB(c2ccccc2CCc2ccccc2Br)OC1(C)C>>Cc1ccccc1c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.Boronate_Aromatic
suzuki	3482	Cc1ccccc1Br.CC1(C)OB(c2ccncc2CCc2ccccc2Br)OC1(C)C>>Cc1ccccc1c1ccncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.Boronate_Heteroaromatic
suzuki	3483	Cc1ccccc1Br.F[B-](F)(F)c1ccccc1CCc1ccccc1Br>>Cc1ccccc1c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.TrifluoroBoronateAromatic
suzuki	3484	Cc1c(Br)ccc2ccccc12.OB1CCCC(Cc2c(Br)ccc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PhePhe.BoronicCyclic
suzuki	3485	Cc1c(Br)ccc2ccccc12.OB(O)c1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(c2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PhePhe.Boronic_Aromatic
suzuki	3486	Cc1c(Br)ccc2ccccc12.OB(O)c1ccncc1CCc1c(Br)ccc2ccccc12>>Cc1c(c2ccncc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PhePhe.Boronic_Heteroaromatic
suzuki	3487	Cc1c(Br)ccc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(Br)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.Boronate_Aromatic
suzuki	3488	Cc1c(Br)ccc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(Br)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccncc1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.Boronate_Heteroaromatic
suzuki	3489	Cc1c(Br)ccc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.TrifluoroBoronateAromatic
suzuki	3490	Cc1ccccc1I.OB1CCCC(Cc2ccccc2I)O1>>Cc1ccccc1CCCC(O)Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Phe.BoronicCyclic
suzuki	3491	Cc1ccccc1I.OB(O)c1ccccc1CCc1ccccc1I>>Cc1ccccc1c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Phe.Boronic_Aromatic
suzuki	3492	Cc1ccccc1I.OB(O)c1ccncc1CCc1ccccc1I>>Cc1ccccc1c1ccncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Phe.Boronic_Heteroaromatic
suzuki	3493	Cc1ccccc1I.CC1(C)OB(c2ccccc2CCc2ccccc2I)OC1(C)C>>Cc1ccccc1c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.Boronate_Aromatic
suzuki	3494	Cc1ccccc1I.CC1(C)OB(c2ccncc2CCc2ccccc2I)OC1(C)C>>Cc1ccccc1c1ccncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.Boronate_Heteroaromatic
suzuki	3495	Cc1ccccc1I.F[B-](F)(F)c1ccccc1CCc1ccccc1I>>Cc1ccccc1c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.TrifluoroBoronateAromatic
suzuki	3496	Cc1c(I)ccc2ccccc12.OB1CCCC(Cc2c(I)ccc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PhePhe.BoronicCyclic
suzuki	3497	Cc1c(I)ccc2ccccc12.OB(O)c1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(c2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PhePhe.Boronic_Aromatic
suzuki	3498	Cc1c(I)ccc2ccccc12.OB(O)c1ccncc1CCc1c(I)ccc2ccccc12>>Cc1c(c2ccncc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PhePhe.Boronic_Heteroaromatic
suzuki	3499	Cc1c(I)ccc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(I)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.Boronate_Aromatic
suzuki	3500	Cc1c(I)ccc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(I)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccncc1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.Boronate_Heteroaromatic
suzuki	3501	Cc1c(I)ccc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.TrifluoroBoronateAromatic
suzuki	3502	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCCB(O)O2)c1)C(F)(F)F>>Cc1cccc(CCCC(O)Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Phe.BoronicCyclic
suzuki	3503	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2B(O)O)c1)C(F)(F)F>>Cc1cccc(c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Phe.Boronic_Aromatic
suzuki	3504	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2cnccc2B(O)O)c1)C(F)(F)F>>Cc1cccc(c2ccncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Phe.Boronic_Heteroaromatic
suzuki	3505	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC1(C)OB(c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)OC1(C)C>>Cc1cccc(c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.Boronate_Aromatic
suzuki	3506	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC1(C)OB(c2ccncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)OC1(C)C>>Cc1cccc(c2ccncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.Boronate_Heteroaromatic
suzuki	3507	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2[B-](F)(F)F)c1)C(F)(F)F>>Cc1cccc(c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.TrifluoroBoronateAromatic
suzuki	3508	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PhePhe.BoronicCyclic
suzuki	3509	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PhePhe.Boronic_Aromatic
suzuki	3510	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PhePhe.Boronic_Heteroaromatic
suzuki	3511	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.Boronate_Aromatic
suzuki	3512	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)OC1(C)C>>Cc1c2ccccc2ccc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.Boronate_Heteroaromatic
suzuki	3513	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.TrifluoroBoronateAromatic
suzuki	3514	Cc1cocc1Br.OB1CCCC(Cc2cocc2Br)O1>>Cc1cocc1CCCC(O)Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5.BoronicCyclic
suzuki	3515	Cc1cocc1Br.OB(O)c1ccccc1CCc1cocc1Br>>Cc1cocc1c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5.Boronic_Aromatic
suzuki	3516	Cc1cocc1Br.OB(O)c1ccncc1CCc1cocc1Br>>Cc1cocc1c1ccncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5.Boronic_Heteroaromatic
suzuki	3517	Cc1cocc1Br.CC1(C)OB(c2ccccc2CCc2cocc2Br)OC1(C)C>>Cc1cocc1c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.Boronate_Aromatic
suzuki	3518	Cc1cocc1Br.CC1(C)OB(c2ccncc2CCc2cocc2Br)OC1(C)C>>Cc1cocc1c1ccncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.Boronate_Heteroaromatic
suzuki	3519	Cc1cocc1Br.F[B-](F)(F)c1ccccc1CCc1cocc1Br>>Cc1cocc1c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.TrifluoroBoronateAromatic
suzuki	3520	Cc1c(Br)oc2cocc12.OB1CCCC(Cc2c(Br)oc3cocc23)O1>>Cc1c(CCCC(O)Cc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.BoronicCyclic
suzuki	3521	Cc1c(Br)oc2cocc12.OB(O)c1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(c2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.Boronic_Aromatic
suzuki	3522	Cc1c(Br)oc2cocc12.OB(O)c1ccncc1CCc1c(Br)oc2cocc12>>Cc1c(c2ccncc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het5.Boronic_Heteroaromatic
suzuki	3523	Cc1c(Br)oc2cocc12.CC1(C)OB(c2ccccc2CCc2c(Br)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccccc1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.Boronate_Aromatic
suzuki	3524	Cc1c(Br)oc2cocc12.CC1(C)OB(c2ccncc2CCc2c(Br)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccncc1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.Boronate_Heteroaromatic
suzuki	3525	Cc1c(Br)oc2cocc12.F[B-](F)(F)c1ccccc1CCc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.TrifluoroBoronateAromatic
suzuki	3526	Cc1c(Br)oc2ccncc12.OB1CCCC(Cc2c(Br)oc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.BoronicCyclic
suzuki	3527	Cc1c(Br)oc2ccncc12.OB(O)c1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(c2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.Boronic_Aromatic
suzuki	3528	Cc1c(Br)oc2ccncc12.OB(O)c1ccncc1CCc1c(Br)oc2ccncc12>>Cc1c(c2ccncc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Het6.Boronic_Heteroaromatic
suzuki	3529	Cc1c(Br)oc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(Br)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccccc1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.Boronate_Aromatic
suzuki	3530	Cc1c(Br)oc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(Br)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccncc1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.Boronate_Heteroaromatic
suzuki	3531	Cc1c(Br)oc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.TrifluoroBoronateAromatic
suzuki	3532	Cc1c(Br)oc2ccccc12.OB1CCCC(Cc2c(Br)oc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.BoronicCyclic
suzuki	3533	Cc1c(Br)oc2ccccc12.OB(O)c1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(c2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.Boronic_Aromatic
suzuki	3534	Cc1c(Br)oc2ccccc12.OB(O)c1ccncc1CCc1c(Br)oc2ccccc12>>Cc1c(c2ccncc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het5Phe.Boronic_Heteroaromatic
suzuki	3535	Cc1c(Br)oc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(Br)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccccc1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.Boronate_Aromatic
suzuki	3536	Cc1c(Br)oc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(Br)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccncc1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.Boronate_Heteroaromatic
suzuki	3537	Cc1c(Br)oc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.TrifluoroBoronateAromatic
suzuki	3538	Cc1cnccc1Br.OB1CCCC(Cc2cnccc2Br)O1>>Cc1cnccc1CCCC(O)Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6.BoronicCyclic
suzuki	3539	Cc1cnccc1Br.OB(O)c1ccccc1CCc1cnccc1Br>>Cc1cnccc1c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6.Boronic_Aromatic
suzuki	3540	Cc1cnccc1Br.OB(O)c1ccncc1CCc1cnccc1Br>>Cc1cnccc1c1ccncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6.Boronic_Heteroaromatic
suzuki	3541	Cc1cnccc1Br.CC1(C)OB(c2ccccc2CCc2cnccc2Br)OC1(C)C>>Cc1cnccc1c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.Boronate_Aromatic
suzuki	3542	Cc1cnccc1Br.CC1(C)OB(c2ccncc2CCc2cnccc2Br)OC1(C)C>>Cc1cnccc1c1ccncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.Boronate_Heteroaromatic
suzuki	3543	Cc1cnccc1Br.F[B-](F)(F)c1ccccc1CCc1cnccc1Br>>Cc1cnccc1c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.TrifluoroBoronateAromatic
suzuki	3544	Cc1nc2cocc2cc1Br.OB1CCCC(Cc2nc3cocc3cc2Br)O1>>Cc1nc2cocc2cc1CCCC(O)Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.BoronicCyclic
suzuki	3545	Cc1nc2cocc2cc1Br.OB(O)c1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.Boronic_Aromatic
suzuki	3546	Cc1nc2cocc2cc1Br.OB(O)c1ccncc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het5.Boronic_Heteroaromatic
suzuki	3547	Cc1nc2cocc2cc1Br.CC1(C)OB(c2ccccc2CCc2nc3cocc3cc2Br)OC1(C)C>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.Boronate_Aromatic
suzuki	3548	Cc1nc2cocc2cc1Br.CC1(C)OB(c2ccncc2CCc2nc3cocc3cc2Br)OC1(C)C>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.Boronate_Heteroaromatic
suzuki	3549	Cc1nc2cocc2cc1Br.F[B-](F)(F)c1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.TrifluoroBoronateAromatic
suzuki	3550	Cc1c(Br)ncc2ccncc12.OB1CCCC(Cc2c(Br)ncc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.BoronicCyclic
suzuki	3551	Cc1c(Br)ncc2ccncc12.OB(O)c1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(c2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.Boronic_Aromatic
suzuki	3552	Cc1c(Br)ncc2ccncc12.OB(O)c1ccncc1CCc1c(Br)ncc2ccncc12>>Cc1c(c2ccncc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Het6.Boronic_Heteroaromatic
suzuki	3553	Cc1c(Br)ncc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(Br)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.Boronate_Aromatic
suzuki	3554	Cc1c(Br)ncc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(Br)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccncc1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.Boronate_Heteroaromatic
suzuki	3555	Cc1c(Br)ncc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.TrifluoroBoronateAromatic
suzuki	3556	Cc1c(Br)ncc2ccccc12.OB1CCCC(Cc2c(Br)ncc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.BoronicCyclic
suzuki	3557	Cc1c(Br)ncc2ccccc12.OB(O)c1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(c2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.Boronic_Aromatic
suzuki	3558	Cc1c(Br)ncc2ccccc12.OB(O)c1ccncc1CCc1c(Br)ncc2ccccc12>>Cc1c(c2ccncc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_Het6Phe.Boronic_Heteroaromatic
suzuki	3559	Cc1c(Br)ncc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(Br)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.Boronate_Aromatic
suzuki	3560	Cc1c(Br)ncc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(Br)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccncc1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.Boronate_Heteroaromatic
suzuki	3561	Cc1c(Br)ncc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.TrifluoroBoronateAromatic
suzuki	3562	Cc1cc2cocc2cc1Br.OB1CCCC(Cc2cc3cocc3cc2Br)O1>>Cc1cc2cocc2cc1CCCC(O)Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet5.BoronicCyclic
suzuki	3563	Cc1cc2cocc2cc1Br.OB(O)c1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet5.Boronic_Aromatic
suzuki	3564	Cc1cc2cocc2cc1Br.OB(O)c1ccncc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet5.Boronic_Heteroaromatic
suzuki	3565	Cc1cc2cocc2cc1Br.CC1(C)OB(c2ccccc2CCc2cc3cocc3cc2Br)OC1(C)C>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.Boronate_Aromatic
suzuki	3566	Cc1cc2cocc2cc1Br.CC1(C)OB(c2ccncc2CCc2cc3cocc3cc2Br)OC1(C)C>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.Boronate_Heteroaromatic
suzuki	3567	Cc1cc2cocc2cc1Br.F[B-](F)(F)c1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.TrifluoroBoronateAromatic
suzuki	3568	CCc1c(Br)ccc2ccncc12.OB1CCCC(CCc2c(Br)ccc3ccncc23)O1>>CCc1c(CCCC(O)CCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet6.BoronicCyclic
suzuki	3569	CCc1c(Br)ccc2ccncc12.OB(O)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(c2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet6.Boronic_Aromatic
suzuki	3570	CCc1c(Br)ccc2ccncc12.OB(O)c1ccncc1CCCc1c(Br)ccc2ccncc12>>CCc1c(c2ccncc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Bromide_PheHet6.Boronic_Heteroaromatic
suzuki	3571	CCc1c(Br)ccc2ccncc12.CC1(C)OB(c2ccccc2CCCc2c(Br)ccc3ccncc23)OC1(C)C>>CCc1c2cnccc2ccc1c1ccccc1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.Boronate_Aromatic
suzuki	3572	CCc1c(Br)ccc2ccncc12.CC1(C)OB(c2ccncc2CCCc2c(Br)ccc3ccncc23)OC1(C)C>>CCc1c2cnccc2ccc1c1ccncc1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.Boronate_Heteroaromatic
suzuki	3573	CCc1c(Br)ccc2ccncc12.F[B-](F)(F)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.TrifluoroBoronateAromatic
suzuki	3574	Cc1cocc1Cl.OB1CCCC(Cc2cocc2Cl)O1>>Cc1cocc1CCCC(O)Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5.BoronicCyclic
suzuki	3575	Cc1cocc1Cl.OB(O)c1ccccc1CCc1cocc1Cl>>Cc1cocc1c1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5.Boronic_Aromatic
suzuki	3576	Cc1cocc1Cl.OB(O)c1ccncc1CCc1cocc1Cl>>Cc1cocc1c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5.Boronic_Heteroaromatic
suzuki	3577	Cc1cocc1Cl.CC1(C)OB(c2ccccc2CCc2cocc2Cl)OC1(C)C>>Cc1cocc1c1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.Boronate_Aromatic
suzuki	3578	Cc1cocc1Cl.CC1(C)OB(c2ccncc2CCc2cocc2Cl)OC1(C)C>>Cc1cocc1c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.Boronate_Heteroaromatic
suzuki	3579	Cc1cocc1Cl.F[B-](F)(F)c1ccccc1CCc1cocc1Cl>>Cc1cocc1c1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.TrifluoroBoronateAromatic
suzuki	3580	Cc1c(Cl)oc2cocc12.OB1CCCC(Cc2c(Cl)oc3cocc23)O1>>Cc1c(CCCC(O)Cc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het5.BoronicCyclic
suzuki	3581	Cc1c(Cl)oc2cocc12.OB(O)c1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c(c2ccccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het5.Boronic_Aromatic
suzuki	3582	Cc1c(Cl)oc2cocc12.OB(O)c1ccncc1CCc1c(Cl)oc2cocc12>>Cc1c(c2ccncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het5.Boronic_Heteroaromatic
suzuki	3583	Cc1c(Cl)oc2cocc12.CC1(C)OB(c2ccccc2CCc2c(Cl)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccccc1CCc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.Boronate_Aromatic
suzuki	3584	Cc1c(Cl)oc2cocc12.CC1(C)OB(c2ccncc2CCc2c(Cl)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccncc1CCc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.Boronate_Heteroaromatic
suzuki	3585	Cc1c(Cl)oc2cocc12.F[B-](F)(F)c1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1CCc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.TrifluoroBoronateAromatic
suzuki	3586	Cc1c(Cl)oc2ccncc12.OB1CCCC(Cc2c(Cl)oc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het6.BoronicCyclic
suzuki	3587	Cc1c(Cl)oc2ccncc12.OB(O)c1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c(c2ccccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het6.Boronic_Aromatic
suzuki	3588	Cc1c(Cl)oc2ccncc12.OB(O)c1ccncc1CCc1c(Cl)oc2ccncc12>>Cc1c(c2ccncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Het6.Boronic_Heteroaromatic
suzuki	3589	Cc1c(Cl)oc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(Cl)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccccc1CCc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.Boronate_Aromatic
suzuki	3590	Cc1c(Cl)oc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(Cl)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccncc1CCc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.Boronate_Heteroaromatic
suzuki	3591	Cc1c(Cl)oc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1CCc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.TrifluoroBoronateAromatic
suzuki	3592	Cc1c(Cl)oc2ccccc12.OB1CCCC(Cc2c(Cl)oc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Phe.BoronicCyclic
suzuki	3593	Cc1c(Cl)oc2ccccc12.OB(O)c1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c(c2ccccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Phe.Boronic_Aromatic
suzuki	3594	Cc1c(Cl)oc2ccccc12.OB(O)c1ccncc1CCc1c(Cl)oc2ccccc12>>Cc1c(c2ccncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het5Phe.Boronic_Heteroaromatic
suzuki	3595	Cc1c(Cl)oc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(Cl)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccccc1CCc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.Boronate_Aromatic
suzuki	3596	Cc1c(Cl)oc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(Cl)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccncc1CCc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.Boronate_Heteroaromatic
suzuki	3597	Cc1c(Cl)oc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1CCc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.TrifluoroBoronateAromatic
suzuki	3598	Cc1cnccc1Cl.OB1CCCC(Cc2cnccc2Cl)O1>>Cc1cnccc1CCCC(O)Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6.BoronicCyclic
suzuki	3599	Cc1cnccc1Cl.OB(O)c1ccccc1CCc1cnccc1Cl>>Cc1cnccc1c1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6.Boronic_Aromatic
suzuki	3600	Cc1cnccc1Cl.OB(O)c1ccncc1CCc1cnccc1Cl>>Cc1cnccc1c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6.Boronic_Heteroaromatic
suzuki	3601	Cc1cnccc1Cl.CC1(C)OB(c2ccccc2CCc2cnccc2Cl)OC1(C)C>>Cc1cnccc1c1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.Boronate_Aromatic
suzuki	3602	Cc1cnccc1Cl.CC1(C)OB(c2ccncc2CCc2cnccc2Cl)OC1(C)C>>Cc1cnccc1c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.Boronate_Heteroaromatic
suzuki	3603	Cc1cnccc1Cl.F[B-](F)(F)c1ccccc1CCc1cnccc1Cl>>Cc1cnccc1c1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.TrifluoroBoronateAromatic
suzuki	3604	Cc1nc2cocc2cc1Cl.OB1CCCC(Cc2nc3cocc3cc2Cl)O1>>Cc1nc2cocc2cc1CCCC(O)Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het5.BoronicCyclic
suzuki	3605	Cc1nc2cocc2cc1Cl.OB(O)c1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het5.Boronic_Aromatic
suzuki	3606	Cc1nc2cocc2cc1Cl.OB(O)c1ccncc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het5.Boronic_Heteroaromatic
suzuki	3607	Cc1nc2cocc2cc1Cl.CC1(C)OB(c2ccccc2CCc2nc3cocc3cc2Cl)OC1(C)C>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.Boronate_Aromatic
suzuki	3608	Cc1nc2cocc2cc1Cl.CC1(C)OB(c2ccncc2CCc2nc3cocc3cc2Cl)OC1(C)C>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.Boronate_Heteroaromatic
suzuki	3609	Cc1nc2cocc2cc1Cl.F[B-](F)(F)c1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.TrifluoroBoronateAromatic
suzuki	3610	Cc1c(Cl)ncc2ccncc12.OB1CCCC(Cc2c(Cl)ncc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het6.BoronicCyclic
suzuki	3611	Cc1c(Cl)ncc2ccncc12.OB(O)c1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(c2ccccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het6.Boronic_Aromatic
suzuki	3612	Cc1c(Cl)ncc2ccncc12.OB(O)c1ccncc1CCc1c(Cl)ncc2ccncc12>>Cc1c(c2ccncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Het6.Boronic_Heteroaromatic
suzuki	3613	Cc1c(Cl)ncc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(Cl)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.Boronate_Aromatic
suzuki	3614	Cc1c(Cl)ncc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(Cl)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccncc1CCc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.Boronate_Heteroaromatic
suzuki	3615	Cc1c(Cl)ncc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.TrifluoroBoronateAromatic
suzuki	3616	Cc1c(Cl)ncc2ccccc12.OB1CCCC(Cc2c(Cl)ncc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Phe.BoronicCyclic
suzuki	3617	Cc1c(Cl)ncc2ccccc12.OB(O)c1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(c2ccccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Phe.Boronic_Aromatic
suzuki	3618	Cc1c(Cl)ncc2ccccc12.OB(O)c1ccncc1CCc1c(Cl)ncc2ccccc12>>Cc1c(c2ccncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Chloride_Het6Phe.Boronic_Heteroaromatic
suzuki	3619	Cc1c(Cl)ncc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(Cl)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.Boronate_Aromatic
suzuki	3620	Cc1c(Cl)ncc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(Cl)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccncc1CCc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.Boronate_Heteroaromatic
suzuki	3621	Cc1c(Cl)ncc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.TrifluoroBoronateAromatic
suzuki	3622	Cc1cocc1I.OB1CCCC(Cc2cocc2I)O1>>Cc1cocc1CCCC(O)Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5.BoronicCyclic
suzuki	3623	Cc1cocc1I.OB(O)c1ccccc1CCc1cocc1I>>Cc1cocc1c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5.Boronic_Aromatic
suzuki	3624	Cc1cocc1I.OB(O)c1ccncc1CCc1cocc1I>>Cc1cocc1c1ccncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5.Boronic_Heteroaromatic
suzuki	3625	Cc1cocc1I.CC1(C)OB(c2ccccc2CCc2cocc2I)OC1(C)C>>Cc1cocc1c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.Boronate_Aromatic
suzuki	3626	Cc1cocc1I.CC1(C)OB(c2ccncc2CCc2cocc2I)OC1(C)C>>Cc1cocc1c1ccncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.Boronate_Heteroaromatic
suzuki	3627	Cc1cocc1I.F[B-](F)(F)c1ccccc1CCc1cocc1I>>Cc1cocc1c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.TrifluoroBoronateAromatic
suzuki	3628	Cc1c(I)oc2cocc12.OB1CCCC(Cc2c(I)oc3cocc23)O1>>Cc1c(CCCC(O)Cc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het5.BoronicCyclic
suzuki	3629	Cc1c(I)oc2cocc12.OB(O)c1ccccc1CCc1c(I)oc2cocc12>>Cc1c(c2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het5.Boronic_Aromatic
suzuki	3630	Cc1c(I)oc2cocc12.OB(O)c1ccncc1CCc1c(I)oc2cocc12>>Cc1c(c2ccncc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het5.Boronic_Heteroaromatic
suzuki	3631	Cc1c(I)oc2cocc12.CC1(C)OB(c2ccccc2CCc2c(I)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccccc1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.Boronate_Aromatic
suzuki	3632	Cc1c(I)oc2cocc12.CC1(C)OB(c2ccncc2CCc2c(I)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccncc1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.Boronate_Heteroaromatic
suzuki	3633	Cc1c(I)oc2cocc12.F[B-](F)(F)c1ccccc1CCc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.TrifluoroBoronateAromatic
suzuki	3634	Cc1c(I)oc2ccncc12.OB1CCCC(Cc2c(I)oc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het6.BoronicCyclic
suzuki	3635	Cc1c(I)oc2ccncc12.OB(O)c1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(c2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het6.Boronic_Aromatic
suzuki	3636	Cc1c(I)oc2ccncc12.OB(O)c1ccncc1CCc1c(I)oc2ccncc12>>Cc1c(c2ccncc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Het6.Boronic_Heteroaromatic
suzuki	3637	Cc1c(I)oc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(I)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccccc1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.Boronate_Aromatic
suzuki	3638	Cc1c(I)oc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(I)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccncc1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.Boronate_Heteroaromatic
suzuki	3639	Cc1c(I)oc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.TrifluoroBoronateAromatic
suzuki	3640	Cc1c(I)oc2ccccc12.OB1CCCC(Cc2c(I)oc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Phe.BoronicCyclic
suzuki	3641	Cc1c(I)oc2ccccc12.OB(O)c1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(c2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Phe.Boronic_Aromatic
suzuki	3642	Cc1c(I)oc2ccccc12.OB(O)c1ccncc1CCc1c(I)oc2ccccc12>>Cc1c(c2ccncc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het5Phe.Boronic_Heteroaromatic
suzuki	3643	Cc1c(I)oc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(I)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccccc1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.Boronate_Aromatic
suzuki	3644	Cc1c(I)oc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(I)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccncc1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.Boronate_Heteroaromatic
suzuki	3645	Cc1c(I)oc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.TrifluoroBoronateAromatic
suzuki	3646	Cc1cnccc1I.OB1CCCC(Cc2cnccc2I)O1>>Cc1cnccc1CCCC(O)Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6.BoronicCyclic
suzuki	3647	Cc1cnccc1I.OB(O)c1ccccc1CCc1cnccc1I>>Cc1cnccc1c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6.Boronic_Aromatic
suzuki	3648	Cc1cnccc1I.OB(O)c1ccncc1CCc1cnccc1I>>Cc1cnccc1c1ccncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6.Boronic_Heteroaromatic
suzuki	3649	Cc1cnccc1I.CC1(C)OB(c2ccccc2CCc2cnccc2I)OC1(C)C>>Cc1cnccc1c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.Boronate_Aromatic
suzuki	3650	Cc1cnccc1I.CC1(C)OB(c2ccncc2CCc2cnccc2I)OC1(C)C>>Cc1cnccc1c1ccncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.Boronate_Heteroaromatic
suzuki	3651	Cc1cnccc1I.F[B-](F)(F)c1ccccc1CCc1cnccc1I>>Cc1cnccc1c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.TrifluoroBoronateAromatic
suzuki	3652	Cc1nc2cocc2cc1I.OB1CCCC(Cc2nc3cocc3cc2I)O1>>Cc1nc2cocc2cc1CCCC(O)Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het5.BoronicCyclic
suzuki	3653	Cc1nc2cocc2cc1I.OB(O)c1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het5.Boronic_Aromatic
suzuki	3654	Cc1nc2cocc2cc1I.OB(O)c1ccncc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het5.Boronic_Heteroaromatic
suzuki	3655	Cc1nc2cocc2cc1I.CC1(C)OB(c2ccccc2CCc2nc3cocc3cc2I)OC1(C)C>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.Boronate_Aromatic
suzuki	3656	Cc1nc2cocc2cc1I.CC1(C)OB(c2ccncc2CCc2nc3cocc3cc2I)OC1(C)C>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.Boronate_Heteroaromatic
suzuki	3657	Cc1nc2cocc2cc1I.F[B-](F)(F)c1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.TrifluoroBoronateAromatic
suzuki	3658	Cc1c(I)ncc2ccncc12.OB1CCCC(Cc2c(I)ncc3ccncc23)O1>>Cc1c(CCCC(O)Cc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het6.BoronicCyclic
suzuki	3659	Cc1c(I)ncc2ccncc12.OB(O)c1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(c2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het6.Boronic_Aromatic
suzuki	3660	Cc1c(I)ncc2ccncc12.OB(O)c1ccncc1CCc1c(I)ncc2ccncc12>>Cc1c(c2ccncc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Het6.Boronic_Heteroaromatic
suzuki	3661	Cc1c(I)ncc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(I)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.Boronate_Aromatic
suzuki	3662	Cc1c(I)ncc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(I)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccncc1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.Boronate_Heteroaromatic
suzuki	3663	Cc1c(I)ncc2ccncc12.F[B-](F)(F)c1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.TrifluoroBoronateAromatic
suzuki	3664	Cc1c(I)ncc2ccccc12.OB1CCCC(Cc2c(I)ncc3ccccc23)O1>>Cc1c(CCCC(O)Cc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Phe.BoronicCyclic
suzuki	3665	Cc1c(I)ncc2ccccc12.OB(O)c1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(c2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Phe.Boronic_Aromatic
suzuki	3666	Cc1c(I)ncc2ccccc12.OB(O)c1ccncc1CCc1c(I)ncc2ccccc12>>Cc1c(c2ccncc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_Het6Phe.Boronic_Heteroaromatic
suzuki	3667	Cc1c(I)ncc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(I)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.Boronate_Aromatic
suzuki	3668	Cc1c(I)ncc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(I)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccncc1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.Boronate_Heteroaromatic
suzuki	3669	Cc1c(I)ncc2ccccc12.F[B-](F)(F)c1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.TrifluoroBoronateAromatic
suzuki	3670	Cc1cc2cocc2cc1I.OB1CCCC(Cc2cc3cocc3cc2I)O1>>Cc1cc2cocc2cc1CCCC(O)Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet5.BoronicCyclic
suzuki	3671	Cc1cc2cocc2cc1I.OB(O)c1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet5.Boronic_Aromatic
suzuki	3672	Cc1cc2cocc2cc1I.OB(O)c1ccncc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet5.Boronic_Heteroaromatic
suzuki	3673	Cc1cc2cocc2cc1I.CC1(C)OB(c2ccccc2CCc2cc3cocc3cc2I)OC1(C)C>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.Boronate_Aromatic
suzuki	3674	Cc1cc2cocc2cc1I.CC1(C)OB(c2ccncc2CCc2cc3cocc3cc2I)OC1(C)C>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.Boronate_Heteroaromatic
suzuki	3675	Cc1cc2cocc2cc1I.F[B-](F)(F)c1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.TrifluoroBoronateAromatic
suzuki	3676	CCc1c(I)ccc2ccncc12.OB1CCCC(CCc2c(I)ccc3ccncc23)O1>>CCc1c(CCCC(O)CCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet6.BoronicCyclic
suzuki	3677	CCc1c(I)ccc2ccncc12.OB(O)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(c2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet6.Boronic_Aromatic
suzuki	3678	CCc1c(I)ccc2ccncc12.OB(O)c1ccncc1CCCc1c(I)ccc2ccncc12>>CCc1c(c2ccncc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Iodide_PheHet6.Boronic_Heteroaromatic
suzuki	3679	CCc1c(I)ccc2ccncc12.CC1(C)OB(c2ccccc2CCCc2c(I)ccc3ccncc23)OC1(C)C>>CCc1c2cnccc2ccc1c1ccccc1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.Boronate_Aromatic
suzuki	3680	CCc1c(I)ccc2ccncc12.CC1(C)OB(c2ccncc2CCCc2c(I)ccc3ccncc23)OC1(C)C>>CCc1c2cnccc2ccc1c1ccncc1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.Boronate_Heteroaromatic
suzuki	3681	CCc1c(I)ccc2ccncc12.F[B-](F)(F)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.TrifluoroBoronateAromatic
suzuki	3682	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCCB(O)O1)C(F)(F)F>>Cc1cocc1CCCC(O)Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5.BoronicCyclic
suzuki	3683	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1cocc1c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5.Boronic_Aromatic
suzuki	3684	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1cocc1c1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5.Boronic_Heteroaromatic
suzuki	3685	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccccc2CCc2cocc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cocc1c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.Boronate_Aromatic
suzuki	3686	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccncc2CCc2cocc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cocc1c1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.Boronate_Heteroaromatic
suzuki	3687	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1cocc1c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.TrifluoroBoronateAromatic
suzuki	3688	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het5.BoronicCyclic
suzuki	3689	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het5.Boronic_Aromatic
suzuki	3690	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het5.Boronic_Heteroaromatic
suzuki	3691	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.Boronate_Aromatic
suzuki	3692	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)OC1(C)C>>Cc1c2cocc2oc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.Boronate_Heteroaromatic
suzuki	3693	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2cocc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.TrifluoroBoronateAromatic
suzuki	3694	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het6.BoronicCyclic
suzuki	3695	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het6.Boronic_Aromatic
suzuki	3696	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Het6.Boronic_Heteroaromatic
suzuki	3697	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.Boronate_Aromatic
suzuki	3698	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)OC1(C)C>>Cc1c2cnccc2oc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.Boronate_Heteroaromatic
suzuki	3699	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2cnccc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.TrifluoroBoronateAromatic
suzuki	3700	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Phe.BoronicCyclic
suzuki	3701	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Phe.Boronic_Aromatic
suzuki	3702	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het5Phe.Boronic_Heteroaromatic
suzuki	3703	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.Boronate_Aromatic
suzuki	3704	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)OC1(C)C>>Cc1c2ccccc2oc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.Boronate_Heteroaromatic
suzuki	3705	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2ccccc2oc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.TrifluoroBoronateAromatic
suzuki	3706	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCCB(O)O1)C(F)(F)F>>Cc1cnccc1CCCC(O)Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6.BoronicCyclic
suzuki	3707	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1cnccc1c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6.Boronic_Aromatic
suzuki	3708	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1cnccc1c1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6.Boronic_Heteroaromatic
suzuki	3709	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccccc2CCc2cnccc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cnccc1c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.Boronate_Aromatic
suzuki	3710	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccncc2CCc2cnccc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cnccc1c1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.Boronate_Heteroaromatic
suzuki	3711	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1cnccc1c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.TrifluoroBoronateAromatic
suzuki	3712	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCCB(O)O1)C(F)(F)F>>Cc1nc2cocc2cc1CCCC(O)Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het5.BoronicCyclic
suzuki	3713	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het5.Boronic_Aromatic
suzuki	3714	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het5.Boronic_Heteroaromatic
suzuki	3715	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccccc2CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.Boronate_Aromatic
suzuki	3716	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccncc2CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1nc2cocc2cc1c1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.Boronate_Heteroaromatic
suzuki	3717	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1nc2cocc2cc1c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.TrifluoroBoronateAromatic
suzuki	3718	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het6.BoronicCyclic
suzuki	3719	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het6.Boronic_Aromatic
suzuki	3720	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Het6.Boronic_Heteroaromatic
suzuki	3721	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.Boronate_Aromatic
suzuki	3722	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)OC1(C)C>>Cc1c2cnccc2cnc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.Boronate_Heteroaromatic
suzuki	3723	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.TrifluoroBoronateAromatic
suzuki	3724	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Phe.BoronicCyclic
suzuki	3725	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Phe.Boronic_Aromatic
suzuki	3726	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_Het6Phe.Boronic_Heteroaromatic
suzuki	3727	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.Boronate_Aromatic
suzuki	3728	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)OC1(C)C>>Cc1c2ccccc2cnc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.Boronate_Heteroaromatic
suzuki	3729	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.TrifluoroBoronateAromatic
suzuki	3730	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCCB(O)O1)C(F)(F)F>>Cc1cc2cocc2cc1CCCC(O)Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet5.BoronicCyclic
suzuki	3731	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet5.Boronic_Aromatic
suzuki	3732	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet5.Boronic_Heteroaromatic
suzuki	3733	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccccc2CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.Boronate_Aromatic
suzuki	3734	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(C)OB(c2ccncc2CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)OC1(C)C>>Cc1cc2cocc2cc1c1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.Boronate_Heteroaromatic
suzuki	3735	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1cc2cocc2cc1c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.TrifluoroBoronateAromatic
suzuki	3736	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCCB(O)O1)C(F)(F)F>>Cc1c(CCCC(O)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;R;$(B([O;D1])[O;D2]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet6.BoronicCyclic
suzuki	3737	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1B(O)O)C(F)(F)F>>Cc1c(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet6.Boronic_Aromatic
suzuki	3738	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1cnccc1B(O)O)C(F)(F)F>>Cc1c(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$([B;!R]([O;D1])[O;D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][#6:4]>>[a:2][#6:4]	X-Triflate_PheHet6.Boronic_Heteroaromatic
suzuki	3739	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC1(C)OB(c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)OC1(C)C>>Cc1c2cnccc2ccc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[c;$(c1ccccc1)])]);!$(B1OBOBO1):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.Boronate_Aromatic
suzuki	3740	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC1(C)OB(c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)OC1(C)C>>Cc1c2cnccc2ccc1c1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([O;!D1])[O;!D1]);$([$(*[a;$(a1aaaaa1)]),$(*[a;$(a1aaaa1)]);!$(*[c;$(c1ccccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.Boronate_Heteroaromatic
suzuki	3741	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1[B-](F)(F)F)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[B;$(B([a])(F)(F)F):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.TrifluoroBoronateAromatic
amine_acetylation	3742	CCCC(=O)Br.NCCNCCCCCCC(=O)Br>>CCCC(=O)N(CCN)CCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3743	CCCC(=O)Br.NC=CNCCCCCCC(=O)Br>>CCCC(=O)N(C=CN)CCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3744	CCCC(=O)Br.NC=CNC=CCCCCC(=O)Br>>CCCC(=O)N(C=CN)C=CCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3745	CCCC(=O)Br.NC1CNCC(CCCCC(=O)Br)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3746	CCCC(=O)Br.O=C(Br)CCCCC1CC=CNC1>>CCCC(=O)N1C=CCC(CCCCC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3747	CCCC(=O)Br.O=C(Br)CCCCC1C=CNC=CC1>>CCCC(=O)N1C=CCC(CCCCC(=O)Br)C=C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3748	CCCC(=O)Br.NCCNCCCCCC(=O)Br>>CCCC(=O)NCCNCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3749	CCCC(=O)Br.NC=CNCCCCCC(=O)Br>>CCCC(=O)NC=CNCCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3750	CCCC(=O)Br.Nc1cccc(CCCCC(=O)Br)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3751	CCCC(=O)Br.NCCNc1ccccc1CCCCCC(=O)Br>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3752	CCCC(=O)Br.NC=CNc1ccccc1CCCCC(=O)Br>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3753	CCCC(=O)Br.O=C(Br)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3754	CCCC(=O)Br.O=C(Br)CCCc1ccc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ccc(CCCC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3755	CCCC(=O)Br.O=C(Br)CCCc1ccc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3756	CCCC(=O)Br.Nc1cccc(CCCCC(=O)Br)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3757	CCCC(=O)Br.Nc1cc2ccc(CCCCC(=O)Br)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)Br)cc2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3758	CCCC(=O)Br.Nc1cncc(CCCCC(=O)Br)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3759	CCCC(=O)Br.Nc1cncc(CCCCC(=O)Br)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3760	CCCC(=O)Br.NCCNc1ccncc1CCCCC(=O)Br>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3761	CCCC(=O)Br.NC=CNc1ccncc1CCCCC(=O)Br>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3762	CCCC(=O)Br.O=C(Br)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3763	CCCC(=O)Br.O=C(Br)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)Br)Cc2ccncc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3764	CCCC(=O)Br.O=C(Br)CCCc1cnc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ncc(CCCC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3765	CCCC(=O)Br.O=C(Br)CCCc1cnc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3766	CCCC(=O)Br.Nc1occ(CCCCC(=O)Br)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3767	CCCC(=O)Br.Nc1oc2c(CCCCC(=O)Br)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)Br)occ2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3768	CCCC(=O)Br.Nc1oc2cc(CCCCC(=O)Br)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3769	CCCC(=O)Br.Nc1oc2ccc(CCCCC(=O)Br)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3770	CCCC(=O)Br.Nc1nccc(CCCCC(=O)Br)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3771	CCCC(=O)Br.Nc1c(CCCC(=O)Br)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)Br)nc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3772	CCCC(=O)Br.Nc1ncc2cc(CCCCC(=O)Br)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3773	CCCC(=O)Br.Nc1ncc2ccc(CCCCC(=O)Br)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3774	CCCC(=O)Br.Nc1c(CCCC(=O)Br)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)Br)cc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3775	CCCC(=O)Br.Nc1cc2cncc(CCCCC(=O)Br)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)Br)c2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3776	CCCC(=O)Br.NCc1ccccc1CCCCCC(=O)Br>>CCCC(=O)NCc1ccccc1CCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.Benzylamine_primary
amine_acetylation	3777	CCCC(=O)Br.NCc1cnccc1CCCCCC(=O)Br>>CCCC(=O)NCc1cnccc1CCCCCC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_SaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3778	CCC=CC(=O)Br.NCCNCCCCCC=CC(=O)Br>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3779	CCC=CC(=O)Br.NC=CNCCCCCC=CC(=O)Br>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3780	CCC=CC(=O)Br.NC=CNC=CCCCC=CC(=O)Br>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3781	CCC=CC(=O)Br.NC1CNCC(CCCC=CC(=O)Br)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3782	CCC=CC(=O)Br.O=C(Br)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3783	CCC=CC(=O)Br.O=C(Br)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)Br)C=C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3784	CCC=CC(=O)Br.NCCNCCCCC=CC(=O)Br>>CCC=CC(=O)NCCNCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3785	CCC=CC(=O)Br.NC=CNCCCCC=CC(=O)Br>>CCC=CC(=O)NC=CNCCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3786	CCC=CC(=O)Br.Nc1cccc(CCCC=CC(=O)Br)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3787	CCC=CC(=O)Br.NCCNc1ccccc1CCCCC=CC(=O)Br>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3788	CCC=CC(=O)Br.NC=CNc1ccccc1CCCC=CC(=O)Br>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3789	CCC=CC(=O)Br.O=C(Br)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3790	CCC=CC(=O)Br.O=C(Br)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3791	CCC=CC(=O)Br.O=C(Br)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3792	CCC=CC(=O)Br.Nc1cccc(CCCC=CC(=O)Br)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3793	CCC=CC(=O)Br.Nc1cc2ccc(CCCC=CC(=O)Br)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)Br)cc2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3794	CCC=CC(=O)Br.Nc1cncc(CCCC=CC(=O)Br)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3795	CCC=CC(=O)Br.Nc1cncc(CCCC=CC(=O)Br)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3796	CCC=CC(=O)Br.NCCNc1ccncc1CCCC=CC(=O)Br>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3797	CCC=CC(=O)Br.NC=CNc1ccncc1CCCC=CC(=O)Br>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3798	CCC=CC(=O)Br.O=C(Br)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3799	CCC=CC(=O)Br.O=C(Br)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)Br)Cc2ccncc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3800	CCC=CC(=O)Br.O=C(Br)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3801	CCC=CC(=O)Br.O=C(Br)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3802	CCC=CC(=O)Br.Nc1occ(CCCC=CC(=O)Br)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3803	CCC=CC(=O)Br.Nc1oc2c(CCCC=CC(=O)Br)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)Br)occ2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3804	CCC=CC(=O)Br.Nc1oc2cc(CCCC=CC(=O)Br)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3805	CCC=CC(=O)Br.Nc1oc2ccc(CCCC=CC(=O)Br)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3806	CCC=CC(=O)Br.Nc1nccc(CCCC=CC(=O)Br)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3807	CCC=CC(=O)Br.Nc1c(CCC=CC(=O)Br)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)Br)nc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3808	CCC=CC(=O)Br.Nc1ncc2cc(CCCC=CC(=O)Br)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3809	CCC=CC(=O)Br.Nc1ncc2ccc(CCCC=CC(=O)Br)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3810	CCC=CC(=O)Br.Nc1c(CCC=CC(=O)Br)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)Br)cc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3811	CCC=CC(=O)Br.Nc1cc2cncc(CCCC=CC(=O)Br)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)Br)c2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3812	CCC=CC(=O)Br.NCc1ccccc1CCCCC=CC(=O)Br>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.Benzylamine_primary
amine_acetylation	3813	CCC=CC(=O)Br.NCc1cnccc1CCCCC=CC(=O)Br>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_UnsaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3814	CCCC(=O)Cl.NCCNCCCCCCC(=O)Cl>>CCCC(=O)N(CCN)CCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3815	CCCC(=O)Cl.NC=CNCCCCCCC(=O)Cl>>CCCC(=O)N(C=CN)CCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3816	CCCC(=O)Cl.NC=CNC=CCCCCC(=O)Cl>>CCCC(=O)N(C=CN)C=CCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3817	CCCC(=O)Cl.NC1CNCC(CCCCC(=O)Cl)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3818	CCCC(=O)Cl.O=C(Cl)CCCCC1CC=CNC1>>CCCC(=O)N1C=CCC(CCCCC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3819	CCCC(=O)Cl.O=C(Cl)CCCCC1C=CNC=CC1>>CCCC(=O)N1C=CCC(CCCCC(=O)Cl)C=C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3820	CCCC(=O)Cl.NCCNCCCCCC(=O)Cl>>CCCC(=O)NCCNCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3821	CCCC(=O)Cl.NC=CNCCCCCC(=O)Cl>>CCCC(=O)NC=CNCCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3822	CCCC(=O)Cl.Nc1cccc(CCCCC(=O)Cl)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3823	CCCC(=O)Cl.NCCNc1ccccc1CCCCCC(=O)Cl>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3824	CCCC(=O)Cl.NC=CNc1ccccc1CCCCC(=O)Cl>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3825	CCCC(=O)Cl.O=C(Cl)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3826	CCCC(=O)Cl.O=C(Cl)CCCc1ccc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ccc(CCCC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3827	CCCC(=O)Cl.O=C(Cl)CCCc1ccc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3828	CCCC(=O)Cl.Nc1cccc(CCCCC(=O)Cl)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3829	CCCC(=O)Cl.Nc1cc2ccc(CCCCC(=O)Cl)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)Cl)cc2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3830	CCCC(=O)Cl.Nc1cncc(CCCCC(=O)Cl)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3831	CCCC(=O)Cl.Nc1cncc(CCCCC(=O)Cl)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3832	CCCC(=O)Cl.NCCNc1ccncc1CCCCC(=O)Cl>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3833	CCCC(=O)Cl.NC=CNc1ccncc1CCCCC(=O)Cl>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3834	CCCC(=O)Cl.O=C(Cl)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3835	CCCC(=O)Cl.O=C(Cl)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)Cl)Cc2ccncc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3836	CCCC(=O)Cl.O=C(Cl)CCCc1cnc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ncc(CCCC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3837	CCCC(=O)Cl.O=C(Cl)CCCc1cnc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3838	CCCC(=O)Cl.Nc1occ(CCCCC(=O)Cl)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3839	CCCC(=O)Cl.Nc1oc2c(CCCCC(=O)Cl)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)Cl)occ2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3840	CCCC(=O)Cl.Nc1oc2cc(CCCCC(=O)Cl)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3841	CCCC(=O)Cl.Nc1oc2ccc(CCCCC(=O)Cl)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3842	CCCC(=O)Cl.Nc1nccc(CCCCC(=O)Cl)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3843	CCCC(=O)Cl.Nc1c(CCCC(=O)Cl)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3844	CCCC(=O)Cl.Nc1ncc2cc(CCCCC(=O)Cl)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3845	CCCC(=O)Cl.Nc1ncc2ccc(CCCCC(=O)Cl)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3846	CCCC(=O)Cl.Nc1c(CCCC(=O)Cl)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3847	CCCC(=O)Cl.Nc1cc2cncc(CCCCC(=O)Cl)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)Cl)c2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3848	CCCC(=O)Cl.NCc1ccccc1CCCCCC(=O)Cl>>CCCC(=O)NCc1ccccc1CCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.Benzylamine_primary
amine_acetylation	3849	CCCC(=O)Cl.NCc1cnccc1CCCCCC(=O)Cl>>CCCC(=O)NCc1cnccc1CCCCCC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_SaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3850	CCC=CC(=O)Cl.NCCNCCCCCC=CC(=O)Cl>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3851	CCC=CC(=O)Cl.NC=CNCCCCCC=CC(=O)Cl>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3852	CCC=CC(=O)Cl.NC=CNC=CCCCC=CC(=O)Cl>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3853	CCC=CC(=O)Cl.NC1CNCC(CCCC=CC(=O)Cl)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3854	CCC=CC(=O)Cl.O=C(Cl)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3855	CCC=CC(=O)Cl.O=C(Cl)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)Cl)C=C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3856	CCC=CC(=O)Cl.NCCNCCCCC=CC(=O)Cl>>CCC=CC(=O)NCCNCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3857	CCC=CC(=O)Cl.NC=CNCCCCC=CC(=O)Cl>>CCC=CC(=O)NC=CNCCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3858	CCC=CC(=O)Cl.Nc1cccc(CCCC=CC(=O)Cl)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3859	CCC=CC(=O)Cl.NCCNc1ccccc1CCCCC=CC(=O)Cl>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3860	CCC=CC(=O)Cl.NC=CNc1ccccc1CCCC=CC(=O)Cl>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3861	CCC=CC(=O)Cl.O=C(Cl)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3862	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3863	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3864	CCC=CC(=O)Cl.Nc1cccc(CCCC=CC(=O)Cl)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3865	CCC=CC(=O)Cl.Nc1cc2ccc(CCCC=CC(=O)Cl)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)Cl)cc2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3866	CCC=CC(=O)Cl.Nc1cncc(CCCC=CC(=O)Cl)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3867	CCC=CC(=O)Cl.Nc1cncc(CCCC=CC(=O)Cl)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3868	CCC=CC(=O)Cl.NCCNc1ccncc1CCCC=CC(=O)Cl>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3869	CCC=CC(=O)Cl.NC=CNc1ccncc1CCCC=CC(=O)Cl>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3870	CCC=CC(=O)Cl.O=C(Cl)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3871	CCC=CC(=O)Cl.O=C(Cl)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)Cl)Cc2ccncc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3872	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3873	CCC=CC(=O)Cl.O=C(Cl)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3874	CCC=CC(=O)Cl.Nc1occ(CCCC=CC(=O)Cl)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3875	CCC=CC(=O)Cl.Nc1oc2c(CCCC=CC(=O)Cl)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)Cl)occ2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3876	CCC=CC(=O)Cl.Nc1oc2cc(CCCC=CC(=O)Cl)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3877	CCC=CC(=O)Cl.Nc1oc2ccc(CCCC=CC(=O)Cl)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3878	CCC=CC(=O)Cl.Nc1nccc(CCCC=CC(=O)Cl)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3879	CCC=CC(=O)Cl.Nc1c(CCC=CC(=O)Cl)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3880	CCC=CC(=O)Cl.Nc1ncc2cc(CCCC=CC(=O)Cl)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3881	CCC=CC(=O)Cl.Nc1ncc2ccc(CCCC=CC(=O)Cl)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3882	CCC=CC(=O)Cl.Nc1c(CCC=CC(=O)Cl)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3883	CCC=CC(=O)Cl.Nc1cc2cncc(CCCC=CC(=O)Cl)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)Cl)c2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3884	CCC=CC(=O)Cl.NCc1ccccc1CCCCC=CC(=O)Cl>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.Benzylamine_primary
amine_acetylation	3885	CCC=CC(=O)Cl.NCc1cnccc1CCCCC=CC(=O)Cl>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_UnsaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3886	CCCC(=O)F.NCCNCCCCCCC(=O)F>>CCCC(=O)N(CCN)CCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3887	CCCC(=O)F.NC=CNCCCCCCC(=O)F>>CCCC(=O)N(C=CN)CCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3888	CCCC(=O)F.NC=CNC=CCCCCC(=O)F>>CCCC(=O)N(C=CN)C=CCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3889	CCCC(=O)F.NC1CNCC(CCCCC(=O)F)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3890	CCCC(=O)F.O=C(F)CCCCC1CC=CNC1>>CCCC(=O)N1C=CCC(CCCCC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3891	CCCC(=O)F.O=C(F)CCCCC1C=CNC=CC1>>CCCC(=O)N1C=CCC(CCCCC(=O)F)C=C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3892	CCCC(=O)F.NCCNCCCCCC(=O)F>>CCCC(=O)NCCNCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3893	CCCC(=O)F.NC=CNCCCCCC(=O)F>>CCCC(=O)NC=CNCCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3894	CCCC(=O)F.Nc1cccc(CCCCC(=O)F)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3895	CCCC(=O)F.NCCNc1ccccc1CCCCCC(=O)F>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3896	CCCC(=O)F.NC=CNc1ccccc1CCCCC(=O)F>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3897	CCCC(=O)F.O=C(F)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3898	CCCC(=O)F.O=C(F)CCCc1ccc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ccc(CCCC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3899	CCCC(=O)F.O=C(F)CCCc1ccc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3900	CCCC(=O)F.Nc1cccc(CCCCC(=O)F)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3901	CCCC(=O)F.Nc1cc2ccc(CCCCC(=O)F)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)F)cc2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3902	CCCC(=O)F.Nc1cncc(CCCCC(=O)F)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3903	CCCC(=O)F.Nc1cncc(CCCCC(=O)F)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3904	CCCC(=O)F.NCCNc1ccncc1CCCCC(=O)F>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3905	CCCC(=O)F.NC=CNc1ccncc1CCCCC(=O)F>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3906	CCCC(=O)F.O=C(F)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3907	CCCC(=O)F.O=C(F)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)F)Cc2ccncc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3908	CCCC(=O)F.O=C(F)CCCc1cnc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ncc(CCCC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3909	CCCC(=O)F.O=C(F)CCCc1cnc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3910	CCCC(=O)F.Nc1occ(CCCCC(=O)F)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3911	CCCC(=O)F.Nc1oc2c(CCCCC(=O)F)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)F)occ2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3912	CCCC(=O)F.Nc1oc2cc(CCCCC(=O)F)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3913	CCCC(=O)F.Nc1oc2ccc(CCCCC(=O)F)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3914	CCCC(=O)F.Nc1nccc(CCCCC(=O)F)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3915	CCCC(=O)F.Nc1c(CCCC(=O)F)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)F)nc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3916	CCCC(=O)F.Nc1ncc2cc(CCCCC(=O)F)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3917	CCCC(=O)F.Nc1ncc2ccc(CCCCC(=O)F)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3918	CCCC(=O)F.Nc1c(CCCC(=O)F)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)F)cc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3919	CCCC(=O)F.Nc1cc2cncc(CCCCC(=O)F)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)F)c2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3920	CCCC(=O)F.NCc1ccccc1CCCCCC(=O)F>>CCCC(=O)NCc1ccccc1CCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.Benzylamine_primary
amine_acetylation	3921	CCCC(=O)F.NCc1cnccc1CCCCCC(=O)F>>CCCC(=O)NCc1cnccc1CCCCCC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_SaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3922	CCC=CC(=O)F.NCCNCCCCCC=CC(=O)F>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3923	CCC=CC(=O)F.NC=CNCCCCCC=CC(=O)F>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3924	CCC=CC(=O)F.NC=CNC=CCCCC=CC(=O)F>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3925	CCC=CC(=O)F.NC1CNCC(CCCC=CC(=O)F)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3926	CCC=CC(=O)F.O=C(F)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3927	CCC=CC(=O)F.O=C(F)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)F)C=C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3928	CCC=CC(=O)F.NCCNCCCCC=CC(=O)F>>CCC=CC(=O)NCCNCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3929	CCC=CC(=O)F.NC=CNCCCCC=CC(=O)F>>CCC=CC(=O)NC=CNCCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3930	CCC=CC(=O)F.Nc1cccc(CCCC=CC(=O)F)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3931	CCC=CC(=O)F.NCCNc1ccccc1CCCCC=CC(=O)F>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3932	CCC=CC(=O)F.NC=CNc1ccccc1CCCC=CC(=O)F>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3933	CCC=CC(=O)F.O=C(F)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3934	CCC=CC(=O)F.O=C(F)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3935	CCC=CC(=O)F.O=C(F)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3936	CCC=CC(=O)F.Nc1cccc(CCCC=CC(=O)F)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3937	CCC=CC(=O)F.Nc1cc2ccc(CCCC=CC(=O)F)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)F)cc2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3938	CCC=CC(=O)F.Nc1cncc(CCCC=CC(=O)F)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3939	CCC=CC(=O)F.Nc1cncc(CCCC=CC(=O)F)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3940	CCC=CC(=O)F.NCCNc1ccncc1CCCC=CC(=O)F>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3941	CCC=CC(=O)F.NC=CNc1ccncc1CCCC=CC(=O)F>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3942	CCC=CC(=O)F.O=C(F)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3943	CCC=CC(=O)F.O=C(F)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)F)Cc2ccncc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3944	CCC=CC(=O)F.O=C(F)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3945	CCC=CC(=O)F.O=C(F)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3946	CCC=CC(=O)F.Nc1occ(CCCC=CC(=O)F)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3947	CCC=CC(=O)F.Nc1oc2c(CCCC=CC(=O)F)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)F)occ2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3948	CCC=CC(=O)F.Nc1oc2cc(CCCC=CC(=O)F)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3949	CCC=CC(=O)F.Nc1oc2ccc(CCCC=CC(=O)F)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3950	CCC=CC(=O)F.Nc1nccc(CCCC=CC(=O)F)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3951	CCC=CC(=O)F.Nc1c(CCC=CC(=O)F)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)F)nc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3952	CCC=CC(=O)F.Nc1ncc2cc(CCCC=CC(=O)F)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3953	CCC=CC(=O)F.Nc1ncc2ccc(CCCC=CC(=O)F)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3954	CCC=CC(=O)F.Nc1c(CCC=CC(=O)F)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)F)cc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3955	CCC=CC(=O)F.Nc1cc2cncc(CCCC=CC(=O)F)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)F)c2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3956	CCC=CC(=O)F.NCc1ccccc1CCCCC=CC(=O)F>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.Benzylamine_primary
amine_acetylation	3957	CCC=CC(=O)F.NCc1cnccc1CCCCC=CC(=O)F>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_UnsaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3958	CCCC(=O)I.NCCNCCCCCCC(=O)I>>CCCC(=O)N(CCN)CCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3959	CCCC(=O)I.NC=CNCCCCCCC(=O)I>>CCCC(=O)N(C=CN)CCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3960	CCCC(=O)I.NC=CNC=CCCCCC(=O)I>>CCCC(=O)N(C=CN)C=CCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3961	CCCC(=O)I.NC1CNCC(CCCCC(=O)I)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3962	CCCC(=O)I.O=C(I)CCCCC1CC=CNC1>>CCCC(=O)N1C=CCC(CCCCC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3963	CCCC(=O)I.O=C(I)CCCCC1C=CNC=CC1>>CCCC(=O)N1C=CCC(CCCCC(=O)I)C=C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3964	CCCC(=O)I.NCCNCCCCCC(=O)I>>CCCC(=O)NCCNCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	3965	CCCC(=O)I.NC=CNCCCCCC(=O)I>>CCCC(=O)NC=CNCCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	3966	CCCC(=O)I.Nc1cccc(CCCCC(=O)I)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	3967	CCCC(=O)I.NCCNc1ccccc1CCCCCC(=O)I>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3968	CCCC(=O)I.NC=CNc1ccccc1CCCCC(=O)I>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3969	CCCC(=O)I.O=C(I)CCCC1CCc2ccccc2Nc2ccccc2C1>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	3970	CCCC(=O)I.O=C(I)CCCc1ccc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ccc(CCCC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	3971	CCCC(=O)I.O=C(I)CCCc1ccc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	3972	CCCC(=O)I.Nc1cccc(CCCCC(=O)I)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	3973	CCCC(=O)I.Nc1cc2ccc(CCCCC(=O)I)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)I)cc2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	3974	CCCC(=O)I.Nc1cncc(CCCCC(=O)I)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3975	CCCC(=O)I.Nc1cncc(CCCCC(=O)I)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3976	CCCC(=O)I.NCCNc1ccncc1CCCCC(=O)I>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3977	CCCC(=O)I.NC=CNc1ccncc1CCCCC(=O)I>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3978	CCCC(=O)I.O=C(I)CCCC1CCc2ccncc2Nc2ccccc2C1>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	3979	CCCC(=O)I.O=C(I)CCCC1CCc2cnccc2Nc2cnccc2C1>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)I)Cc2ccncc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	3980	CCCC(=O)I.O=C(I)CCCc1cnc2c(c1)NCCC2>>CCCC(=O)N1CCCc2ncc(CCCC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	3981	CCCC(=O)I.O=C(I)CCCc1cnc2c(c1)NC=CC2>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	3982	CCCC(=O)I.Nc1occ(CCCCC(=O)I)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	3983	CCCC(=O)I.Nc1oc2c(CCCCC(=O)I)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)I)occ2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	3984	CCCC(=O)I.Nc1oc2cc(CCCCC(=O)I)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	3985	CCCC(=O)I.Nc1oc2ccc(CCCCC(=O)I)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	3986	CCCC(=O)I.Nc1nccc(CCCCC(=O)I)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	3987	CCCC(=O)I.Nc1c(CCCC(=O)I)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)I)nc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	3988	CCCC(=O)I.Nc1ncc2cc(CCCCC(=O)I)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	3989	CCCC(=O)I.Nc1ncc2ccc(CCCCC(=O)I)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	3990	CCCC(=O)I.Nc1c(CCCC(=O)I)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)I)cc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	3991	CCCC(=O)I.Nc1cc2cncc(CCCCC(=O)I)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)I)c2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	3992	CCCC(=O)I.NCc1ccccc1CCCCCC(=O)I>>CCCC(=O)NCc1ccccc1CCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.Benzylamine_primary
amine_acetylation	3993	CCCC(=O)I.NCc1cnccc1CCCCCC(=O)I>>CCCC(=O)NCc1cnccc1CCCCCC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_SaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	3994	CCC=CC(=O)I.NCCNCCCCCC=CC(=O)I>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3995	CCC=CC(=O)I.NC=CNCCCCCC=CC(=O)I>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3996	CCC=CC(=O)I.NC=CNC=CCCCC=CC(=O)I>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3997	CCC=CC(=O)I.NC1CNCC(CCCC=CC(=O)I)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	3998	CCC=CC(=O)I.O=C(I)C=CCCCC1CC=CNC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	3999	CCC=CC(=O)I.O=C(I)C=CCCCC1C=CNC=CC1>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)I)C=C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4000	CCC=CC(=O)I.NCCNCCCCC=CC(=O)I>>CCC=CC(=O)NCCNCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4001	CCC=CC(=O)I.NC=CNCCCCC=CC(=O)I>>CCC=CC(=O)NC=CNCCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4002	CCC=CC(=O)I.Nc1cccc(CCCC=CC(=O)I)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4003	CCC=CC(=O)I.NCCNc1ccccc1CCCCC=CC(=O)I>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4004	CCC=CC(=O)I.NC=CNc1ccccc1CCCC=CC(=O)I>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4005	CCC=CC(=O)I.O=C(I)C=CCCC1CCc2ccccc2Nc2ccccc2C1>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4006	CCC=CC(=O)I.O=C(I)C=CCCc1ccc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4007	CCC=CC(=O)I.O=C(I)C=CCCc1ccc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4008	CCC=CC(=O)I.Nc1cccc(CCCC=CC(=O)I)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	4009	CCC=CC(=O)I.Nc1cc2ccc(CCCC=CC(=O)I)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)I)cc2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	4010	CCC=CC(=O)I.Nc1cncc(CCCC=CC(=O)I)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4011	CCC=CC(=O)I.Nc1cncc(CCCC=CC(=O)I)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4012	CCC=CC(=O)I.NCCNc1ccncc1CCCC=CC(=O)I>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4013	CCC=CC(=O)I.NC=CNc1ccncc1CCCC=CC(=O)I>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4014	CCC=CC(=O)I.O=C(I)C=CCCC1CCc2ccncc2Nc2ccccc2C1>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4015	CCC=CC(=O)I.O=C(I)C=CCCC1CCc2cnccc2Nc2cnccc2C1>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)I)Cc2ccncc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4016	CCC=CC(=O)I.O=C(I)C=CCCc1cnc2c(c1)NCCC2>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4017	CCC=CC(=O)I.O=C(I)C=CCCc1cnc2c(c1)NC=CC2>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4018	CCC=CC(=O)I.Nc1occ(CCCC=CC(=O)I)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	4019	CCC=CC(=O)I.Nc1oc2c(CCCC=CC(=O)I)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)I)occ2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	4020	CCC=CC(=O)I.Nc1oc2cc(CCCC=CC(=O)I)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	4021	CCC=CC(=O)I.Nc1oc2ccc(CCCC=CC(=O)I)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	4022	CCC=CC(=O)I.Nc1nccc(CCCC=CC(=O)I)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	4023	CCC=CC(=O)I.Nc1c(CCC=CC(=O)I)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)I)nc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	4024	CCC=CC(=O)I.Nc1ncc2cc(CCCC=CC(=O)I)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	4025	CCC=CC(=O)I.Nc1ncc2ccc(CCCC=CC(=O)I)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	4026	CCC=CC(=O)I.Nc1c(CCC=CC(=O)I)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)I)cc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	4027	CCC=CC(=O)I.Nc1cc2cncc(CCCC=CC(=O)I)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)I)c2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	4028	CCC=CC(=O)I.NCc1ccccc1CCCCC=CC(=O)I>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.Benzylamine_primary
amine_acetylation	4029	CCC=CC(=O)I.NCc1cnccc1CCCCC=CC(=O)I>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_UnsaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	4030	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(CCN)CCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4031	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(C=CN)CCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4032	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(C=CN)C=CCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4033	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCCCC(=O)OS(=O)(=O)C(F)(F)F)C1>>CCCC(=O)N1CC(N)CC(CCCCC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4034	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCC1CC=CNC1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1C=CCC(CCCCC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4035	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCCC1C=CNC=CC1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1C=CCC(CCCCC(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4036	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)NCCNCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4037	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)NC=CNCCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4038	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4039	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(CCN)c1ccccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4040	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(C=CN)c1ccccc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4041	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCC1CCc2ccccc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1c2ccccc2CCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4042	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1ccc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1CCCc2ccc(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4043	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1ccc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1C=CCc2ccc(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4044	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCC(=O)Nc1cccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	4045	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>CCCC(=O)Nc1cc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	4046	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCCC(=O)N(c1ccccc1)c1c(N)cncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4047	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>CCCC(=O)N(c1cccnc1)c1c(N)cncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4048	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(CCN)c1ccncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4049	CCCC(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N(C=CN)c1ccncc1CCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4050	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCC1CCc2ccncc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1c2cnccc2CCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4051	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCC1CCc2cnccc2Nc2cnccc2C1)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1c2ccncc2CCC(CCCC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4052	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1cnc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1CCCc2ncc(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4053	CCCC(=O)OS(=O)(=O)C(F)(F)F.O=C(CCCc1cnc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCCC(=O)N1C=CCc2ncc(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_SaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4054	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCC(=O)Nc1occ(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	4055	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCCCC(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>CCCC(=O)Nc1oc2c(CCCCC(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	4056	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCCC(=O)Nc1oc2cc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	4057	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCCC(=O)Nc1oc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	4058	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCCC(=O)Nc1nccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	4059	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCCC(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	4060	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCCC(=O)Nc1ncc2cc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	4061	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCCC(=O)Nc1ncc2ccc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	4062	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>CCCC(=O)Nc1c(CCCC(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	4063	CCCC(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>CCCC(=O)Nc1cc2cncc(CCCCC(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	4064	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)NCc1ccccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.Benzylamine_primary
amine_acetylation	4065	CCCC(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F>>CCCC(=O)NCc1cnccc1CCCCCC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([!$(**C=C);!$(**C#C);!$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_SaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	4066	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(CCN)CCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4067	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(C=CN)CCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4068	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(C=CN)C=CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4069	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)C1>>CCC=CC(=O)N1CC(N)CC(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4070	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCC1CC=CNC1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4071	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCCC1C=CNC=CC1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1C=CCC(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4072	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)NCCNCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4073	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)NC=CNCCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4074	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4075	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(CCN)c1ccccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4076	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(C=CN)c1ccccc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4077	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCC1CCc2ccccc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1c2ccccc2CCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4078	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1ccc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1CCCc2ccc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4079	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1ccc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1C=CCc2ccc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4080	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCC=CC(=O)Nc1cccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Phe
amine_acetylation	4081	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>CCC=CC(=O)Nc1cc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_PhePhe
amine_acetylation	4082	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>CCC=CC(=O)N(c1ccccc1)c1c(N)cncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4083	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>CCC=CC(=O)N(c1cccnc1)c1c(N)cncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4084	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(CCN)c1ccncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4085	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N(C=CN)c1ccncc1CCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4086	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCC1CCc2ccncc2Nc2ccccc2C1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1c2cnccc2CCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4087	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCC1CCc2cnccc2Nc2cnccc2C1)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1c2ccncc2CCC(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4088	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1cnc2c(c1)NCCC2)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1CCCc2ncc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4089	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.O=C(C=CCCc1cnc2c(c1)NC=CC2)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)N1C=CCc2ncc(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_UnsaturatedAliphatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4090	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCC=CC(=O)Nc1occ(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het5
amine_acetylation	4091	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>CCC=CC(=O)Nc1oc2c(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het5Het5
amine_acetylation	4092	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCC=CC(=O)Nc1oc2cc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het5Het6
amine_acetylation	4093	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCC=CC(=O)Nc1oc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het5Phe
amine_acetylation	4094	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N>>CCC=CC(=O)Nc1nccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het6
amine_acetylation	4095	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het6Het5
amine_acetylation	4096	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>CCC=CC(=O)Nc1ncc2cc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het6Het6
amine_acetylation	4097	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>CCC=CC(=O)Nc1ncc2ccc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_Het6Phe
amine_acetylation	4098	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1c(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>CCC=CC(=O)Nc1c(CCC=CC(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_PheHet5
amine_acetylation	4099	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>CCC=CC(=O)Nc1cc2cncc(CCCC=CC(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Amine_Primary_PheHet6
amine_acetylation	4100	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)NCc1ccccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.Benzylamine_primary
amine_acetylation	4101	CCC=CC(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F>>CCC=CC(=O)NCc1cnccc1CCCCC=CC(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**C=C),$(**C#C),$(**C#N);!$(**a)]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_UnsaturatedAliphatic.HeteroBenzylamine_primary
amine_acetylation	4102	Cc1ccccc1C(=O)Br.NCCNCCCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4103	Cc1ccccc1C(=O)Br.NC=CNCCCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4104	Cc1ccccc1C(=O)Br.NC=CNC=CCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4105	Cc1ccccc1C(=O)Br.NC1CNCC(CCc2ccccc2C(=O)Br)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4106	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4107	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)Br)C=C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4108	Cc1ccccc1C(=O)Br.NCCNCCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4109	Cc1ccccc1C(=O)Br.NC=CNCCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4110	Cc1ccccc1C(=O)Br.Nc1cccc(CCc2ccccc2C(=O)Br)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4111	Cc1ccccc1C(=O)Br.NCCNc1ccccc1CCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4112	Cc1ccccc1C(=O)Br.NC=CNc1ccccc1CCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4113	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4114	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4115	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4116	Cc1ccccc1C(=O)Br.Nc1cccc(CCc2ccccc2C(=O)Br)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Phe
amine_acetylation	4117	Cc1ccccc1C(=O)Br.Nc1cc2ccc(CCc3ccccc3C(=O)Br)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)Br)cc2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_PhePhe
amine_acetylation	4118	Cc1ccccc1C(=O)Br.Nc1cncc(CCc2ccccc2C(=O)Br)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4119	Cc1ccccc1C(=O)Br.Nc1cncc(CCc2ccccc2C(=O)Br)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4120	Cc1ccccc1C(=O)Br.NCCNc1ccncc1CCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4121	Cc1ccccc1C(=O)Br.NC=CNc1ccncc1CCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4122	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4123	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)Br)Cc2ccncc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4124	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4125	Cc1ccccc1C(=O)Br.O=C(Br)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4126	Cc1ccccc1C(=O)Br.Nc1occ(CCc2ccccc2C(=O)Br)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het5
amine_acetylation	4127	Cc1ccccc1C(=O)Br.Nc1oc2c(CCc3ccccc3C(=O)Br)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)Br)occ2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het5Het5
amine_acetylation	4128	Cc1ccccc1C(=O)Br.Nc1oc2cc(CCc3ccccc3C(=O)Br)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het5Het6
amine_acetylation	4129	Cc1ccccc1C(=O)Br.Nc1oc2ccc(CCc3ccccc3C(=O)Br)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het5Phe
amine_acetylation	4130	Cc1ccccc1C(=O)Br.Nc1nccc(CCc2ccccc2C(=O)Br)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het6
amine_acetylation	4131	Cc1ccccc1C(=O)Br.Nc1c(Cc2ccccc2C(=O)Br)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)Br)nc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het6Het5
amine_acetylation	4132	Cc1ccccc1C(=O)Br.Nc1ncc2cc(CCc3ccccc3C(=O)Br)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het6Het6
amine_acetylation	4133	Cc1ccccc1C(=O)Br.Nc1ncc2ccc(CCc3ccccc3C(=O)Br)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_Het6Phe
amine_acetylation	4134	Cc1ccccc1C(=O)Br.Nc1c(Cc2ccccc2C(=O)Br)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)Br)cc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_PheHet5
amine_acetylation	4135	Cc1ccccc1C(=O)Br.Nc1cc2cncc(CCc3ccccc3C(=O)Br)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)Br)c2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Amine_Primary_PheHet6
amine_acetylation	4136	Cc1ccccc1C(=O)Br.NCc1ccccc1CCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.Benzylamine_primary
amine_acetylation	4137	Cc1ccccc1C(=O)Br.NCc1cnccc1CCCc1ccccc1C(=O)Br>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Aromatic.HeteroBenzylamine_primary
amine_acetylation	4138	Cc1ccccc1C(=O)Cl.NCCNCCCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4139	Cc1ccccc1C(=O)Cl.NC=CNCCCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4140	Cc1ccccc1C(=O)Cl.NC=CNC=CCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4141	Cc1ccccc1C(=O)Cl.NC1CNCC(CCc2ccccc2C(=O)Cl)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4142	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4143	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)Cl)C=C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4144	Cc1ccccc1C(=O)Cl.NCCNCCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4145	Cc1ccccc1C(=O)Cl.NC=CNCCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4146	Cc1ccccc1C(=O)Cl.Nc1cccc(CCc2ccccc2C(=O)Cl)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4147	Cc1ccccc1C(=O)Cl.NCCNc1ccccc1CCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4148	Cc1ccccc1C(=O)Cl.NC=CNc1ccccc1CCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4149	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4150	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4151	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4152	Cc1ccccc1C(=O)Cl.Nc1cccc(CCc2ccccc2C(=O)Cl)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Phe
amine_acetylation	4153	Cc1ccccc1C(=O)Cl.Nc1cc2ccc(CCc3ccccc3C(=O)Cl)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)Cl)cc2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_PhePhe
amine_acetylation	4154	Cc1ccccc1C(=O)Cl.Nc1cncc(CCc2ccccc2C(=O)Cl)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4155	Cc1ccccc1C(=O)Cl.Nc1cncc(CCc2ccccc2C(=O)Cl)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4156	Cc1ccccc1C(=O)Cl.NCCNc1ccncc1CCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4157	Cc1ccccc1C(=O)Cl.NC=CNc1ccncc1CCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4158	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4159	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)Cl)Cc2ccncc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4160	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4161	Cc1ccccc1C(=O)Cl.O=C(Cl)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4162	Cc1ccccc1C(=O)Cl.Nc1occ(CCc2ccccc2C(=O)Cl)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het5
amine_acetylation	4163	Cc1ccccc1C(=O)Cl.Nc1oc2c(CCc3ccccc3C(=O)Cl)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)Cl)occ2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het5Het5
amine_acetylation	4164	Cc1ccccc1C(=O)Cl.Nc1oc2cc(CCc3ccccc3C(=O)Cl)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het5Het6
amine_acetylation	4165	Cc1ccccc1C(=O)Cl.Nc1oc2ccc(CCc3ccccc3C(=O)Cl)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het5Phe
amine_acetylation	4166	Cc1ccccc1C(=O)Cl.Nc1nccc(CCc2ccccc2C(=O)Cl)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het6
amine_acetylation	4167	Cc1ccccc1C(=O)Cl.Nc1c(Cc2ccccc2C(=O)Cl)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het6Het5
amine_acetylation	4168	Cc1ccccc1C(=O)Cl.Nc1ncc2cc(CCc3ccccc3C(=O)Cl)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het6Het6
amine_acetylation	4169	Cc1ccccc1C(=O)Cl.Nc1ncc2ccc(CCc3ccccc3C(=O)Cl)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_Het6Phe
amine_acetylation	4170	Cc1ccccc1C(=O)Cl.Nc1c(Cc2ccccc2C(=O)Cl)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_PheHet5
amine_acetylation	4171	Cc1ccccc1C(=O)Cl.Nc1cc2cncc(CCc3ccccc3C(=O)Cl)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)Cl)c2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Amine_Primary_PheHet6
amine_acetylation	4172	Cc1ccccc1C(=O)Cl.NCc1ccccc1CCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.Benzylamine_primary
amine_acetylation	4173	Cc1ccccc1C(=O)Cl.NCc1cnccc1CCCc1ccccc1C(=O)Cl>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Aromatic.HeteroBenzylamine_primary
amine_acetylation	4174	Cc1ccccc1C(=O)F.NCCNCCCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4175	Cc1ccccc1C(=O)F.NC=CNCCCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4176	Cc1ccccc1C(=O)F.NC=CNC=CCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4177	Cc1ccccc1C(=O)F.NC1CNCC(CCc2ccccc2C(=O)F)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4178	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4179	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)F)C=C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4180	Cc1ccccc1C(=O)F.NCCNCCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4181	Cc1ccccc1C(=O)F.NC=CNCCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4182	Cc1ccccc1C(=O)F.Nc1cccc(CCc2ccccc2C(=O)F)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4183	Cc1ccccc1C(=O)F.NCCNc1ccccc1CCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4184	Cc1ccccc1C(=O)F.NC=CNc1ccccc1CCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4185	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4186	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4187	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4188	Cc1ccccc1C(=O)F.Nc1cccc(CCc2ccccc2C(=O)F)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Phe
amine_acetylation	4189	Cc1ccccc1C(=O)F.Nc1cc2ccc(CCc3ccccc3C(=O)F)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)F)cc2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_PhePhe
amine_acetylation	4190	Cc1ccccc1C(=O)F.Nc1cncc(CCc2ccccc2C(=O)F)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4191	Cc1ccccc1C(=O)F.Nc1cncc(CCc2ccccc2C(=O)F)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4192	Cc1ccccc1C(=O)F.NCCNc1ccncc1CCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4193	Cc1ccccc1C(=O)F.NC=CNc1ccncc1CCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4194	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4195	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)F)Cc2ccncc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4196	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4197	Cc1ccccc1C(=O)F.O=C(F)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4198	Cc1ccccc1C(=O)F.Nc1occ(CCc2ccccc2C(=O)F)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het5
amine_acetylation	4199	Cc1ccccc1C(=O)F.Nc1oc2c(CCc3ccccc3C(=O)F)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)F)occ2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het5Het5
amine_acetylation	4200	Cc1ccccc1C(=O)F.Nc1oc2cc(CCc3ccccc3C(=O)F)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het5Het6
amine_acetylation	4201	Cc1ccccc1C(=O)F.Nc1oc2ccc(CCc3ccccc3C(=O)F)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het5Phe
amine_acetylation	4202	Cc1ccccc1C(=O)F.Nc1nccc(CCc2ccccc2C(=O)F)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het6
amine_acetylation	4203	Cc1ccccc1C(=O)F.Nc1c(Cc2ccccc2C(=O)F)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)F)nc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het6Het5
amine_acetylation	4204	Cc1ccccc1C(=O)F.Nc1ncc2cc(CCc3ccccc3C(=O)F)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het6Het6
amine_acetylation	4205	Cc1ccccc1C(=O)F.Nc1ncc2ccc(CCc3ccccc3C(=O)F)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_Het6Phe
amine_acetylation	4206	Cc1ccccc1C(=O)F.Nc1c(Cc2ccccc2C(=O)F)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)F)cc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_PheHet5
amine_acetylation	4207	Cc1ccccc1C(=O)F.Nc1cc2cncc(CCc3ccccc3C(=O)F)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)F)c2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Amine_Primary_PheHet6
amine_acetylation	4208	Cc1ccccc1C(=O)F.NCc1ccccc1CCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.Benzylamine_primary
amine_acetylation	4209	Cc1ccccc1C(=O)F.NCc1cnccc1CCCc1ccccc1C(=O)F>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Aromatic.HeteroBenzylamine_primary
amine_acetylation	4210	Cc1ccccc1C(=O)I.NCCNCCCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4211	Cc1ccccc1C(=O)I.NC=CNCCCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4212	Cc1ccccc1C(=O)I.NC=CNC=CCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4213	Cc1ccccc1C(=O)I.NC1CNCC(CCc2ccccc2C(=O)I)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4214	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4215	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)I)C=C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4216	Cc1ccccc1C(=O)I.NCCNCCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4217	Cc1ccccc1C(=O)I.NC=CNCCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4218	Cc1ccccc1C(=O)I.Nc1cccc(CCc2ccccc2C(=O)I)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4219	Cc1ccccc1C(=O)I.NCCNc1ccccc1CCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4220	Cc1ccccc1C(=O)I.NC=CNc1ccccc1CCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4221	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4222	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4223	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4224	Cc1ccccc1C(=O)I.Nc1cccc(CCc2ccccc2C(=O)I)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Phe
amine_acetylation	4225	Cc1ccccc1C(=O)I.Nc1cc2ccc(CCc3ccccc3C(=O)I)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)I)cc2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_PhePhe
amine_acetylation	4226	Cc1ccccc1C(=O)I.Nc1cncc(CCc2ccccc2C(=O)I)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4227	Cc1ccccc1C(=O)I.Nc1cncc(CCc2ccccc2C(=O)I)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4228	Cc1ccccc1C(=O)I.NCCNc1ccncc1CCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4229	Cc1ccccc1C(=O)I.NC=CNc1ccncc1CCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4230	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4231	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)I)Cc2ccncc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4232	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4233	Cc1ccccc1C(=O)I.O=C(I)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4234	Cc1ccccc1C(=O)I.Nc1occ(CCc2ccccc2C(=O)I)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het5
amine_acetylation	4235	Cc1ccccc1C(=O)I.Nc1oc2c(CCc3ccccc3C(=O)I)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)I)occ2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het5Het5
amine_acetylation	4236	Cc1ccccc1C(=O)I.Nc1oc2cc(CCc3ccccc3C(=O)I)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het5Het6
amine_acetylation	4237	Cc1ccccc1C(=O)I.Nc1oc2ccc(CCc3ccccc3C(=O)I)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het5Phe
amine_acetylation	4238	Cc1ccccc1C(=O)I.Nc1nccc(CCc2ccccc2C(=O)I)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het6
amine_acetylation	4239	Cc1ccccc1C(=O)I.Nc1c(Cc2ccccc2C(=O)I)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)I)nc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het6Het5
amine_acetylation	4240	Cc1ccccc1C(=O)I.Nc1ncc2cc(CCc3ccccc3C(=O)I)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het6Het6
amine_acetylation	4241	Cc1ccccc1C(=O)I.Nc1ncc2ccc(CCc3ccccc3C(=O)I)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_Het6Phe
amine_acetylation	4242	Cc1ccccc1C(=O)I.Nc1c(Cc2ccccc2C(=O)I)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)I)cc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_PheHet5
amine_acetylation	4243	Cc1ccccc1C(=O)I.Nc1cc2cncc(CCc3ccccc3C(=O)I)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)I)c2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Amine_Primary_PheHet6
amine_acetylation	4244	Cc1ccccc1C(=O)I.NCc1ccccc1CCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.Benzylamine_primary
amine_acetylation	4245	Cc1ccccc1C(=O)I.NCc1cnccc1CCCc1ccccc1C(=O)I>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Aromatic.HeteroBenzylamine_primary
amine_acetylation	4246	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(CCN)CCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4247	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(C=CN)CCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4248	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(C=CN)C=CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4249	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C1>>Cc1ccccc1C(=O)N1CC(N)CC(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4250	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1CC=CNC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4251	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1C(=O)N1C=CCC(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4252	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)NCCNCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4253	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)NC=CNCCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4254	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4255	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(CCN)c1ccccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4256	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(C=CN)c1ccccc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4257	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2ccccc2CCC(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4258	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ccc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4259	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ccc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4260	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1ccccc1C(=O)Nc1cccc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Phe
amine_acetylation	4261	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1ccccc1C(=O)Nc1cc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_PhePhe
amine_acetylation	4262	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1ccccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4263	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1ccccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4264	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(CCN)c1ccncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4265	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)N(C=CN)c1ccncc1CCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4266	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1C(=O)N1c2cnccc2CCC(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4267	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1C(=O)N1c2ccncc2CCC(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4268	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1C(=O)N1CCCc2ncc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4269	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1C(=O)N1C=CCc2ncc(Cc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Aromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4270	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1ccccc1C(=O)Nc1occ(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het5
amine_acetylation	4271	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1ccccc1C(=O)Nc1oc2c(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het5Het5
amine_acetylation	4272	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1ccccc1C(=O)Nc1oc2cc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het5Het6
amine_acetylation	4273	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1ccccc1C(=O)Nc1oc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het5Phe
amine_acetylation	4274	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1ccccc1C(=O)Nc1nccc(CCc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het6
amine_acetylation	4275	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1c(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het6Het5
amine_acetylation	4276	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1ccccc1C(=O)Nc1ncc2cc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het6Het6
amine_acetylation	4277	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1ccccc1C(=O)Nc1ncc2ccc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_Het6Phe
amine_acetylation	4278	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1c(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1ccccc1C(=O)Nc1c(Cc2ccccc2C(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_PheHet5
amine_acetylation	4279	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1ccccc1C(=O)Nc1cc2cncc(CCc3ccccc3C(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Amine_Primary_PheHet6
amine_acetylation	4280	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)NCc1ccccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.Benzylamine_primary
amine_acetylation	4281	Cc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1ccccc1C(=O)NCc1cnccc1CCCc1ccccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[c;$(c1ccccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Aromatic.HeteroBenzylamine_primary
amine_acetylation	4282	Cc1cnccc1C(=O)Br.NCCNCCCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4283	Cc1cnccc1C(=O)Br.NC=CNCCCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4284	Cc1cnccc1C(=O)Br.NC=CNC=CCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4285	Cc1cnccc1C(=O)Br.NC1CNCC(CCc2cnccc2C(=O)Br)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4286	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)Br)C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4287	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)Br)C=C1	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4288	Cc1cnccc1C(=O)Br.NCCNCCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4289	Cc1cnccc1C(=O)Br.NC=CNCCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4290	Cc1cnccc1C(=O)Br.Nc1cccc(CCc2cnccc2C(=O)Br)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4291	Cc1cnccc1C(=O)Br.NCCNc1ccccc1CCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4292	Cc1cnccc1C(=O)Br.NC=CNc1ccccc1CCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4293	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4294	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4295	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4296	Cc1cnccc1C(=O)Br.Nc1cccc(CCc2cnccc2C(=O)Br)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Phe
amine_acetylation	4297	Cc1cnccc1C(=O)Br.Nc1cc2ccc(CCc3cnccc3C(=O)Br)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)Br)cc2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_PhePhe
amine_acetylation	4298	Cc1cnccc1C(=O)Br.Nc1cncc(CCc2cnccc2C(=O)Br)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4299	Cc1cnccc1C(=O)Br.Nc1cncc(CCc2cnccc2C(=O)Br)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4300	Cc1cnccc1C(=O)Br.NCCNc1ccncc1CCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4301	Cc1cnccc1C(=O)Br.NC=CNc1ccncc1CCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4302	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)Br)Cc2ccccc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4303	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)Br)Cc2ccncc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4304	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4305	Cc1cnccc1C(=O)Br.O=C(Br)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)Br)cc21	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Bromide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4306	Cc1cnccc1C(=O)Br.Nc1occ(CCc2cnccc2C(=O)Br)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het5
amine_acetylation	4307	Cc1cnccc1C(=O)Br.Nc1oc2c(CCc3cnccc3C(=O)Br)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)Br)occ2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het5Het5
amine_acetylation	4308	Cc1cnccc1C(=O)Br.Nc1oc2cc(CCc3cnccc3C(=O)Br)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het5Het6
amine_acetylation	4309	Cc1cnccc1C(=O)Br.Nc1oc2ccc(CCc3cnccc3C(=O)Br)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het5Phe
amine_acetylation	4310	Cc1cnccc1C(=O)Br.Nc1nccc(CCc2cnccc2C(=O)Br)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)Br)c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het6
amine_acetylation	4311	Cc1cnccc1C(=O)Br.Nc1c(Cc2cnccc2C(=O)Br)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)Br)nc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het6Het5
amine_acetylation	4312	Cc1cnccc1C(=O)Br.Nc1ncc2cc(CCc3cnccc3C(=O)Br)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)Br)ncc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het6Het6
amine_acetylation	4313	Cc1cnccc1C(=O)Br.Nc1ncc2ccc(CCc3cnccc3C(=O)Br)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)Br)cc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_Het6Phe
amine_acetylation	4314	Cc1cnccc1C(=O)Br.Nc1c(Cc2cnccc2C(=O)Br)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)Br)cc2cocc2c1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_PheHet5
amine_acetylation	4315	Cc1cnccc1C(=O)Br.Nc1cc2cncc(CCc3cnccc3C(=O)Br)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)Br)c2cc1N	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Amine_Primary_PheHet6
amine_acetylation	4316	Cc1cnccc1C(=O)Br.NCc1ccccc1CCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.Benzylamine_primary
amine_acetylation	4317	Cc1cnccc1C(=O)Br.NCc1cnccc1CCCc1cnccc1C(=O)Br>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)Br	[Br;$([Br][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Bromide_Heteroaromatic.HeteroBenzylamine_primary
amine_acetylation	4318	Cc1cnccc1C(=O)Cl.NCCNCCCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4319	Cc1cnccc1C(=O)Cl.NC=CNCCCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4320	Cc1cnccc1C(=O)Cl.NC=CNC=CCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4321	Cc1cnccc1C(=O)Cl.NC1CNCC(CCc2cnccc2C(=O)Cl)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4322	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)Cl)C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4323	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)Cl)C=C1	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4324	Cc1cnccc1C(=O)Cl.NCCNCCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4325	Cc1cnccc1C(=O)Cl.NC=CNCCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4326	Cc1cnccc1C(=O)Cl.Nc1cccc(CCc2cnccc2C(=O)Cl)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4327	Cc1cnccc1C(=O)Cl.NCCNc1ccccc1CCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4328	Cc1cnccc1C(=O)Cl.NC=CNc1ccccc1CCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4329	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4330	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4331	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4332	Cc1cnccc1C(=O)Cl.Nc1cccc(CCc2cnccc2C(=O)Cl)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Phe
amine_acetylation	4333	Cc1cnccc1C(=O)Cl.Nc1cc2ccc(CCc3cnccc3C(=O)Cl)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)Cl)cc2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_PhePhe
amine_acetylation	4334	Cc1cnccc1C(=O)Cl.Nc1cncc(CCc2cnccc2C(=O)Cl)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4335	Cc1cnccc1C(=O)Cl.Nc1cncc(CCc2cnccc2C(=O)Cl)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4336	Cc1cnccc1C(=O)Cl.NCCNc1ccncc1CCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4337	Cc1cnccc1C(=O)Cl.NC=CNc1ccncc1CCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4338	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)Cl)Cc2ccccc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4339	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)Cl)Cc2ccncc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4340	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4341	Cc1cnccc1C(=O)Cl.O=C(Cl)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)Cl)cc21	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Chloride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4342	Cc1cnccc1C(=O)Cl.Nc1occ(CCc2cnccc2C(=O)Cl)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het5
amine_acetylation	4343	Cc1cnccc1C(=O)Cl.Nc1oc2c(CCc3cnccc3C(=O)Cl)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)Cl)occ2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het5Het5
amine_acetylation	4344	Cc1cnccc1C(=O)Cl.Nc1oc2cc(CCc3cnccc3C(=O)Cl)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het5Het6
amine_acetylation	4345	Cc1cnccc1C(=O)Cl.Nc1oc2ccc(CCc3cnccc3C(=O)Cl)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het5Phe
amine_acetylation	4346	Cc1cnccc1C(=O)Cl.Nc1nccc(CCc2cnccc2C(=O)Cl)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)Cl)c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het6
amine_acetylation	4347	Cc1cnccc1C(=O)Cl.Nc1c(Cc2cnccc2C(=O)Cl)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)Cl)nc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het6Het5
amine_acetylation	4348	Cc1cnccc1C(=O)Cl.Nc1ncc2cc(CCc3cnccc3C(=O)Cl)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)Cl)ncc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het6Het6
amine_acetylation	4349	Cc1cnccc1C(=O)Cl.Nc1ncc2ccc(CCc3cnccc3C(=O)Cl)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)Cl)cc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_Het6Phe
amine_acetylation	4350	Cc1cnccc1C(=O)Cl.Nc1c(Cc2cnccc2C(=O)Cl)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)Cl)cc2cocc2c1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_PheHet5
amine_acetylation	4351	Cc1cnccc1C(=O)Cl.Nc1cc2cncc(CCc3cnccc3C(=O)Cl)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)Cl)c2cc1N	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Amine_Primary_PheHet6
amine_acetylation	4352	Cc1cnccc1C(=O)Cl.NCc1ccccc1CCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.Benzylamine_primary
amine_acetylation	4353	Cc1cnccc1C(=O)Cl.NCc1cnccc1CCCc1cnccc1C(=O)Cl>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)Cl	[Cl;$([Cl][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Chloride_Heteroaromatic.HeteroBenzylamine_primary
amine_acetylation	4354	Cc1cnccc1C(=O)F.NCCNCCCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4355	Cc1cnccc1C(=O)F.NC=CNCCCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4356	Cc1cnccc1C(=O)F.NC=CNC=CCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4357	Cc1cnccc1C(=O)F.NC1CNCC(CCc2cnccc2C(=O)F)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4358	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)F)C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4359	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)F)C=C1	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4360	Cc1cnccc1C(=O)F.NCCNCCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4361	Cc1cnccc1C(=O)F.NC=CNCCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4362	Cc1cnccc1C(=O)F.Nc1cccc(CCc2cnccc2C(=O)F)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4363	Cc1cnccc1C(=O)F.NCCNc1ccccc1CCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4364	Cc1cnccc1C(=O)F.NC=CNc1ccccc1CCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4365	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4366	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4367	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4368	Cc1cnccc1C(=O)F.Nc1cccc(CCc2cnccc2C(=O)F)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Phe
amine_acetylation	4369	Cc1cnccc1C(=O)F.Nc1cc2ccc(CCc3cnccc3C(=O)F)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)F)cc2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_PhePhe
amine_acetylation	4370	Cc1cnccc1C(=O)F.Nc1cncc(CCc2cnccc2C(=O)F)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4371	Cc1cnccc1C(=O)F.Nc1cncc(CCc2cnccc2C(=O)F)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4372	Cc1cnccc1C(=O)F.NCCNc1ccncc1CCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4373	Cc1cnccc1C(=O)F.NC=CNc1ccncc1CCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4374	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)F)Cc2ccccc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4375	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)F)Cc2ccncc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4376	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4377	Cc1cnccc1C(=O)F.O=C(F)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)F)cc21	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Fluoride_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4378	Cc1cnccc1C(=O)F.Nc1occ(CCc2cnccc2C(=O)F)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het5
amine_acetylation	4379	Cc1cnccc1C(=O)F.Nc1oc2c(CCc3cnccc3C(=O)F)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)F)occ2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het5Het5
amine_acetylation	4380	Cc1cnccc1C(=O)F.Nc1oc2cc(CCc3cnccc3C(=O)F)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het5Het6
amine_acetylation	4381	Cc1cnccc1C(=O)F.Nc1oc2ccc(CCc3cnccc3C(=O)F)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het5Phe
amine_acetylation	4382	Cc1cnccc1C(=O)F.Nc1nccc(CCc2cnccc2C(=O)F)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)F)c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het6
amine_acetylation	4383	Cc1cnccc1C(=O)F.Nc1c(Cc2cnccc2C(=O)F)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)F)nc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het6Het5
amine_acetylation	4384	Cc1cnccc1C(=O)F.Nc1ncc2cc(CCc3cnccc3C(=O)F)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)F)ncc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het6Het6
amine_acetylation	4385	Cc1cnccc1C(=O)F.Nc1ncc2ccc(CCc3cnccc3C(=O)F)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)F)cc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_Het6Phe
amine_acetylation	4386	Cc1cnccc1C(=O)F.Nc1c(Cc2cnccc2C(=O)F)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)F)cc2cocc2c1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_PheHet5
amine_acetylation	4387	Cc1cnccc1C(=O)F.Nc1cc2cncc(CCc3cnccc3C(=O)F)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)F)c2cc1N	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Amine_Primary_PheHet6
amine_acetylation	4388	Cc1cnccc1C(=O)F.NCc1ccccc1CCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.Benzylamine_primary
amine_acetylation	4389	Cc1cnccc1C(=O)F.NCc1cnccc1CCCc1cnccc1C(=O)F>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)F	[F;$([F][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Fluoride_Heteroaromatic.HeteroBenzylamine_primary
amine_acetylation	4390	Cc1cnccc1C(=O)I.NCCNCCCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4391	Cc1cnccc1C(=O)I.NC=CNCCCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4392	Cc1cnccc1C(=O)I.NC=CNC=CCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4393	Cc1cnccc1C(=O)I.NC1CNCC(CCc2cnccc2C(=O)I)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4394	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)I)C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4395	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)I)C=C1	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4396	Cc1cnccc1C(=O)I.NCCNCCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4397	Cc1cnccc1C(=O)I.NC=CNCCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4398	Cc1cnccc1C(=O)I.Nc1cccc(CCc2cnccc2C(=O)I)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4399	Cc1cnccc1C(=O)I.NCCNc1ccccc1CCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4400	Cc1cnccc1C(=O)I.NC=CNc1ccccc1CCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4401	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4402	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4403	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4404	Cc1cnccc1C(=O)I.Nc1cccc(CCc2cnccc2C(=O)I)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Phe
amine_acetylation	4405	Cc1cnccc1C(=O)I.Nc1cc2ccc(CCc3cnccc3C(=O)I)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)I)cc2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_PhePhe
amine_acetylation	4406	Cc1cnccc1C(=O)I.Nc1cncc(CCc2cnccc2C(=O)I)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4407	Cc1cnccc1C(=O)I.Nc1cncc(CCc2cnccc2C(=O)I)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4408	Cc1cnccc1C(=O)I.NCCNc1ccncc1CCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4409	Cc1cnccc1C(=O)I.NC=CNc1ccncc1CCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4410	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)I)Cc2ccccc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4411	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)I)Cc2ccncc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4412	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4413	Cc1cnccc1C(=O)I.O=C(I)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)I)cc21	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Iodide_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4414	Cc1cnccc1C(=O)I.Nc1occ(CCc2cnccc2C(=O)I)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het5
amine_acetylation	4415	Cc1cnccc1C(=O)I.Nc1oc2c(CCc3cnccc3C(=O)I)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)I)occ2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het5Het5
amine_acetylation	4416	Cc1cnccc1C(=O)I.Nc1oc2cc(CCc3cnccc3C(=O)I)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het5Het6
amine_acetylation	4417	Cc1cnccc1C(=O)I.Nc1oc2ccc(CCc3cnccc3C(=O)I)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het5Phe
amine_acetylation	4418	Cc1cnccc1C(=O)I.Nc1nccc(CCc2cnccc2C(=O)I)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)I)c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het6
amine_acetylation	4419	Cc1cnccc1C(=O)I.Nc1c(Cc2cnccc2C(=O)I)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)I)nc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het6Het5
amine_acetylation	4420	Cc1cnccc1C(=O)I.Nc1ncc2cc(CCc3cnccc3C(=O)I)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)I)ncc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het6Het6
amine_acetylation	4421	Cc1cnccc1C(=O)I.Nc1ncc2ccc(CCc3cnccc3C(=O)I)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)I)cc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_Het6Phe
amine_acetylation	4422	Cc1cnccc1C(=O)I.Nc1c(Cc2cnccc2C(=O)I)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)I)cc2cocc2c1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_PheHet5
amine_acetylation	4423	Cc1cnccc1C(=O)I.Nc1cc2cncc(CCc3cnccc3C(=O)I)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)I)c2cc1N	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Amine_Primary_PheHet6
amine_acetylation	4424	Cc1cnccc1C(=O)I.NCc1ccccc1CCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.Benzylamine_primary
amine_acetylation	4425	Cc1cnccc1C(=O)I.NCc1cnccc1CCCc1cnccc1C(=O)I>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)I	[I;$([I][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Iodide_Heteroaromatic.HeteroBenzylamine_primary
amine_acetylation	4426	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(CCN)CCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4427	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(C=CN)CCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4428	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(C=CN)C=CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4429	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C1>>Cc1cnccc1C(=O)N1CC(N)CC(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
amine_acetylation	4430	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCC1CC=CNC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4431	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1C(=O)N1C=CCC(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
amine_acetylation	4432	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)NCCNCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_SaturatedAliphatic
amine_acetylation	4433	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)NC=CNCCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_UnsaturatedAliphatic
amine_acetylation	4434	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Aromatic
amine_acetylation	4435	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(CCN)c1ccccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4436	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(C=CN)c1ccccc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4437	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2ccccc2CCC(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Aromatic
amine_acetylation	4438	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ccc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
amine_acetylation	4439	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ccc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
amine_acetylation	4440	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1C(=O)Nc1cccc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Phe
amine_acetylation	4441	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1cnccc1C(=O)Nc1cc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_PhePhe
amine_acetylation	4442	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cnccc1C(=O)N(c1ccccc1)c1c(N)cncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4443	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1cnccc1C(=O)N(c1cccnc1)c1c(N)cncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4444	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(CCN)c1ccncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4445	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)N(C=CN)c1ccncc1CCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4446	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1C(=O)N1c2cnccc2CCC(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_Aromatic-Heteroaromatic
amine_acetylation	4447	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1C(=O)N1c2ccncc2CCC(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
amine_acetylation	4448	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1C(=O)N1CCCc2ncc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
amine_acetylation	4449	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.O=C(OS(=O)(=O)C(F)(F)F)c1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1C(=O)N1C=CCc2ncc(Cc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[*:2][N:3]([#6:4])[#6:5]	AcidX-Triflate_Heteroaromatic.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
amine_acetylation	4450	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1C(=O)Nc1occ(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het5
amine_acetylation	4451	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1cnccc1C(=O)Nc1oc2c(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het5Het5
amine_acetylation	4452	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cnccc1C(=O)Nc1oc2cc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het5Het6
amine_acetylation	4453	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cnccc1C(=O)Nc1oc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het5Phe
amine_acetylation	4454	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1C(=O)Nc1nccc(CCc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het6
amine_acetylation	4455	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het6Het5
amine_acetylation	4456	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cnccc1C(=O)Nc1ncc2cc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het6Het6
amine_acetylation	4457	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cnccc1C(=O)Nc1ncc2ccc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_Het6Phe
amine_acetylation	4458	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1cnccc1C(=O)Nc1c(Cc2cnccc2C(=O)OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_PheHet5
amine_acetylation	4459	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1cnccc1C(=O)Nc1cc2cncc(CCc3cnccc3C(=O)OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Amine_Primary_PheHet6
amine_acetylation	4460	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)NCc1ccccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.Benzylamine_primary
amine_acetylation	4461	Cc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F>>Cc1cnccc1C(=O)NCc1cnccc1CCCc1cnccc1C(=O)OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][C;$(C(=O));!$(C([#7,#8,#15,#16])(=[O;D1])[#9,#17,#35,#53])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[*:2][N:3][#6:4]	AcidX-Triflate_Heteroaromatic.HeteroBenzylamine_primary
B-H	4462	Cc1ccccc1Br.NCCNCCCCc1ccccc1Br>>Cc1ccccc1N(CCN)CCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4463	Cc1ccccc1Br.NC=CNCCCCc1ccccc1Br>>Cc1ccccc1N(C=CN)CCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4464	Cc1ccccc1Br.NC=CNC=CCCc1ccccc1Br>>Cc1ccccc1N(C=CN)C=CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4465	Cc1ccccc1Br.NC1CNCC(CCc2ccccc2Br)C1>>Cc1ccccc1N1CC(N)CC(CCc2ccccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4466	Cc1ccccc1Br.Brc1ccccc1CCC1CC=CNC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4467	Cc1ccccc1Br.Brc1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2Br)C=C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4468	Cc1ccccc1Br.NCCNCCCc1ccccc1Br>>Cc1ccccc1NCCNCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_SaturatedAliphatic
B-H	4469	Cc1ccccc1Br.NC=CNCCCc1ccccc1Br>>Cc1ccccc1NC=CNCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_UnsaturatedAliphatic
B-H	4470	Cc1ccccc1Br.Nc1cccc(CCc2ccccc2Br)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4471	Cc1ccccc1Br.NCCNc1ccccc1CCCc1ccccc1Br>>Cc1ccccc1N(CCN)c1ccccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4472	Cc1ccccc1Br.NC=CNc1ccccc1CCc1ccccc1Br>>Cc1ccccc1N(C=CN)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4473	Cc1ccccc1Br.Brc1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1N1c2ccccc2CCC(Cc2ccccc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4474	Cc1ccccc1Br.Brc1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ccc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4475	Cc1ccccc1Br.Brc1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ccc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4476	Cc1ccccc1Br.Nc1cccc(CCc2ccccc2Br)c1N>>Cc1ccccc1Nc1cccc(CCc2ccccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Phe
B-H	4477	Cc1ccccc1Br.Nc1cc2ccc(CCc3ccccc3Br)cc2cc1N>>Cc1ccccc1Nc1cc2ccc(CCc3ccccc3Br)cc2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_PhePhe
B-H	4478	Cc1ccccc1Br.Nc1cncc(CCc2ccccc2Br)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4479	Cc1ccccc1Br.Nc1cncc(CCc2ccccc2Br)c1Nc1cccnc1>>Cc1ccccc1N(c1cccnc1)c1c(N)cncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4480	Cc1ccccc1Br.NCCNc1ccncc1CCc1ccccc1Br>>Cc1ccccc1N(CCN)c1ccncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4481	Cc1ccccc1Br.NC=CNc1ccncc1CCc1ccccc1Br>>Cc1ccccc1N(C=CN)c1ccncc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4482	Cc1ccccc1Br.Brc1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1N1c2cnccc2CCC(Cc2ccccc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4483	Cc1ccccc1Br.Brc1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1N1c2ccncc2CCC(Cc2ccccc2Br)Cc2ccncc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4484	Cc1ccccc1Br.Brc1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ncc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4485	Cc1ccccc1Br.Brc1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ncc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4486	Cc1ccccc1Br.Nc1occ(CCc2ccccc2Br)c1N>>Cc1ccccc1Nc1occ(CCc2ccccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het5
B-H	4487	Cc1ccccc1Br.Nc1oc2c(CCc3ccccc3Br)occ2c1N>>Cc1ccccc1Nc1oc2c(CCc3ccccc3Br)occ2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het5Het5
B-H	4488	Cc1ccccc1Br.Nc1oc2cc(CCc3ccccc3Br)ncc2c1N>>Cc1ccccc1Nc1oc2cc(CCc3ccccc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het5Het6
B-H	4489	Cc1ccccc1Br.Nc1oc2ccc(CCc3ccccc3Br)cc2c1N>>Cc1ccccc1Nc1oc2ccc(CCc3ccccc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het5Phe
B-H	4490	Cc1ccccc1Br.Nc1nccc(CCc2ccccc2Br)c1N>>Cc1ccccc1Nc1nccc(CCc2ccccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het6
B-H	4491	Cc1ccccc1Br.Nc1c(Cc2ccccc2Br)nc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2Br)nc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het6Het5
B-H	4492	Cc1ccccc1Br.Nc1ncc2cc(CCc3ccccc3Br)ncc2c1N>>Cc1ccccc1Nc1ncc2cc(CCc3ccccc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het6Het6
B-H	4493	Cc1ccccc1Br.Nc1ncc2ccc(CCc3ccccc3Br)cc2c1N>>Cc1ccccc1Nc1ncc2ccc(CCc3ccccc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_Het6Phe
B-H	4494	Cc1ccccc1Br.Nc1c(Cc2ccccc2Br)cc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2Br)cc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_PheHet5
B-H	4495	Cc1ccccc1Br.Nc1cc2cncc(CCc3ccccc3Br)c2cc1N>>Cc1ccccc1Nc1cc2cncc(CCc3ccccc3Br)c2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Amine_Primary_PheHet6
B-H	4496	Cc1ccccc1Br.NCc1ccccc1CCCc1ccccc1Br>>Cc1ccccc1NCc1ccccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.Benzylamine_primary
B-H	4497	Cc1ccccc1Br.NCc1cnccc1CCCc1ccccc1Br>>Cc1ccccc1NCc1cnccc1CCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Phe.HeteroBenzylamine_primary
B-H	4498	Cc1c(Br)ccc2ccccc12.NCCNCCCCc1c(Br)ccc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4499	Cc1c(Br)ccc2ccccc12.NC=CNCCCCc1c(Br)ccc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4500	Cc1c(Br)ccc2ccccc12.NC=CNC=CCCc1c(Br)ccc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4501	Cc1c(Br)ccc2ccccc12.NC1CNCC(CCc2c(Br)ccc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)ccc4ccccc34)C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4502	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)ccc4ccccc34)C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4503	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)ccc4ccccc34)C=C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4504	Cc1c(Br)ccc2ccccc12.NCCNCCCc1c(Br)ccc2ccccc12>>Cc1c(NCCNCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_SaturatedAliphatic
B-H	4505	Cc1c(Br)ccc2ccccc12.NC=CNCCCc1c(Br)ccc2ccccc12>>Cc1c(NC=CNCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_UnsaturatedAliphatic
B-H	4506	Cc1c(Br)ccc2ccccc12.Nc1cccc(CCc2c(Br)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4507	Cc1c(Br)ccc2ccccc12.NCCNc1ccccc1CCCc1c(Br)ccc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4508	Cc1c(Br)ccc2ccccc12.NC=CNc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4509	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4510	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4511	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4512	Cc1c(Br)ccc2ccccc12.Nc1cccc(CCc2c(Br)ccc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)ccc4ccccc34)c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Phe
B-H	4513	Cc1c(Br)ccc2ccccc12.Nc1cc2ccc(CCc3c(Br)ccc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)ccc5ccccc45)cc3cc2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_PhePhe
B-H	4514	Cc1c(Br)ccc2ccccc12.Nc1cncc(CCc2c(Br)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4515	Cc1c(Br)ccc2ccccc12.Nc1cncc(CCc2c(Br)ccc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4516	Cc1c(Br)ccc2ccccc12.NCCNc1ccncc1CCc1c(Br)ccc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4517	Cc1c(Br)ccc2ccccc12.NC=CNc1ccncc1CCc1c(Br)ccc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4518	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4519	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)ccc4ccccc34)Cc3ccncc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4520	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4521	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4522	Cc1c(Br)ccc2ccccc12.Nc1occ(CCc2c(Br)ccc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)ccc4ccccc34)c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het5
B-H	4523	Cc1c(Br)ccc2ccccc12.Nc1oc2c(CCc3c(Br)ccc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)ccc5ccccc45)occ3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het5Het5
B-H	4524	Cc1c(Br)ccc2ccccc12.Nc1oc2cc(CCc3c(Br)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het5Het6
B-H	4525	Cc1c(Br)ccc2ccccc12.Nc1oc2ccc(CCc3c(Br)ccc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)ccc5ccccc45)cc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het5Phe
B-H	4526	Cc1c(Br)ccc2ccccc12.Nc1nccc(CCc2c(Br)ccc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)ccc4ccccc34)c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het6
B-H	4527	Cc1c(Br)ccc2ccccc12.Nc1c(Cc2c(Br)ccc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ccc4ccccc34)nc3cocc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het6Het5
B-H	4528	Cc1c(Br)ccc2ccccc12.Nc1ncc2cc(CCc3c(Br)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het6Het6
B-H	4529	Cc1c(Br)ccc2ccccc12.Nc1ncc2ccc(CCc3c(Br)ccc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)ccc5ccccc45)cc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_Het6Phe
B-H	4530	Cc1c(Br)ccc2ccccc12.Nc1c(Cc2c(Br)ccc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ccc4ccccc34)cc3cocc3c2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_PheHet5
B-H	4531	Cc1c(Br)ccc2ccccc12.Nc1cc2cncc(CCc3c(Br)ccc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)ccc5ccccc45)c3cc2N)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Amine_Primary_PheHet6
B-H	4532	Cc1c(Br)ccc2ccccc12.NCc1ccccc1CCCc1c(Br)ccc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.Benzylamine_primary
B-H	4533	Cc1c(Br)ccc2ccccc12.NCc1cnccc1CCCc1c(Br)ccc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PhePhe.HeteroBenzylamine_primary
B-H	4534	Cc1ccccc1I.NCCNCCCCc1ccccc1I>>Cc1ccccc1N(CCN)CCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4535	Cc1ccccc1I.NC=CNCCCCc1ccccc1I>>Cc1ccccc1N(C=CN)CCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4536	Cc1ccccc1I.NC=CNC=CCCc1ccccc1I>>Cc1ccccc1N(C=CN)C=CCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4537	Cc1ccccc1I.NC1CNCC(CCc2ccccc2I)C1>>Cc1ccccc1N1CC(N)CC(CCc2ccccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4538	Cc1ccccc1I.Ic1ccccc1CCC1CC=CNC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4539	Cc1ccccc1I.Ic1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2I)C=C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4540	Cc1ccccc1I.NCCNCCCc1ccccc1I>>Cc1ccccc1NCCNCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_SaturatedAliphatic
B-H	4541	Cc1ccccc1I.NC=CNCCCc1ccccc1I>>Cc1ccccc1NC=CNCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_UnsaturatedAliphatic
B-H	4542	Cc1ccccc1I.Nc1cccc(CCc2ccccc2I)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4543	Cc1ccccc1I.NCCNc1ccccc1CCCc1ccccc1I>>Cc1ccccc1N(CCN)c1ccccc1CCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4544	Cc1ccccc1I.NC=CNc1ccccc1CCc1ccccc1I>>Cc1ccccc1N(C=CN)c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4545	Cc1ccccc1I.Ic1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1N1c2ccccc2CCC(Cc2ccccc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4546	Cc1ccccc1I.Ic1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ccc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4547	Cc1ccccc1I.Ic1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ccc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4548	Cc1ccccc1I.Nc1cccc(CCc2ccccc2I)c1N>>Cc1ccccc1Nc1cccc(CCc2ccccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Phe
B-H	4549	Cc1ccccc1I.Nc1cc2ccc(CCc3ccccc3I)cc2cc1N>>Cc1ccccc1Nc1cc2ccc(CCc3ccccc3I)cc2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_PhePhe
B-H	4550	Cc1ccccc1I.Nc1cncc(CCc2ccccc2I)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4551	Cc1ccccc1I.Nc1cncc(CCc2ccccc2I)c1Nc1cccnc1>>Cc1ccccc1N(c1cccnc1)c1c(N)cncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4552	Cc1ccccc1I.NCCNc1ccncc1CCc1ccccc1I>>Cc1ccccc1N(CCN)c1ccncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4553	Cc1ccccc1I.NC=CNc1ccncc1CCc1ccccc1I>>Cc1ccccc1N(C=CN)c1ccncc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4554	Cc1ccccc1I.Ic1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1N1c2cnccc2CCC(Cc2ccccc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4555	Cc1ccccc1I.Ic1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1N1c2ccncc2CCC(Cc2ccccc2I)Cc2ccncc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4556	Cc1ccccc1I.Ic1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ncc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4557	Cc1ccccc1I.Ic1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ncc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4558	Cc1ccccc1I.Nc1occ(CCc2ccccc2I)c1N>>Cc1ccccc1Nc1occ(CCc2ccccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het5
B-H	4559	Cc1ccccc1I.Nc1oc2c(CCc3ccccc3I)occ2c1N>>Cc1ccccc1Nc1oc2c(CCc3ccccc3I)occ2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het5Het5
B-H	4560	Cc1ccccc1I.Nc1oc2cc(CCc3ccccc3I)ncc2c1N>>Cc1ccccc1Nc1oc2cc(CCc3ccccc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het5Het6
B-H	4561	Cc1ccccc1I.Nc1oc2ccc(CCc3ccccc3I)cc2c1N>>Cc1ccccc1Nc1oc2ccc(CCc3ccccc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het5Phe
B-H	4562	Cc1ccccc1I.Nc1nccc(CCc2ccccc2I)c1N>>Cc1ccccc1Nc1nccc(CCc2ccccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het6
B-H	4563	Cc1ccccc1I.Nc1c(Cc2ccccc2I)nc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2I)nc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het6Het5
B-H	4564	Cc1ccccc1I.Nc1ncc2cc(CCc3ccccc3I)ncc2c1N>>Cc1ccccc1Nc1ncc2cc(CCc3ccccc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het6Het6
B-H	4565	Cc1ccccc1I.Nc1ncc2ccc(CCc3ccccc3I)cc2c1N>>Cc1ccccc1Nc1ncc2ccc(CCc3ccccc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_Het6Phe
B-H	4566	Cc1ccccc1I.Nc1c(Cc2ccccc2I)cc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2I)cc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_PheHet5
B-H	4567	Cc1ccccc1I.Nc1cc2cncc(CCc3ccccc3I)c2cc1N>>Cc1ccccc1Nc1cc2cncc(CCc3ccccc3I)c2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Amine_Primary_PheHet6
B-H	4568	Cc1ccccc1I.NCc1ccccc1CCCc1ccccc1I>>Cc1ccccc1NCc1ccccc1CCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.Benzylamine_primary
B-H	4569	Cc1ccccc1I.NCc1cnccc1CCCc1ccccc1I>>Cc1ccccc1NCc1cnccc1CCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Phe.HeteroBenzylamine_primary
B-H	4570	Cc1c(I)ccc2ccccc12.NCCNCCCCc1c(I)ccc2ccccc12>>Cc1c(N(CCN)CCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4571	Cc1c(I)ccc2ccccc12.NC=CNCCCCc1c(I)ccc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4572	Cc1c(I)ccc2ccccc12.NC=CNC=CCCc1c(I)ccc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4573	Cc1c(I)ccc2ccccc12.NC1CNCC(CCc2c(I)ccc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)ccc4ccccc34)C2)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4574	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)ccc4ccccc34)C2)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4575	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)ccc4ccccc34)C=C2)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4576	Cc1c(I)ccc2ccccc12.NCCNCCCc1c(I)ccc2ccccc12>>Cc1c(NCCNCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_SaturatedAliphatic
B-H	4577	Cc1c(I)ccc2ccccc12.NC=CNCCCc1c(I)ccc2ccccc12>>Cc1c(NC=CNCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_UnsaturatedAliphatic
B-H	4578	Cc1c(I)ccc2ccccc12.Nc1cccc(CCc2c(I)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4579	Cc1c(I)ccc2ccccc12.NCCNc1ccccc1CCCc1c(I)ccc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4580	Cc1c(I)ccc2ccccc12.NC=CNc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4581	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4582	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4583	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4584	Cc1c(I)ccc2ccccc12.Nc1cccc(CCc2c(I)ccc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)ccc4ccccc34)c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Phe
B-H	4585	Cc1c(I)ccc2ccccc12.Nc1cc2ccc(CCc3c(I)ccc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)ccc5ccccc45)cc3cc2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_PhePhe
B-H	4586	Cc1c(I)ccc2ccccc12.Nc1cncc(CCc2c(I)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4587	Cc1c(I)ccc2ccccc12.Nc1cncc(CCc2c(I)ccc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4588	Cc1c(I)ccc2ccccc12.NCCNc1ccncc1CCc1c(I)ccc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4589	Cc1c(I)ccc2ccccc12.NC=CNc1ccncc1CCc1c(I)ccc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4590	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4591	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)ccc4ccccc34)Cc3ccncc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4592	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4593	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4594	Cc1c(I)ccc2ccccc12.Nc1occ(CCc2c(I)ccc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(I)ccc4ccccc34)c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het5
B-H	4595	Cc1c(I)ccc2ccccc12.Nc1oc2c(CCc3c(I)ccc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)ccc5ccccc45)occ3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het5Het5
B-H	4596	Cc1c(I)ccc2ccccc12.Nc1oc2cc(CCc3c(I)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het5Het6
B-H	4597	Cc1c(I)ccc2ccccc12.Nc1oc2ccc(CCc3c(I)ccc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)ccc5ccccc45)cc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het5Phe
B-H	4598	Cc1c(I)ccc2ccccc12.Nc1nccc(CCc2c(I)ccc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)ccc4ccccc34)c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het6
B-H	4599	Cc1c(I)ccc2ccccc12.Nc1c(Cc2c(I)ccc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ccc4ccccc34)nc3cocc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het6Het5
B-H	4600	Cc1c(I)ccc2ccccc12.Nc1ncc2cc(CCc3c(I)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het6Het6
B-H	4601	Cc1c(I)ccc2ccccc12.Nc1ncc2ccc(CCc3c(I)ccc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)ccc5ccccc45)cc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_Het6Phe
B-H	4602	Cc1c(I)ccc2ccccc12.Nc1c(Cc2c(I)ccc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ccc4ccccc34)cc3cocc3c2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_PheHet5
B-H	4603	Cc1c(I)ccc2ccccc12.Nc1cc2cncc(CCc3c(I)ccc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)ccc5ccccc45)c3cc2N)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Amine_Primary_PheHet6
B-H	4604	Cc1c(I)ccc2ccccc12.NCc1ccccc1CCCc1c(I)ccc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.Benzylamine_primary
B-H	4605	Cc1c(I)ccc2ccccc12.NCc1cnccc1CCCc1c(I)ccc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PhePhe.HeteroBenzylamine_primary
B-H	4606	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCCNCCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(CCN)CCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4607	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC=CNCCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(C=CN)CCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4608	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC=CNC=CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(C=CN)C=CCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4609	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC1CNCC(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)C1>>Cc1cccc(N2CC(N)CC(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)C2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4610	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCC2CC=CNC2)c1)C(F)(F)F>>Cc1cccc(N2C=CCC(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)C2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4611	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCC2C=CNC=CC2)c1)C(F)(F)F>>Cc1cccc(N2C=CCC(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)C=C2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4612	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCCNCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(NCCNCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_SaturatedAliphatic
B-H	4613	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC=CNCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(NC=CNCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_UnsaturatedAliphatic
B-H	4614	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cccc(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1Nc1ccccc1>>Cc1cccc(N(c2ccccc2)c2c(N)cccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4615	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCCNc1ccccc1CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(CCN)c2ccccc2CCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4616	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC=CNc1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(C=CN)c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4617	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCc3ccccc3Nc3ccccc3C2)c1)C(F)(F)F>>Cc1cccc(N2c3ccccc3CCC(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)Cc3ccccc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4618	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)NCCC3)c1)C(F)(F)F>>Cc1cccc(N2CCCc3ccc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4619	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)NC=CC3)c1)C(F)(F)F>>Cc1cccc(N2C=CCc3ccc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4620	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cccc(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1N>>Cc1cccc(Nc2cccc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Phe
B-H	4621	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cc2ccc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)cc2cc1N>>Cc1cccc(Nc2cc3ccc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc3cc2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_PhePhe
B-H	4622	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cncc(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1Nc1ccccc1>>Cc1cccc(N(c2ccccc2)c2c(N)cncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4623	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cncc(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1Nc1cccnc1>>Cc1cccc(N(c2cccnc2)c2c(N)cncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4624	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCCNc1ccncc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(CCN)c2ccncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4625	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NC=CNc1ccncc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(N(C=CN)c2ccncc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4626	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCc3ccncc3Nc3ccccc3C2)c1)C(F)(F)F>>Cc1cccc(N2c3cnccc3CCC(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)Cc3ccccc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4627	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCc3cnccc3Nc3cnccc3C2)c1)C(F)(F)F>>Cc1cccc(N2c3ccncc3CCC(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)Cc3ccncc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4628	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnc3c(c2)NCCC3)c1)C(F)(F)F>>Cc1cccc(N2CCCc3ncc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4629	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnc3c(c2)NC=CC3)c1)C(F)(F)F>>Cc1cccc(N2C=CCc3ncc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4630	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1occ(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1N>>Cc1cccc(Nc2occ(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het5
B-H	4631	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1oc2c(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)occ2c1N>>Cc1cccc(Nc2oc3c(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)occ3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het5Het5
B-H	4632	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1oc2cc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)ncc2c1N>>Cc1cccc(Nc2oc3cc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)ncc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het5Het6
B-H	4633	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1oc2ccc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)cc2c1N>>Cc1cccc(Nc2oc3ccc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het5Phe
B-H	4634	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1nccc(CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1N>>Cc1cccc(Nc2nccc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het6
B-H	4635	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1c(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)nc2cocc2c1N>>Cc1cccc(Nc2c(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)nc3cocc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het6Het5
B-H	4636	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1ncc2cc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)ncc2c1N>>Cc1cccc(Nc2ncc3cc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)ncc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het6Het6
B-H	4637	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1ncc2ccc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)cc2c1N>>Cc1cccc(Nc2ncc3ccc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_Het6Phe
B-H	4638	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1c(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)cc2cocc2c1N>>Cc1cccc(Nc2c(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)cc3cocc3c2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_PheHet5
B-H	4639	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.Nc1cc2cncc(CCc3cccc(OS(=O)(=O)C(F)(F)F)c3)c2cc1N>>Cc1cccc(Nc2cc3cncc(CCc4cccc(OS(=O)(=O)C(F)(F)F)c4)c3cc2N)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Amine_Primary_PheHet6
B-H	4640	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCc1ccccc1CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(NCc2ccccc2CCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.Benzylamine_primary
B-H	4641	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.NCc1cnccc1CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cccc(NCc2cnccc2CCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Phe.HeteroBenzylamine_primary
B-H	4642	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4643	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4644	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4645	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)C2)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4646	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)C2)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4647	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)C=C2)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4648	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_SaturatedAliphatic
B-H	4649	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_UnsaturatedAliphatic
B-H	4650	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4651	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4652	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4653	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4654	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4655	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4656	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Phe
B-H	4657	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc3cc2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_PhePhe
B-H	4658	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4659	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4660	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4661	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4662	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4663	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)Cc3ccncc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4664	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4665	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4666	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het5
B-H	4667	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)occ3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het5Het5
B-H	4668	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het5Het6
B-H	4669	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het5Phe
B-H	4670	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het6
B-H	4671	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)nc3cocc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het6Het5
B-H	4672	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het6Het6
B-H	4673	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_Het6Phe
B-H	4674	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)cc3cocc3c2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_PheHet5
B-H	4675	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)c3cc2N)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Amine_Primary_PheHet6
B-H	4676	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.Benzylamine_primary
B-H	4677	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PhePhe.HeteroBenzylamine_primary
B-H	4678	Cc1cocc1Br.NCCNCCCCc1cocc1Br>>Cc1cocc1N(CCN)CCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4679	Cc1cocc1Br.NC=CNCCCCc1cocc1Br>>Cc1cocc1N(C=CN)CCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4680	Cc1cocc1Br.NC=CNC=CCCc1cocc1Br>>Cc1cocc1N(C=CN)C=CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4681	Cc1cocc1Br.NC1CNCC(CCc2cocc2Br)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4682	Cc1cocc1Br.Brc1cocc1CCC1CC=CNC1>>Cc1cocc1N1C=CCC(CCc2cocc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4683	Cc1cocc1Br.Brc1cocc1CCC1C=CNC=CC1>>Cc1cocc1N1C=CCC(CCc2cocc2Br)C=C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4684	Cc1cocc1Br.NCCNCCCc1cocc1Br>>Cc1cocc1NCCNCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_SaturatedAliphatic
B-H	4685	Cc1cocc1Br.NC=CNCCCc1cocc1Br>>Cc1cocc1NC=CNCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_UnsaturatedAliphatic
B-H	4686	Cc1cocc1Br.Nc1cccc(CCc2cocc2Br)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4687	Cc1cocc1Br.NCCNc1ccccc1CCCc1cocc1Br>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4688	Cc1cocc1Br.NC=CNc1ccccc1CCc1cocc1Br>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4689	Cc1cocc1Br.Brc1cocc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4690	Cc1cocc1Br.Brc1cocc1Cc1ccc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ccc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4691	Cc1cocc1Br.Brc1cocc1Cc1ccc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4692	Cc1cocc1Br.Nc1cccc(CCc2cocc2Br)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Phe
B-H	4693	Cc1cocc1Br.Nc1cc2ccc(CCc3cocc3Br)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3Br)cc2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_PhePhe
B-H	4694	Cc1cocc1Br.Nc1cncc(CCc2cocc2Br)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4695	Cc1cocc1Br.Nc1cncc(CCc2cocc2Br)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4696	Cc1cocc1Br.NCCNc1ccncc1CCc1cocc1Br>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4697	Cc1cocc1Br.NC=CNc1ccncc1CCc1cocc1Br>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4698	Cc1cocc1Br.Brc1cocc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4699	Cc1cocc1Br.Brc1cocc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2Br)Cc2ccncc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4700	Cc1cocc1Br.Brc1cocc1Cc1cnc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ncc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4701	Cc1cocc1Br.Brc1cocc1Cc1cnc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4702	Cc1cocc1Br.Nc1occ(CCc2cocc2Br)c1N>>Cc1cocc1Nc1occ(CCc2cocc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het5
B-H	4703	Cc1cocc1Br.Nc1oc2c(CCc3cocc3Br)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3Br)occ2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het5Het5
B-H	4704	Cc1cocc1Br.Nc1oc2cc(CCc3cocc3Br)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het5Het6
B-H	4705	Cc1cocc1Br.Nc1oc2ccc(CCc3cocc3Br)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het5Phe
B-H	4706	Cc1cocc1Br.Nc1nccc(CCc2cocc2Br)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het6
B-H	4707	Cc1cocc1Br.Nc1c(Cc2cocc2Br)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Br)nc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het6Het5
B-H	4708	Cc1cocc1Br.Nc1ncc2cc(CCc3cocc3Br)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het6Het6
B-H	4709	Cc1cocc1Br.Nc1ncc2ccc(CCc3cocc3Br)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_Het6Phe
B-H	4710	Cc1cocc1Br.Nc1c(Cc2cocc2Br)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Br)cc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_PheHet5
B-H	4711	Cc1cocc1Br.Nc1cc2cncc(CCc3cocc3Br)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3Br)c2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Amine_Primary_PheHet6
B-H	4712	Cc1cocc1Br.NCc1ccccc1CCCc1cocc1Br>>Cc1cocc1NCc1ccccc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.Benzylamine_primary
B-H	4713	Cc1cocc1Br.NCc1cnccc1CCCc1cocc1Br>>Cc1cocc1NCc1cnccc1CCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5.HeteroBenzylamine_primary
B-H	4714	Cc1c(Br)oc2cocc12.NCCNCCCCc1c(Br)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4715	Cc1c(Br)oc2cocc12.NC=CNCCCCc1c(Br)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4716	Cc1c(Br)oc2cocc12.NC=CNC=CCCc1c(Br)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4717	Cc1c(Br)oc2cocc12.NC1CNCC(CCc2c(Br)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)oc4cocc34)C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4718	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4cocc34)C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4719	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4cocc34)C=C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4720	Cc1c(Br)oc2cocc12.NCCNCCCc1c(Br)oc2cocc12>>Cc1c(NCCNCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_SaturatedAliphatic
B-H	4721	Cc1c(Br)oc2cocc12.NC=CNCCCc1c(Br)oc2cocc12>>Cc1c(NC=CNCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_UnsaturatedAliphatic
B-H	4722	Cc1c(Br)oc2cocc12.Nc1cccc(CCc2c(Br)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4723	Cc1c(Br)oc2cocc12.NCCNc1ccccc1CCCc1c(Br)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4724	Cc1c(Br)oc2cocc12.NC=CNc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4725	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)oc4cocc34)Cc3ccccc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4726	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4727	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4728	Cc1c(Br)oc2cocc12.Nc1cccc(CCc2c(Br)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)oc4cocc34)c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Phe
B-H	4729	Cc1c(Br)oc2cocc12.Nc1cc2ccc(CCc3c(Br)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)oc5cocc45)cc3cc2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_PhePhe
B-H	4730	Cc1c(Br)oc2cocc12.Nc1cncc(CCc2c(Br)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4731	Cc1c(Br)oc2cocc12.Nc1cncc(CCc2c(Br)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4732	Cc1c(Br)oc2cocc12.NCCNc1ccncc1CCc1c(Br)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4733	Cc1c(Br)oc2cocc12.NC=CNc1ccncc1CCc1c(Br)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4734	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)oc4cocc34)Cc3ccccc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4735	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)oc4cocc34)Cc3ccncc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4736	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4737	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4738	Cc1c(Br)oc2cocc12.Nc1occ(CCc2c(Br)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)oc4cocc34)c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het5
B-H	4739	Cc1c(Br)oc2cocc12.Nc1oc2c(CCc3c(Br)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)oc5cocc45)occ3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het5Het5
B-H	4740	Cc1c(Br)oc2cocc12.Nc1oc2cc(CCc3c(Br)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)oc5cocc45)ncc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het5Het6
B-H	4741	Cc1c(Br)oc2cocc12.Nc1oc2ccc(CCc3c(Br)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)oc5cocc45)cc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het5Phe
B-H	4742	Cc1c(Br)oc2cocc12.Nc1nccc(CCc2c(Br)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)oc4cocc34)c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het6
B-H	4743	Cc1c(Br)oc2cocc12.Nc1c(Cc2c(Br)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4cocc34)nc3cocc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het6Het5
B-H	4744	Cc1c(Br)oc2cocc12.Nc1ncc2cc(CCc3c(Br)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)oc5cocc45)ncc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het6Het6
B-H	4745	Cc1c(Br)oc2cocc12.Nc1ncc2ccc(CCc3c(Br)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)oc5cocc45)cc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_Het6Phe
B-H	4746	Cc1c(Br)oc2cocc12.Nc1c(Cc2c(Br)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4cocc34)cc3cocc3c2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_PheHet5
B-H	4747	Cc1c(Br)oc2cocc12.Nc1cc2cncc(CCc3c(Br)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)oc5cocc45)c3cc2N)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Amine_Primary_PheHet6
B-H	4748	Cc1c(Br)oc2cocc12.NCc1ccccc1CCCc1c(Br)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.Benzylamine_primary
B-H	4749	Cc1c(Br)oc2cocc12.NCc1cnccc1CCCc1c(Br)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het5.HeteroBenzylamine_primary
B-H	4750	Cc1c(Br)oc2ccncc12.NCCNCCCCc1c(Br)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4751	Cc1c(Br)oc2ccncc12.NC=CNCCCCc1c(Br)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4752	Cc1c(Br)oc2ccncc12.NC=CNC=CCCc1c(Br)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4753	Cc1c(Br)oc2ccncc12.NC1CNCC(CCc2c(Br)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)oc4ccncc34)C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4754	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4ccncc34)C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4755	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4ccncc34)C=C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4756	Cc1c(Br)oc2ccncc12.NCCNCCCc1c(Br)oc2ccncc12>>Cc1c(NCCNCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_SaturatedAliphatic
B-H	4757	Cc1c(Br)oc2ccncc12.NC=CNCCCc1c(Br)oc2ccncc12>>Cc1c(NC=CNCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_UnsaturatedAliphatic
B-H	4758	Cc1c(Br)oc2ccncc12.Nc1cccc(CCc2c(Br)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4759	Cc1c(Br)oc2ccncc12.NCCNc1ccccc1CCCc1c(Br)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4760	Cc1c(Br)oc2ccncc12.NC=CNc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4761	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4762	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4763	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4764	Cc1c(Br)oc2ccncc12.Nc1cccc(CCc2c(Br)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)oc4ccncc34)c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Phe
B-H	4765	Cc1c(Br)oc2ccncc12.Nc1cc2ccc(CCc3c(Br)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)oc5ccncc45)cc3cc2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_PhePhe
B-H	4766	Cc1c(Br)oc2ccncc12.Nc1cncc(CCc2c(Br)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4767	Cc1c(Br)oc2ccncc12.Nc1cncc(CCc2c(Br)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4768	Cc1c(Br)oc2ccncc12.NCCNc1ccncc1CCc1c(Br)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4769	Cc1c(Br)oc2ccncc12.NC=CNc1ccncc1CCc1c(Br)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4770	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4771	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4772	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4773	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4774	Cc1c(Br)oc2ccncc12.Nc1occ(CCc2c(Br)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)oc4ccncc34)c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het5
B-H	4775	Cc1c(Br)oc2ccncc12.Nc1oc2c(CCc3c(Br)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)oc5ccncc45)occ3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het5Het5
B-H	4776	Cc1c(Br)oc2ccncc12.Nc1oc2cc(CCc3c(Br)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)oc5ccncc45)ncc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het5Het6
B-H	4777	Cc1c(Br)oc2ccncc12.Nc1oc2ccc(CCc3c(Br)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)oc5ccncc45)cc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het5Phe
B-H	4778	Cc1c(Br)oc2ccncc12.Nc1nccc(CCc2c(Br)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)oc4ccncc34)c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het6
B-H	4779	Cc1c(Br)oc2ccncc12.Nc1c(Cc2c(Br)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het6Het5
B-H	4780	Cc1c(Br)oc2ccncc12.Nc1ncc2cc(CCc3c(Br)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)oc5ccncc45)ncc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het6Het6
B-H	4781	Cc1c(Br)oc2ccncc12.Nc1ncc2ccc(CCc3c(Br)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)oc5ccncc45)cc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_Het6Phe
B-H	4782	Cc1c(Br)oc2ccncc12.Nc1c(Cc2c(Br)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_PheHet5
B-H	4783	Cc1c(Br)oc2ccncc12.Nc1cc2cncc(CCc3c(Br)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)oc5ccncc45)c3cc2N)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Amine_Primary_PheHet6
B-H	4784	Cc1c(Br)oc2ccncc12.NCc1ccccc1CCCc1c(Br)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.Benzylamine_primary
B-H	4785	Cc1c(Br)oc2ccncc12.NCc1cnccc1CCCc1c(Br)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Het6.HeteroBenzylamine_primary
B-H	4786	Cc1c(Br)oc2ccccc12.NCCNCCCCc1c(Br)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4787	Cc1c(Br)oc2ccccc12.NC=CNCCCCc1c(Br)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4788	Cc1c(Br)oc2ccccc12.NC=CNC=CCCc1c(Br)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4789	Cc1c(Br)oc2ccccc12.NC1CNCC(CCc2c(Br)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)oc4ccccc34)C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4790	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4ccccc34)C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4791	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)oc4ccccc34)C=C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4792	Cc1c(Br)oc2ccccc12.NCCNCCCc1c(Br)oc2ccccc12>>Cc1c(NCCNCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_SaturatedAliphatic
B-H	4793	Cc1c(Br)oc2ccccc12.NC=CNCCCc1c(Br)oc2ccccc12>>Cc1c(NC=CNCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_UnsaturatedAliphatic
B-H	4794	Cc1c(Br)oc2ccccc12.Nc1cccc(CCc2c(Br)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4795	Cc1c(Br)oc2ccccc12.NCCNc1ccccc1CCCc1c(Br)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4796	Cc1c(Br)oc2ccccc12.NC=CNc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4797	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4798	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4799	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4800	Cc1c(Br)oc2ccccc12.Nc1cccc(CCc2c(Br)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)oc4ccccc34)c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Phe
B-H	4801	Cc1c(Br)oc2ccccc12.Nc1cc2ccc(CCc3c(Br)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)oc5ccccc45)cc3cc2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_PhePhe
B-H	4802	Cc1c(Br)oc2ccccc12.Nc1cncc(CCc2c(Br)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4803	Cc1c(Br)oc2ccccc12.Nc1cncc(CCc2c(Br)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4804	Cc1c(Br)oc2ccccc12.NCCNc1ccncc1CCc1c(Br)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4805	Cc1c(Br)oc2ccccc12.NC=CNc1ccncc1CCc1c(Br)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4806	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4807	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4808	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4809	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4810	Cc1c(Br)oc2ccccc12.Nc1occ(CCc2c(Br)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)oc4ccccc34)c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het5
B-H	4811	Cc1c(Br)oc2ccccc12.Nc1oc2c(CCc3c(Br)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)oc5ccccc45)occ3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het5Het5
B-H	4812	Cc1c(Br)oc2ccccc12.Nc1oc2cc(CCc3c(Br)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)oc5ccccc45)ncc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het5Het6
B-H	4813	Cc1c(Br)oc2ccccc12.Nc1oc2ccc(CCc3c(Br)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)oc5ccccc45)cc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het5Phe
B-H	4814	Cc1c(Br)oc2ccccc12.Nc1nccc(CCc2c(Br)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)oc4ccccc34)c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het6
B-H	4815	Cc1c(Br)oc2ccccc12.Nc1c(Cc2c(Br)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het6Het5
B-H	4816	Cc1c(Br)oc2ccccc12.Nc1ncc2cc(CCc3c(Br)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)oc5ccccc45)ncc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het6Het6
B-H	4817	Cc1c(Br)oc2ccccc12.Nc1ncc2ccc(CCc3c(Br)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)oc5ccccc45)cc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_Het6Phe
B-H	4818	Cc1c(Br)oc2ccccc12.Nc1c(Cc2c(Br)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_PheHet5
B-H	4819	Cc1c(Br)oc2ccccc12.Nc1cc2cncc(CCc3c(Br)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)oc5ccccc45)c3cc2N)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Amine_Primary_PheHet6
B-H	4820	Cc1c(Br)oc2ccccc12.NCc1ccccc1CCCc1c(Br)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.Benzylamine_primary
B-H	4821	Cc1c(Br)oc2ccccc12.NCc1cnccc1CCCc1c(Br)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het5Phe.HeteroBenzylamine_primary
B-H	4822	Cc1cnccc1Br.NCCNCCCCc1cnccc1Br>>Cc1cnccc1N(CCN)CCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4823	Cc1cnccc1Br.NC=CNCCCCc1cnccc1Br>>Cc1cnccc1N(C=CN)CCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4824	Cc1cnccc1Br.NC=CNC=CCCc1cnccc1Br>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4825	Cc1cnccc1Br.NC1CNCC(CCc2cnccc2Br)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4826	Cc1cnccc1Br.Brc1ccncc1CCC1CC=CNC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4827	Cc1cnccc1Br.Brc1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Br)C=C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4828	Cc1cnccc1Br.NCCNCCCc1cnccc1Br>>Cc1cnccc1NCCNCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_SaturatedAliphatic
B-H	4829	Cc1cnccc1Br.NC=CNCCCc1cnccc1Br>>Cc1cnccc1NC=CNCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_UnsaturatedAliphatic
B-H	4830	Cc1cnccc1Br.Nc1cccc(CCc2cnccc2Br)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4831	Cc1cnccc1Br.NCCNc1ccccc1CCCc1cnccc1Br>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4832	Cc1cnccc1Br.NC=CNc1ccccc1CCc1cnccc1Br>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4833	Cc1cnccc1Br.Brc1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4834	Cc1cnccc1Br.Brc1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4835	Cc1cnccc1Br.Brc1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4836	Cc1cnccc1Br.Nc1cccc(CCc2cnccc2Br)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Phe
B-H	4837	Cc1cnccc1Br.Nc1cc2ccc(CCc3cnccc3Br)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3Br)cc2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_PhePhe
B-H	4838	Cc1cnccc1Br.Nc1cncc(CCc2cnccc2Br)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4839	Cc1cnccc1Br.Nc1cncc(CCc2cnccc2Br)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4840	Cc1cnccc1Br.NCCNc1ccncc1CCc1cnccc1Br>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4841	Cc1cnccc1Br.NC=CNc1ccncc1CCc1cnccc1Br>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4842	Cc1cnccc1Br.Brc1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4843	Cc1cnccc1Br.Brc1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2Br)Cc2ccncc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4844	Cc1cnccc1Br.Brc1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4845	Cc1cnccc1Br.Brc1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4846	Cc1cnccc1Br.Nc1occ(CCc2cnccc2Br)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het5
B-H	4847	Cc1cnccc1Br.Nc1oc2c(CCc3cnccc3Br)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3Br)occ2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het5Het5
B-H	4848	Cc1cnccc1Br.Nc1oc2cc(CCc3cnccc3Br)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het5Het6
B-H	4849	Cc1cnccc1Br.Nc1oc2ccc(CCc3cnccc3Br)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het5Phe
B-H	4850	Cc1cnccc1Br.Nc1nccc(CCc2cnccc2Br)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het6
B-H	4851	Cc1cnccc1Br.Nc1c(Cc2cnccc2Br)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Br)nc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het6Het5
B-H	4852	Cc1cnccc1Br.Nc1ncc2cc(CCc3cnccc3Br)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het6Het6
B-H	4853	Cc1cnccc1Br.Nc1ncc2ccc(CCc3cnccc3Br)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_Het6Phe
B-H	4854	Cc1cnccc1Br.Nc1c(Cc2cnccc2Br)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Br)cc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_PheHet5
B-H	4855	Cc1cnccc1Br.Nc1cc2cncc(CCc3cnccc3Br)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3Br)c2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Amine_Primary_PheHet6
B-H	4856	Cc1cnccc1Br.NCc1ccccc1CCCc1cnccc1Br>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.Benzylamine_primary
B-H	4857	Cc1cnccc1Br.NCc1cnccc1CCCc1cnccc1Br>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6.HeteroBenzylamine_primary
B-H	4858	Cc1nc2cocc2cc1Br.NCCNCCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4859	Cc1nc2cocc2cc1Br.NC=CNCCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4860	Cc1nc2cocc2cc1Br.NC=CNC=CCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4861	Cc1nc2cocc2cc1Br.NC1CNCC(CCc2nc3cocc3cc2Br)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4862	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CCC1CC=CNC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4863	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CCC1C=CNC=CC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Br)C=C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4864	Cc1nc2cocc2cc1Br.NCCNCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_SaturatedAliphatic
B-H	4865	Cc1nc2cocc2cc1Br.NC=CNCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_UnsaturatedAliphatic
B-H	4866	Cc1nc2cocc2cc1Br.Nc1cccc(CCc2nc3cocc3cc2Br)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4867	Cc1nc2cocc2cc1Br.NCCNc1ccccc1CCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4868	Cc1nc2cocc2cc1Br.NC=CNc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4869	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4870	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1ccc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4871	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4872	Cc1nc2cocc2cc1Br.Nc1cccc(CCc2nc3cocc3cc2Br)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Phe
B-H	4873	Cc1nc2cocc2cc1Br.Nc1cc2ccc(CCc3nc4cocc4cc3Br)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3Br)cc2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_PhePhe
B-H	4874	Cc1nc2cocc2cc1Br.Nc1cncc(CCc2nc3cocc3cc2Br)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4875	Cc1nc2cocc2cc1Br.Nc1cncc(CCc2nc3cocc3cc2Br)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4876	Cc1nc2cocc2cc1Br.NCCNc1ccncc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4877	Cc1nc2cocc2cc1Br.NC=CNc1ccncc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4878	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4879	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2Br)Cc2ccncc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4880	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1cnc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4881	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4882	Cc1nc2cocc2cc1Br.Nc1occ(CCc2nc3cocc3cc2Br)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het5
B-H	4883	Cc1nc2cocc2cc1Br.Nc1oc2c(CCc3nc4cocc4cc3Br)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3Br)occ2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het5Het5
B-H	4884	Cc1nc2cocc2cc1Br.Nc1oc2cc(CCc3nc4cocc4cc3Br)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het5Het6
B-H	4885	Cc1nc2cocc2cc1Br.Nc1oc2ccc(CCc3nc4cocc4cc3Br)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het5Phe
B-H	4886	Cc1nc2cocc2cc1Br.Nc1nccc(CCc2nc3cocc3cc2Br)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het6
B-H	4887	Cc1nc2cocc2cc1Br.Nc1c(Cc2nc3cocc3cc2Br)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Br)nc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het6Het5
B-H	4888	Cc1nc2cocc2cc1Br.Nc1ncc2cc(CCc3nc4cocc4cc3Br)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het6Het6
B-H	4889	Cc1nc2cocc2cc1Br.Nc1ncc2ccc(CCc3nc4cocc4cc3Br)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_Het6Phe
B-H	4890	Cc1nc2cocc2cc1Br.Nc1c(Cc2nc3cocc3cc2Br)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Br)cc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_PheHet5
B-H	4891	Cc1nc2cocc2cc1Br.Nc1cc2cncc(CCc3nc4cocc4cc3Br)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3Br)c2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Amine_Primary_PheHet6
B-H	4892	Cc1nc2cocc2cc1Br.NCc1ccccc1CCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.Benzylamine_primary
B-H	4893	Cc1nc2cocc2cc1Br.NCc1cnccc1CCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het5.HeteroBenzylamine_primary
B-H	4894	Cc1c(Br)ncc2ccncc12.NCCNCCCCc1c(Br)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4895	Cc1c(Br)ncc2ccncc12.NC=CNCCCCc1c(Br)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4896	Cc1c(Br)ncc2ccncc12.NC=CNC=CCCc1c(Br)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4897	Cc1c(Br)ncc2ccncc12.NC1CNCC(CCc2c(Br)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)ncc4ccncc34)C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4898	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)ncc4ccncc34)C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4899	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)ncc4ccncc34)C=C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4900	Cc1c(Br)ncc2ccncc12.NCCNCCCc1c(Br)ncc2ccncc12>>Cc1c(NCCNCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_SaturatedAliphatic
B-H	4901	Cc1c(Br)ncc2ccncc12.NC=CNCCCc1c(Br)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_UnsaturatedAliphatic
B-H	4902	Cc1c(Br)ncc2ccncc12.Nc1cccc(CCc2c(Br)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4903	Cc1c(Br)ncc2ccncc12.NCCNc1ccccc1CCCc1c(Br)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4904	Cc1c(Br)ncc2ccncc12.NC=CNc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4905	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4906	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4907	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4908	Cc1c(Br)ncc2ccncc12.Nc1cccc(CCc2c(Br)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)ncc4ccncc34)c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Phe
B-H	4909	Cc1c(Br)ncc2ccncc12.Nc1cc2ccc(CCc3c(Br)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_PhePhe
B-H	4910	Cc1c(Br)ncc2ccncc12.Nc1cncc(CCc2c(Br)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4911	Cc1c(Br)ncc2ccncc12.Nc1cncc(CCc2c(Br)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4912	Cc1c(Br)ncc2ccncc12.NCCNc1ccncc1CCc1c(Br)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4913	Cc1c(Br)ncc2ccncc12.NC=CNc1ccncc1CCc1c(Br)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4914	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4915	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4916	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4917	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4918	Cc1c(Br)ncc2ccncc12.Nc1occ(CCc2c(Br)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)ncc4ccncc34)c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het5
B-H	4919	Cc1c(Br)ncc2ccncc12.Nc1oc2c(CCc3c(Br)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)ncc5ccncc45)occ3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het5Het5
B-H	4920	Cc1c(Br)ncc2ccncc12.Nc1oc2cc(CCc3c(Br)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het5Het6
B-H	4921	Cc1c(Br)ncc2ccncc12.Nc1oc2ccc(CCc3c(Br)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het5Phe
B-H	4922	Cc1c(Br)ncc2ccncc12.Nc1nccc(CCc2c(Br)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)ncc4ccncc34)c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het6
B-H	4923	Cc1c(Br)ncc2ccncc12.Nc1c(Cc2c(Br)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het6Het5
B-H	4924	Cc1c(Br)ncc2ccncc12.Nc1ncc2cc(CCc3c(Br)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het6Het6
B-H	4925	Cc1c(Br)ncc2ccncc12.Nc1ncc2ccc(CCc3c(Br)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_Het6Phe
B-H	4926	Cc1c(Br)ncc2ccncc12.Nc1c(Cc2c(Br)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_PheHet5
B-H	4927	Cc1c(Br)ncc2ccncc12.Nc1cc2cncc(CCc3c(Br)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)ncc5ccncc45)c3cc2N)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Amine_Primary_PheHet6
B-H	4928	Cc1c(Br)ncc2ccncc12.NCc1ccccc1CCCc1c(Br)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.Benzylamine_primary
B-H	4929	Cc1c(Br)ncc2ccncc12.NCc1cnccc1CCCc1c(Br)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Het6.HeteroBenzylamine_primary
B-H	4930	Cc1c(Br)ncc2ccccc12.NCCNCCCCc1c(Br)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4931	Cc1c(Br)ncc2ccccc12.NC=CNCCCCc1c(Br)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4932	Cc1c(Br)ncc2ccccc12.NC=CNC=CCCc1c(Br)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4933	Cc1c(Br)ncc2ccccc12.NC1CNCC(CCc2c(Br)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Br)ncc4ccccc34)C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4934	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Br)ncc4ccccc34)C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4935	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Br)ncc4ccccc34)C=C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4936	Cc1c(Br)ncc2ccccc12.NCCNCCCc1c(Br)ncc2ccccc12>>Cc1c(NCCNCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_SaturatedAliphatic
B-H	4937	Cc1c(Br)ncc2ccccc12.NC=CNCCCc1c(Br)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_UnsaturatedAliphatic
B-H	4938	Cc1c(Br)ncc2ccccc12.Nc1cccc(CCc2c(Br)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4939	Cc1c(Br)ncc2ccccc12.NCCNc1ccccc1CCCc1c(Br)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4940	Cc1c(Br)ncc2ccccc12.NC=CNc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4941	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Br)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4942	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4943	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4944	Cc1c(Br)ncc2ccccc12.Nc1cccc(CCc2c(Br)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Br)ncc4ccccc34)c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Phe
B-H	4945	Cc1c(Br)ncc2ccccc12.Nc1cc2ccc(CCc3c(Br)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Br)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_PhePhe
B-H	4946	Cc1c(Br)ncc2ccccc12.Nc1cncc(CCc2c(Br)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4947	Cc1c(Br)ncc2ccccc12.Nc1cncc(CCc2c(Br)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4948	Cc1c(Br)ncc2ccccc12.NCCNc1ccncc1CCc1c(Br)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4949	Cc1c(Br)ncc2ccccc12.NC=CNc1ccncc1CCc1c(Br)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4950	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Br)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4951	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Br)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4952	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4953	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4954	Cc1c(Br)ncc2ccccc12.Nc1occ(CCc2c(Br)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Br)ncc4ccccc34)c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het5
B-H	4955	Cc1c(Br)ncc2ccccc12.Nc1oc2c(CCc3c(Br)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Br)ncc5ccccc45)occ3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het5Het5
B-H	4956	Cc1c(Br)ncc2ccccc12.Nc1oc2cc(CCc3c(Br)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Br)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het5Het6
B-H	4957	Cc1c(Br)ncc2ccccc12.Nc1oc2ccc(CCc3c(Br)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Br)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het5Phe
B-H	4958	Cc1c(Br)ncc2ccccc12.Nc1nccc(CCc2c(Br)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Br)ncc4ccccc34)c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het6
B-H	4959	Cc1c(Br)ncc2ccccc12.Nc1c(Cc2c(Br)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het6Het5
B-H	4960	Cc1c(Br)ncc2ccccc12.Nc1ncc2cc(CCc3c(Br)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Br)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het6Het6
B-H	4961	Cc1c(Br)ncc2ccccc12.Nc1ncc2ccc(CCc3c(Br)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Br)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_Het6Phe
B-H	4962	Cc1c(Br)ncc2ccccc12.Nc1c(Cc2c(Br)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Br)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_PheHet5
B-H	4963	Cc1c(Br)ncc2ccccc12.Nc1cc2cncc(CCc3c(Br)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Br)ncc5ccccc45)c3cc2N)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Amine_Primary_PheHet6
B-H	4964	Cc1c(Br)ncc2ccccc12.NCc1ccccc1CCCc1c(Br)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.Benzylamine_primary
B-H	4965	Cc1c(Br)ncc2ccccc12.NCc1cnccc1CCCc1c(Br)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_Het6Phe.HeteroBenzylamine_primary
B-H	4966	Cc1cc2cocc2cc1Br.NCCNCCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(CCN)CCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4967	Cc1cc2cocc2cc1Br.NC=CNCCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(C=CN)CCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4968	Cc1cc2cocc2cc1Br.NC=CNC=CCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(C=CN)C=CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4969	Cc1cc2cocc2cc1Br.NC1CNCC(CCc2cc3cocc3cc2Br)C1>>Cc1cc2cocc2cc1N1CC(N)CC(CCc2cc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	4970	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CCC1CC=CNC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	4971	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CCC1C=CNC=CC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2Br)C=C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	4972	Cc1cc2cocc2cc1Br.NCCNCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1NCCNCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_SaturatedAliphatic
B-H	4973	Cc1cc2cocc2cc1Br.NC=CNCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1NC=CNCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_UnsaturatedAliphatic
B-H	4974	Cc1cc2cocc2cc1Br.Nc1cccc(CCc2cc3cocc3cc2Br)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	4975	Cc1cc2cocc2cc1Br.NCCNc1ccccc1CCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(CCN)c1ccccc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4976	Cc1cc2cocc2cc1Br.NC=CNc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(C=CN)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4977	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2ccccc2CCC(Cc2cc3cocc3cc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	4978	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1ccc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ccc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	4979	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1ccc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ccc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	4980	Cc1cc2cocc2cc1Br.Nc1cccc(CCc2cc3cocc3cc2Br)c1N>>Cc1cc2cocc2cc1Nc1cccc(CCc2cc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Phe
B-H	4981	Cc1cc2cocc2cc1Br.Nc1cc2ccc(CCc3cc4cocc4cc3Br)cc2cc1N>>Cc1cc2cocc2cc1Nc1cc2ccc(CCc3cc4cocc4cc3Br)cc2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_PhePhe
B-H	4982	Cc1cc2cocc2cc1Br.Nc1cncc(CCc2cc3cocc3cc2Br)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	4983	Cc1cc2cocc2cc1Br.Nc1cncc(CCc2cc3cocc3cc2Br)c1Nc1cccnc1>>Cc1cc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4984	Cc1cc2cocc2cc1Br.NCCNc1ccncc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(CCN)c1ccncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4985	Cc1cc2cocc2cc1Br.NC=CNc1ccncc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1N(C=CN)c1ccncc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4986	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2cnccc2CCC(Cc2cc3cocc3cc2Br)Cc2ccccc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	4987	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cc2cocc2cc1N1c2ccncc2CCC(Cc2cc3cocc3cc2Br)Cc2ccncc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	4988	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cnc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ncc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	4989	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cnc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ncc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	4990	Cc1cc2cocc2cc1Br.Nc1occ(CCc2cc3cocc3cc2Br)c1N>>Cc1cc2cocc2cc1Nc1occ(CCc2cc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het5
B-H	4991	Cc1cc2cocc2cc1Br.Nc1oc2c(CCc3cc4cocc4cc3Br)occ2c1N>>Cc1cc2cocc2cc1Nc1oc2c(CCc3cc4cocc4cc3Br)occ2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het5Het5
B-H	4992	Cc1cc2cocc2cc1Br.Nc1oc2cc(CCc3cc4cocc4cc3Br)ncc2c1N>>Cc1cc2cocc2cc1Nc1oc2cc(CCc3cc4cocc4cc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het5Het6
B-H	4993	Cc1cc2cocc2cc1Br.Nc1oc2ccc(CCc3cc4cocc4cc3Br)cc2c1N>>Cc1cc2cocc2cc1Nc1oc2ccc(CCc3cc4cocc4cc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het5Phe
B-H	4994	Cc1cc2cocc2cc1Br.Nc1nccc(CCc2cc3cocc3cc2Br)c1N>>Cc1cc2cocc2cc1Nc1nccc(CCc2cc3cocc3cc2Br)c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het6
B-H	4995	Cc1cc2cocc2cc1Br.Nc1c(Cc2cc3cocc3cc2Br)nc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2Br)nc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het6Het5
B-H	4996	Cc1cc2cocc2cc1Br.Nc1ncc2cc(CCc3cc4cocc4cc3Br)ncc2c1N>>Cc1cc2cocc2cc1Nc1ncc2cc(CCc3cc4cocc4cc3Br)ncc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het6Het6
B-H	4997	Cc1cc2cocc2cc1Br.Nc1ncc2ccc(CCc3cc4cocc4cc3Br)cc2c1N>>Cc1cc2cocc2cc1Nc1ncc2ccc(CCc3cc4cocc4cc3Br)cc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_Het6Phe
B-H	4998	Cc1cc2cocc2cc1Br.Nc1c(Cc2cc3cocc3cc2Br)cc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2Br)cc2cocc2c1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_PheHet5
B-H	4999	Cc1cc2cocc2cc1Br.Nc1cc2cncc(CCc3cc4cocc4cc3Br)c2cc1N>>Cc1cc2cocc2cc1Nc1cc2cncc(CCc3cc4cocc4cc3Br)c2cc1N	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Amine_Primary_PheHet6
B-H	5000	Cc1cc2cocc2cc1Br.NCc1ccccc1CCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1NCc1ccccc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.Benzylamine_primary
B-H	5001	Cc1cc2cocc2cc1Br.NCc1cnccc1CCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1NCc1cnccc1CCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet5.HeteroBenzylamine_primary
B-H	5002	CCc1c(Br)ccc2ccncc12.NCCNCCCCCc1c(Br)ccc2ccncc12>>CCc1c(N(CCN)CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5003	CCc1c(Br)ccc2ccncc12.NC=CNCCCCCc1c(Br)ccc2ccncc12>>CCc1c(N(C=CN)CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5004	CCc1c(Br)ccc2ccncc12.NC=CNC=CCCCc1c(Br)ccc2ccncc12>>CCc1c(N(C=CN)C=CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5005	CCc1c(Br)ccc2ccncc12.NC1CNCC(CCCc2c(Br)ccc3ccncc23)C1>>CCc1c(N2CC(N)CC(CCCc3c(Br)ccc4ccncc34)C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5006	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCCC1CC=CNC1>>CCc1c(N2C=CCC(CCCc3c(Br)ccc4ccncc34)C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5007	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCCC1C=CNC=CC1>>CCc1c(N2C=CCC(CCCc3c(Br)ccc4ccncc34)C=C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5008	CCc1c(Br)ccc2ccncc12.NCCNCCCCc1c(Br)ccc2ccncc12>>CCc1c(NCCNCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_SaturatedAliphatic
B-H	5009	CCc1c(Br)ccc2ccncc12.NC=CNCCCCc1c(Br)ccc2ccncc12>>CCc1c(NC=CNCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_UnsaturatedAliphatic
B-H	5010	CCc1c(Br)ccc2ccncc12.Nc1cccc(CCCc2c(Br)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5011	CCc1c(Br)ccc2ccncc12.NCCNc1ccccc1CCCCc1c(Br)ccc2ccncc12>>CCc1c(N(CCN)c2ccccc2CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5012	CCc1c(Br)ccc2ccncc12.NC=CNc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(N(C=CN)c2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5013	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1c(N2c3ccccc3CCC(CCc3c(Br)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5014	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1ccc2c(c1)NCCC2>>CCc1c(N2CCCc3ccc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5015	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1ccc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ccc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5016	CCc1c(Br)ccc2ccncc12.Nc1cccc(CCCc2c(Br)ccc3ccncc23)c1N>>CCc1c(Nc2cccc(CCCc3c(Br)ccc4ccncc34)c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Phe
B-H	5017	CCc1c(Br)ccc2ccncc12.Nc1cc2ccc(CCCc3c(Br)ccc4ccncc34)cc2cc1N>>CCc1c(Nc2cc3ccc(CCCc4c(Br)ccc5ccncc45)cc3cc2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_PhePhe
B-H	5018	CCc1c(Br)ccc2ccncc12.Nc1cncc(CCCc2c(Br)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cncc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5019	CCc1c(Br)ccc2ccncc12.Nc1cncc(CCCc2c(Br)ccc3ccncc23)c1Nc1cccnc1>>CCc1c(N(c2cccnc2)c2c(N)cncc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5020	CCc1c(Br)ccc2ccncc12.NCCNc1ccncc1CCCc1c(Br)ccc2ccncc12>>CCc1c(N(CCN)c2ccncc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5021	CCc1c(Br)ccc2ccncc12.NC=CNc1ccncc1CCCc1c(Br)ccc2ccncc12>>CCc1c(N(C=CN)c2ccncc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5022	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1c(N2c3cnccc3CCC(CCc3c(Br)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5023	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1c(N2c3ccncc3CCC(CCc3c(Br)ccc4ccncc34)Cc3ccncc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5024	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1cnc2c(c1)NCCC2>>CCc1c(N2CCCc3ncc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5025	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1cnc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ncc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Bromide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5026	CCc1c(Br)ccc2ccncc12.Nc1occ(CCCc2c(Br)ccc3ccncc23)c1N>>CCc1c(Nc2occ(CCCc3c(Br)ccc4ccncc34)c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het5
B-H	5027	CCc1c(Br)ccc2ccncc12.Nc1oc2c(CCCc3c(Br)ccc4ccncc34)occ2c1N>>CCc1c(Nc2oc3c(CCCc4c(Br)ccc5ccncc45)occ3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het5Het5
B-H	5028	CCc1c(Br)ccc2ccncc12.Nc1oc2cc(CCCc3c(Br)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2oc3cc(CCCc4c(Br)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het5Het6
B-H	5029	CCc1c(Br)ccc2ccncc12.Nc1oc2ccc(CCCc3c(Br)ccc4ccncc34)cc2c1N>>CCc1c(Nc2oc3ccc(CCCc4c(Br)ccc5ccncc45)cc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het5Phe
B-H	5030	CCc1c(Br)ccc2ccncc12.Nc1nccc(CCCc2c(Br)ccc3ccncc23)c1N>>CCc1c(Nc2nccc(CCCc3c(Br)ccc4ccncc34)c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het6
B-H	5031	CCc1c(Br)ccc2ccncc12.Nc1c(CCc2c(Br)ccc3ccncc23)nc2cocc2c1N>>CCc1c(Nc2c(CCc3c(Br)ccc4ccncc34)nc3cocc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het6Het5
B-H	5032	CCc1c(Br)ccc2ccncc12.Nc1ncc2cc(CCCc3c(Br)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2ncc3cc(CCCc4c(Br)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het6Het6
B-H	5033	CCc1c(Br)ccc2ccncc12.Nc1ncc2ccc(CCCc3c(Br)ccc4ccncc34)cc2c1N>>CCc1c(Nc2ncc3ccc(CCCc4c(Br)ccc5ccncc45)cc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_Het6Phe
B-H	5034	CCc1c(Br)ccc2ccncc12.Nc1c(CCc2c(Br)ccc3ccncc23)cc2cocc2c1N>>CCc1c(Nc2c(CCc3c(Br)ccc4ccncc34)cc3cocc3c2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_PheHet5
B-H	5035	CCc1c(Br)ccc2ccncc12.Nc1cc2cncc(CCCc3c(Br)ccc4ccncc34)c2cc1N>>CCc1c(Nc2cc3cncc(CCCc4c(Br)ccc5ccncc45)c3cc2N)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Amine_Primary_PheHet6
B-H	5036	CCc1c(Br)ccc2ccncc12.NCc1ccccc1CCCCc1c(Br)ccc2ccncc12>>CCc1c(NCc2ccccc2CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.Benzylamine_primary
B-H	5037	CCc1c(Br)ccc2ccncc12.NCc1cnccc1CCCCc1c(Br)ccc2ccncc12>>CCc1c(NCc2cnccc2CCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Bromide_PheHet6.HeteroBenzylamine_primary
B-H	5038	Cc1cocc1Cl.NCCNCCCCc1cocc1Cl>>Cc1cocc1N(CCN)CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5039	Cc1cocc1Cl.NC=CNCCCCc1cocc1Cl>>Cc1cocc1N(C=CN)CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5040	Cc1cocc1Cl.NC=CNC=CCCc1cocc1Cl>>Cc1cocc1N(C=CN)C=CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5041	Cc1cocc1Cl.NC1CNCC(CCc2cocc2Cl)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5042	Cc1cocc1Cl.Clc1cocc1CCC1CC=CNC1>>Cc1cocc1N1C=CCC(CCc2cocc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5043	Cc1cocc1Cl.Clc1cocc1CCC1C=CNC=CC1>>Cc1cocc1N1C=CCC(CCc2cocc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5044	Cc1cocc1Cl.NCCNCCCc1cocc1Cl>>Cc1cocc1NCCNCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_SaturatedAliphatic
B-H	5045	Cc1cocc1Cl.NC=CNCCCc1cocc1Cl>>Cc1cocc1NC=CNCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5046	Cc1cocc1Cl.Nc1cccc(CCc2cocc2Cl)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5047	Cc1cocc1Cl.NCCNc1ccccc1CCCc1cocc1Cl>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5048	Cc1cocc1Cl.NC=CNc1ccccc1CCc1cocc1Cl>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5049	Cc1cocc1Cl.Clc1cocc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5050	Cc1cocc1Cl.Clc1cocc1Cc1ccc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ccc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5051	Cc1cocc1Cl.Clc1cocc1Cc1ccc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5052	Cc1cocc1Cl.Nc1cccc(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Phe
B-H	5053	Cc1cocc1Cl.Nc1cc2ccc(CCc3cocc3Cl)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PhePhe
B-H	5054	Cc1cocc1Cl.Nc1cncc(CCc2cocc2Cl)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5055	Cc1cocc1Cl.Nc1cncc(CCc2cocc2Cl)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5056	Cc1cocc1Cl.NCCNc1ccncc1CCc1cocc1Cl>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5057	Cc1cocc1Cl.NC=CNc1ccncc1CCc1cocc1Cl>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5058	Cc1cocc1Cl.Clc1cocc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5059	Cc1cocc1Cl.Clc1cocc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5060	Cc1cocc1Cl.Clc1cocc1Cc1cnc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ncc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5061	Cc1cocc1Cl.Clc1cocc1Cc1cnc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5062	Cc1cocc1Cl.Nc1occ(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1occ(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5
B-H	5063	Cc1cocc1Cl.Nc1oc2c(CCc3cocc3Cl)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Het5
B-H	5064	Cc1cocc1Cl.Nc1oc2cc(CCc3cocc3Cl)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Het6
B-H	5065	Cc1cocc1Cl.Nc1oc2ccc(CCc3cocc3Cl)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Phe
B-H	5066	Cc1cocc1Cl.Nc1nccc(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6
B-H	5067	Cc1cocc1Cl.Nc1c(Cc2cocc2Cl)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Het5
B-H	5068	Cc1cocc1Cl.Nc1ncc2cc(CCc3cocc3Cl)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Het6
B-H	5069	Cc1cocc1Cl.Nc1ncc2ccc(CCc3cocc3Cl)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Phe
B-H	5070	Cc1cocc1Cl.Nc1c(Cc2cocc2Cl)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PheHet5
B-H	5071	Cc1cocc1Cl.Nc1cc2cncc(CCc3cocc3Cl)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PheHet6
B-H	5072	Cc1cocc1Cl.NCc1ccccc1CCCc1cocc1Cl>>Cc1cocc1NCc1ccccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Benzylamine_primary
B-H	5073	Cc1cocc1Cl.NCc1cnccc1CCCc1cocc1Cl>>Cc1cocc1NCc1cnccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.HeteroBenzylamine_primary
B-H	5074	Cc1c(Cl)oc2cocc12.NCCNCCCCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5075	Cc1c(Cl)oc2cocc12.NC=CNCCCCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5076	Cc1c(Cl)oc2cocc12.NC=CNC=CCCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5077	Cc1c(Cl)oc2cocc12.NC1CNCC(CCc2c(Cl)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4cocc34)C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5078	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4cocc34)C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5079	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4cocc34)C=C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5080	Cc1c(Cl)oc2cocc12.NCCNCCCc1c(Cl)oc2cocc12>>Cc1c(NCCNCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_SaturatedAliphatic
B-H	5081	Cc1c(Cl)oc2cocc12.NC=CNCCCc1c(Cl)oc2cocc12>>Cc1c(NC=CNCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5082	Cc1c(Cl)oc2cocc12.Nc1cccc(CCc2c(Cl)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5083	Cc1c(Cl)oc2cocc12.NCCNc1ccccc1CCCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5084	Cc1c(Cl)oc2cocc12.NC=CNc1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5085	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccccc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5086	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5087	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5088	Cc1c(Cl)oc2cocc12.Nc1cccc(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Phe
B-H	5089	Cc1c(Cl)oc2cocc12.Nc1cc2ccc(CCc3c(Cl)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5cocc45)cc3cc2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PhePhe
B-H	5090	Cc1c(Cl)oc2cocc12.Nc1cncc(CCc2c(Cl)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5091	Cc1c(Cl)oc2cocc12.Nc1cncc(CCc2c(Cl)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5092	Cc1c(Cl)oc2cocc12.NCCNc1ccncc1CCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5093	Cc1c(Cl)oc2cocc12.NC=CNc1ccncc1CCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5094	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccccc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5095	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccncc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5096	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5097	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5098	Cc1c(Cl)oc2cocc12.Nc1occ(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5
B-H	5099	Cc1c(Cl)oc2cocc12.Nc1oc2c(CCc3c(Cl)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5cocc45)occ3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Het5
B-H	5100	Cc1c(Cl)oc2cocc12.Nc1oc2cc(CCc3c(Cl)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5cocc45)ncc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Het6
B-H	5101	Cc1c(Cl)oc2cocc12.Nc1oc2ccc(CCc3c(Cl)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5cocc45)cc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Phe
B-H	5102	Cc1c(Cl)oc2cocc12.Nc1nccc(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6
B-H	5103	Cc1c(Cl)oc2cocc12.Nc1c(Cc2c(Cl)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4cocc34)nc3cocc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Het5
B-H	5104	Cc1c(Cl)oc2cocc12.Nc1ncc2cc(CCc3c(Cl)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5cocc45)ncc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Het6
B-H	5105	Cc1c(Cl)oc2cocc12.Nc1ncc2ccc(CCc3c(Cl)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5cocc45)cc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Phe
B-H	5106	Cc1c(Cl)oc2cocc12.Nc1c(Cc2c(Cl)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4cocc34)cc3cocc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PheHet5
B-H	5107	Cc1c(Cl)oc2cocc12.Nc1cc2cncc(CCc3c(Cl)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5cocc45)c3cc2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PheHet6
B-H	5108	Cc1c(Cl)oc2cocc12.NCc1ccccc1CCCc1c(Cl)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Benzylamine_primary
B-H	5109	Cc1c(Cl)oc2cocc12.NCc1cnccc1CCCc1c(Cl)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.HeteroBenzylamine_primary
B-H	5110	Cc1c(Cl)oc2ccncc12.NCCNCCCCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5111	Cc1c(Cl)oc2ccncc12.NC=CNCCCCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5112	Cc1c(Cl)oc2ccncc12.NC=CNC=CCCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5113	Cc1c(Cl)oc2ccncc12.NC1CNCC(CCc2c(Cl)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4ccncc34)C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5114	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccncc34)C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5115	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccncc34)C=C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5116	Cc1c(Cl)oc2ccncc12.NCCNCCCc1c(Cl)oc2ccncc12>>Cc1c(NCCNCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_SaturatedAliphatic
B-H	5117	Cc1c(Cl)oc2ccncc12.NC=CNCCCc1c(Cl)oc2ccncc12>>Cc1c(NC=CNCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5118	Cc1c(Cl)oc2ccncc12.Nc1cccc(CCc2c(Cl)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5119	Cc1c(Cl)oc2ccncc12.NCCNc1ccccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5120	Cc1c(Cl)oc2ccncc12.NC=CNc1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5121	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5122	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5123	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5124	Cc1c(Cl)oc2ccncc12.Nc1cccc(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Phe
B-H	5125	Cc1c(Cl)oc2ccncc12.Nc1cc2ccc(CCc3c(Cl)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5ccncc45)cc3cc2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PhePhe
B-H	5126	Cc1c(Cl)oc2ccncc12.Nc1cncc(CCc2c(Cl)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5127	Cc1c(Cl)oc2ccncc12.Nc1cncc(CCc2c(Cl)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5128	Cc1c(Cl)oc2ccncc12.NCCNc1ccncc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5129	Cc1c(Cl)oc2ccncc12.NC=CNc1ccncc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5130	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5131	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5132	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5133	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5134	Cc1c(Cl)oc2ccncc12.Nc1occ(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5
B-H	5135	Cc1c(Cl)oc2ccncc12.Nc1oc2c(CCc3c(Cl)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5ccncc45)occ3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Het5
B-H	5136	Cc1c(Cl)oc2ccncc12.Nc1oc2cc(CCc3c(Cl)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5ccncc45)ncc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Het6
B-H	5137	Cc1c(Cl)oc2ccncc12.Nc1oc2ccc(CCc3c(Cl)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5ccncc45)cc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Phe
B-H	5138	Cc1c(Cl)oc2ccncc12.Nc1nccc(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6
B-H	5139	Cc1c(Cl)oc2ccncc12.Nc1c(Cc2c(Cl)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Het5
B-H	5140	Cc1c(Cl)oc2ccncc12.Nc1ncc2cc(CCc3c(Cl)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5ccncc45)ncc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Het6
B-H	5141	Cc1c(Cl)oc2ccncc12.Nc1ncc2ccc(CCc3c(Cl)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5ccncc45)cc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Phe
B-H	5142	Cc1c(Cl)oc2ccncc12.Nc1c(Cc2c(Cl)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PheHet5
B-H	5143	Cc1c(Cl)oc2ccncc12.Nc1cc2cncc(CCc3c(Cl)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5ccncc45)c3cc2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PheHet6
B-H	5144	Cc1c(Cl)oc2ccncc12.NCc1ccccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Benzylamine_primary
B-H	5145	Cc1c(Cl)oc2ccncc12.NCc1cnccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.HeteroBenzylamine_primary
B-H	5146	Cc1c(Cl)oc2ccccc12.NCCNCCCCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5147	Cc1c(Cl)oc2ccccc12.NC=CNCCCCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5148	Cc1c(Cl)oc2ccccc12.NC=CNC=CCCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5149	Cc1c(Cl)oc2ccccc12.NC1CNCC(CCc2c(Cl)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4ccccc34)C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5150	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccccc34)C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5151	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccccc34)C=C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5152	Cc1c(Cl)oc2ccccc12.NCCNCCCc1c(Cl)oc2ccccc12>>Cc1c(NCCNCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_SaturatedAliphatic
B-H	5153	Cc1c(Cl)oc2ccccc12.NC=CNCCCc1c(Cl)oc2ccccc12>>Cc1c(NC=CNCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5154	Cc1c(Cl)oc2ccccc12.Nc1cccc(CCc2c(Cl)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5155	Cc1c(Cl)oc2ccccc12.NCCNc1ccccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5156	Cc1c(Cl)oc2ccccc12.NC=CNc1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5157	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5158	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5159	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5160	Cc1c(Cl)oc2ccccc12.Nc1cccc(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Phe
B-H	5161	Cc1c(Cl)oc2ccccc12.Nc1cc2ccc(CCc3c(Cl)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5ccccc45)cc3cc2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PhePhe
B-H	5162	Cc1c(Cl)oc2ccccc12.Nc1cncc(CCc2c(Cl)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5163	Cc1c(Cl)oc2ccccc12.Nc1cncc(CCc2c(Cl)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5164	Cc1c(Cl)oc2ccccc12.NCCNc1ccncc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5165	Cc1c(Cl)oc2ccccc12.NC=CNc1ccncc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5166	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5167	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5168	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5169	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5170	Cc1c(Cl)oc2ccccc12.Nc1occ(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5
B-H	5171	Cc1c(Cl)oc2ccccc12.Nc1oc2c(CCc3c(Cl)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5ccccc45)occ3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Het5
B-H	5172	Cc1c(Cl)oc2ccccc12.Nc1oc2cc(CCc3c(Cl)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5ccccc45)ncc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Het6
B-H	5173	Cc1c(Cl)oc2ccccc12.Nc1oc2ccc(CCc3c(Cl)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5ccccc45)cc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Phe
B-H	5174	Cc1c(Cl)oc2ccccc12.Nc1nccc(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6
B-H	5175	Cc1c(Cl)oc2ccccc12.Nc1c(Cc2c(Cl)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Het5
B-H	5176	Cc1c(Cl)oc2ccccc12.Nc1ncc2cc(CCc3c(Cl)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5ccccc45)ncc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Het6
B-H	5177	Cc1c(Cl)oc2ccccc12.Nc1ncc2ccc(CCc3c(Cl)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5ccccc45)cc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Phe
B-H	5178	Cc1c(Cl)oc2ccccc12.Nc1c(Cc2c(Cl)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PheHet5
B-H	5179	Cc1c(Cl)oc2ccccc12.Nc1cc2cncc(CCc3c(Cl)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5ccccc45)c3cc2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PheHet6
B-H	5180	Cc1c(Cl)oc2ccccc12.NCc1ccccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Benzylamine_primary
B-H	5181	Cc1c(Cl)oc2ccccc12.NCc1cnccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.HeteroBenzylamine_primary
B-H	5182	Cc1cnccc1Cl.NCCNCCCCc1cnccc1Cl>>Cc1cnccc1N(CCN)CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5183	Cc1cnccc1Cl.NC=CNCCCCc1cnccc1Cl>>Cc1cnccc1N(C=CN)CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5184	Cc1cnccc1Cl.NC=CNC=CCCc1cnccc1Cl>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5185	Cc1cnccc1Cl.NC1CNCC(CCc2cnccc2Cl)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5186	Cc1cnccc1Cl.Clc1ccncc1CCC1CC=CNC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5187	Cc1cnccc1Cl.Clc1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5188	Cc1cnccc1Cl.NCCNCCCc1cnccc1Cl>>Cc1cnccc1NCCNCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_SaturatedAliphatic
B-H	5189	Cc1cnccc1Cl.NC=CNCCCc1cnccc1Cl>>Cc1cnccc1NC=CNCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5190	Cc1cnccc1Cl.Nc1cccc(CCc2cnccc2Cl)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5191	Cc1cnccc1Cl.NCCNc1ccccc1CCCc1cnccc1Cl>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5192	Cc1cnccc1Cl.NC=CNc1ccccc1CCc1cnccc1Cl>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5193	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5194	Cc1cnccc1Cl.Clc1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5195	Cc1cnccc1Cl.Clc1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5196	Cc1cnccc1Cl.Nc1cccc(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Phe
B-H	5197	Cc1cnccc1Cl.Nc1cc2ccc(CCc3cnccc3Cl)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PhePhe
B-H	5198	Cc1cnccc1Cl.Nc1cncc(CCc2cnccc2Cl)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5199	Cc1cnccc1Cl.Nc1cncc(CCc2cnccc2Cl)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5200	Cc1cnccc1Cl.NCCNc1ccncc1CCc1cnccc1Cl>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5201	Cc1cnccc1Cl.NC=CNc1ccncc1CCc1cnccc1Cl>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5202	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5203	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5204	Cc1cnccc1Cl.Clc1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5205	Cc1cnccc1Cl.Clc1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5206	Cc1cnccc1Cl.Nc1occ(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5
B-H	5207	Cc1cnccc1Cl.Nc1oc2c(CCc3cnccc3Cl)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Het5
B-H	5208	Cc1cnccc1Cl.Nc1oc2cc(CCc3cnccc3Cl)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Het6
B-H	5209	Cc1cnccc1Cl.Nc1oc2ccc(CCc3cnccc3Cl)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Phe
B-H	5210	Cc1cnccc1Cl.Nc1nccc(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6
B-H	5211	Cc1cnccc1Cl.Nc1c(Cc2cnccc2Cl)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Het5
B-H	5212	Cc1cnccc1Cl.Nc1ncc2cc(CCc3cnccc3Cl)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Het6
B-H	5213	Cc1cnccc1Cl.Nc1ncc2ccc(CCc3cnccc3Cl)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Phe
B-H	5214	Cc1cnccc1Cl.Nc1c(Cc2cnccc2Cl)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PheHet5
B-H	5215	Cc1cnccc1Cl.Nc1cc2cncc(CCc3cnccc3Cl)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PheHet6
B-H	5216	Cc1cnccc1Cl.NCc1ccccc1CCCc1cnccc1Cl>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Benzylamine_primary
B-H	5217	Cc1cnccc1Cl.NCc1cnccc1CCCc1cnccc1Cl>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.HeteroBenzylamine_primary
B-H	5218	Cc1nc2cocc2cc1Cl.NCCNCCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5219	Cc1nc2cocc2cc1Cl.NC=CNCCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5220	Cc1nc2cocc2cc1Cl.NC=CNC=CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5221	Cc1nc2cocc2cc1Cl.NC1CNCC(CCc2nc3cocc3cc2Cl)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5222	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCC1CC=CNC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5223	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCC1C=CNC=CC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5224	Cc1nc2cocc2cc1Cl.NCCNCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_SaturatedAliphatic
B-H	5225	Cc1nc2cocc2cc1Cl.NC=CNCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5226	Cc1nc2cocc2cc1Cl.Nc1cccc(CCc2nc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5227	Cc1nc2cocc2cc1Cl.NCCNc1ccccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5228	Cc1nc2cocc2cc1Cl.NC=CNc1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5229	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5230	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5231	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5232	Cc1nc2cocc2cc1Cl.Nc1cccc(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Phe
B-H	5233	Cc1nc2cocc2cc1Cl.Nc1cc2ccc(CCc3nc4cocc4cc3Cl)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PhePhe
B-H	5234	Cc1nc2cocc2cc1Cl.Nc1cncc(CCc2nc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5235	Cc1nc2cocc2cc1Cl.Nc1cncc(CCc2nc3cocc3cc2Cl)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5236	Cc1nc2cocc2cc1Cl.NCCNc1ccncc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5237	Cc1nc2cocc2cc1Cl.NC=CNc1ccncc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5238	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5239	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5240	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5241	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5242	Cc1nc2cocc2cc1Cl.Nc1occ(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5
B-H	5243	Cc1nc2cocc2cc1Cl.Nc1oc2c(CCc3nc4cocc4cc3Cl)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Het5
B-H	5244	Cc1nc2cocc2cc1Cl.Nc1oc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Het6
B-H	5245	Cc1nc2cocc2cc1Cl.Nc1oc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Phe
B-H	5246	Cc1nc2cocc2cc1Cl.Nc1nccc(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6
B-H	5247	Cc1nc2cocc2cc1Cl.Nc1c(Cc2nc3cocc3cc2Cl)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Het5
B-H	5248	Cc1nc2cocc2cc1Cl.Nc1ncc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Het6
B-H	5249	Cc1nc2cocc2cc1Cl.Nc1ncc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Phe
B-H	5250	Cc1nc2cocc2cc1Cl.Nc1c(Cc2nc3cocc3cc2Cl)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PheHet5
B-H	5251	Cc1nc2cocc2cc1Cl.Nc1cc2cncc(CCc3nc4cocc4cc3Cl)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PheHet6
B-H	5252	Cc1nc2cocc2cc1Cl.NCc1ccccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Benzylamine_primary
B-H	5253	Cc1nc2cocc2cc1Cl.NCc1cnccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.HeteroBenzylamine_primary
B-H	5254	Cc1c(Cl)ncc2ccncc12.NCCNCCCCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5255	Cc1c(Cl)ncc2ccncc12.NC=CNCCCCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5256	Cc1c(Cl)ncc2ccncc12.NC=CNC=CCCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5257	Cc1c(Cl)ncc2ccncc12.NC1CNCC(CCc2c(Cl)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)ncc4ccncc34)C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5258	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccncc34)C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5259	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccncc34)C=C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5260	Cc1c(Cl)ncc2ccncc12.NCCNCCCc1c(Cl)ncc2ccncc12>>Cc1c(NCCNCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_SaturatedAliphatic
B-H	5261	Cc1c(Cl)ncc2ccncc12.NC=CNCCCc1c(Cl)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5262	Cc1c(Cl)ncc2ccncc12.Nc1cccc(CCc2c(Cl)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5263	Cc1c(Cl)ncc2ccncc12.NCCNc1ccccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5264	Cc1c(Cl)ncc2ccncc12.NC=CNc1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5265	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5266	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5267	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5268	Cc1c(Cl)ncc2ccncc12.Nc1cccc(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Phe
B-H	5269	Cc1c(Cl)ncc2ccncc12.Nc1cc2ccc(CCc3c(Cl)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PhePhe
B-H	5270	Cc1c(Cl)ncc2ccncc12.Nc1cncc(CCc2c(Cl)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5271	Cc1c(Cl)ncc2ccncc12.Nc1cncc(CCc2c(Cl)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5272	Cc1c(Cl)ncc2ccncc12.NCCNc1ccncc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5273	Cc1c(Cl)ncc2ccncc12.NC=CNc1ccncc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5274	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5275	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5276	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5277	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5278	Cc1c(Cl)ncc2ccncc12.Nc1occ(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5
B-H	5279	Cc1c(Cl)ncc2ccncc12.Nc1oc2c(CCc3c(Cl)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)ncc5ccncc45)occ3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Het5
B-H	5280	Cc1c(Cl)ncc2ccncc12.Nc1oc2cc(CCc3c(Cl)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Het6
B-H	5281	Cc1c(Cl)ncc2ccncc12.Nc1oc2ccc(CCc3c(Cl)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Phe
B-H	5282	Cc1c(Cl)ncc2ccncc12.Nc1nccc(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6
B-H	5283	Cc1c(Cl)ncc2ccncc12.Nc1c(Cc2c(Cl)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Het5
B-H	5284	Cc1c(Cl)ncc2ccncc12.Nc1ncc2cc(CCc3c(Cl)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Het6
B-H	5285	Cc1c(Cl)ncc2ccncc12.Nc1ncc2ccc(CCc3c(Cl)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Phe
B-H	5286	Cc1c(Cl)ncc2ccncc12.Nc1c(Cc2c(Cl)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PheHet5
B-H	5287	Cc1c(Cl)ncc2ccncc12.Nc1cc2cncc(CCc3c(Cl)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)ncc5ccncc45)c3cc2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PheHet6
B-H	5288	Cc1c(Cl)ncc2ccncc12.NCc1ccccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Benzylamine_primary
B-H	5289	Cc1c(Cl)ncc2ccncc12.NCc1cnccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.HeteroBenzylamine_primary
B-H	5290	Cc1c(Cl)ncc2ccccc12.NCCNCCCCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5291	Cc1c(Cl)ncc2ccccc12.NC=CNCCCCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5292	Cc1c(Cl)ncc2ccccc12.NC=CNC=CCCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5293	Cc1c(Cl)ncc2ccccc12.NC1CNCC(CCc2c(Cl)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)ncc4ccccc34)C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5294	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccccc34)C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5295	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccccc34)C=C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5296	Cc1c(Cl)ncc2ccccc12.NCCNCCCc1c(Cl)ncc2ccccc12>>Cc1c(NCCNCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_SaturatedAliphatic
B-H	5297	Cc1c(Cl)ncc2ccccc12.NC=CNCCCc1c(Cl)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5298	Cc1c(Cl)ncc2ccccc12.Nc1cccc(CCc2c(Cl)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5299	Cc1c(Cl)ncc2ccccc12.NCCNc1ccccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5300	Cc1c(Cl)ncc2ccccc12.NC=CNc1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5301	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5302	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5303	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5304	Cc1c(Cl)ncc2ccccc12.Nc1cccc(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Phe
B-H	5305	Cc1c(Cl)ncc2ccccc12.Nc1cc2ccc(CCc3c(Cl)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PhePhe
B-H	5306	Cc1c(Cl)ncc2ccccc12.Nc1cncc(CCc2c(Cl)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5307	Cc1c(Cl)ncc2ccccc12.Nc1cncc(CCc2c(Cl)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5308	Cc1c(Cl)ncc2ccccc12.NCCNc1ccncc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5309	Cc1c(Cl)ncc2ccccc12.NC=CNc1ccncc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5310	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5311	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5312	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5313	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5314	Cc1c(Cl)ncc2ccccc12.Nc1occ(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5
B-H	5315	Cc1c(Cl)ncc2ccccc12.Nc1oc2c(CCc3c(Cl)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)ncc5ccccc45)occ3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Het5
B-H	5316	Cc1c(Cl)ncc2ccccc12.Nc1oc2cc(CCc3c(Cl)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Het6
B-H	5317	Cc1c(Cl)ncc2ccccc12.Nc1oc2ccc(CCc3c(Cl)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Phe
B-H	5318	Cc1c(Cl)ncc2ccccc12.Nc1nccc(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6
B-H	5319	Cc1c(Cl)ncc2ccccc12.Nc1c(Cc2c(Cl)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Het5
B-H	5320	Cc1c(Cl)ncc2ccccc12.Nc1ncc2cc(CCc3c(Cl)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Het6
B-H	5321	Cc1c(Cl)ncc2ccccc12.Nc1ncc2ccc(CCc3c(Cl)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Phe
B-H	5322	Cc1c(Cl)ncc2ccccc12.Nc1c(Cc2c(Cl)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PheHet5
B-H	5323	Cc1c(Cl)ncc2ccccc12.Nc1cc2cncc(CCc3c(Cl)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)ncc5ccccc45)c3cc2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PheHet6
B-H	5324	Cc1c(Cl)ncc2ccccc12.NCc1ccccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Benzylamine_primary
B-H	5325	Cc1c(Cl)ncc2ccccc12.NCc1cnccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.HeteroBenzylamine_primary
B-H	5326	Cc1cocc1I.NCCNCCCCc1cocc1I>>Cc1cocc1N(CCN)CCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5327	Cc1cocc1I.NC=CNCCCCc1cocc1I>>Cc1cocc1N(C=CN)CCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5328	Cc1cocc1I.NC=CNC=CCCc1cocc1I>>Cc1cocc1N(C=CN)C=CCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5329	Cc1cocc1I.NC1CNCC(CCc2cocc2I)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5330	Cc1cocc1I.Ic1cocc1CCC1CC=CNC1>>Cc1cocc1N1C=CCC(CCc2cocc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5331	Cc1cocc1I.Ic1cocc1CCC1C=CNC=CC1>>Cc1cocc1N1C=CCC(CCc2cocc2I)C=C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5332	Cc1cocc1I.NCCNCCCc1cocc1I>>Cc1cocc1NCCNCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_SaturatedAliphatic
B-H	5333	Cc1cocc1I.NC=CNCCCc1cocc1I>>Cc1cocc1NC=CNCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5334	Cc1cocc1I.Nc1cccc(CCc2cocc2I)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5335	Cc1cocc1I.NCCNc1ccccc1CCCc1cocc1I>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5336	Cc1cocc1I.NC=CNc1ccccc1CCc1cocc1I>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5337	Cc1cocc1I.Ic1cocc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5338	Cc1cocc1I.Ic1cocc1Cc1ccc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ccc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5339	Cc1cocc1I.Ic1cocc1Cc1ccc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5340	Cc1cocc1I.Nc1cccc(CCc2cocc2I)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Phe
B-H	5341	Cc1cocc1I.Nc1cc2ccc(CCc3cocc3I)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3I)cc2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_PhePhe
B-H	5342	Cc1cocc1I.Nc1cncc(CCc2cocc2I)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5343	Cc1cocc1I.Nc1cncc(CCc2cocc2I)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5344	Cc1cocc1I.NCCNc1ccncc1CCc1cocc1I>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5345	Cc1cocc1I.NC=CNc1ccncc1CCc1cocc1I>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5346	Cc1cocc1I.Ic1cocc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5347	Cc1cocc1I.Ic1cocc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2I)Cc2ccncc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5348	Cc1cocc1I.Ic1cocc1Cc1cnc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ncc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5349	Cc1cocc1I.Ic1cocc1Cc1cnc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5350	Cc1cocc1I.Nc1occ(CCc2cocc2I)c1N>>Cc1cocc1Nc1occ(CCc2cocc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het5
B-H	5351	Cc1cocc1I.Nc1oc2c(CCc3cocc3I)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3I)occ2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het5Het5
B-H	5352	Cc1cocc1I.Nc1oc2cc(CCc3cocc3I)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het5Het6
B-H	5353	Cc1cocc1I.Nc1oc2ccc(CCc3cocc3I)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het5Phe
B-H	5354	Cc1cocc1I.Nc1nccc(CCc2cocc2I)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het6
B-H	5355	Cc1cocc1I.Nc1c(Cc2cocc2I)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2I)nc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het6Het5
B-H	5356	Cc1cocc1I.Nc1ncc2cc(CCc3cocc3I)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het6Het6
B-H	5357	Cc1cocc1I.Nc1ncc2ccc(CCc3cocc3I)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_Het6Phe
B-H	5358	Cc1cocc1I.Nc1c(Cc2cocc2I)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2I)cc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_PheHet5
B-H	5359	Cc1cocc1I.Nc1cc2cncc(CCc3cocc3I)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3I)c2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Amine_Primary_PheHet6
B-H	5360	Cc1cocc1I.NCc1ccccc1CCCc1cocc1I>>Cc1cocc1NCc1ccccc1CCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.Benzylamine_primary
B-H	5361	Cc1cocc1I.NCc1cnccc1CCCc1cocc1I>>Cc1cocc1NCc1cnccc1CCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5.HeteroBenzylamine_primary
B-H	5362	Cc1c(I)oc2cocc12.NCCNCCCCc1c(I)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5363	Cc1c(I)oc2cocc12.NC=CNCCCCc1c(I)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5364	Cc1c(I)oc2cocc12.NC=CNC=CCCc1c(I)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5365	Cc1c(I)oc2cocc12.NC1CNCC(CCc2c(I)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)oc4cocc34)C2)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5366	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)oc4cocc34)C2)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5367	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)oc4cocc34)C=C2)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5368	Cc1c(I)oc2cocc12.NCCNCCCc1c(I)oc2cocc12>>Cc1c(NCCNCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_SaturatedAliphatic
B-H	5369	Cc1c(I)oc2cocc12.NC=CNCCCc1c(I)oc2cocc12>>Cc1c(NC=CNCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5370	Cc1c(I)oc2cocc12.Nc1cccc(CCc2c(I)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5371	Cc1c(I)oc2cocc12.NCCNc1ccccc1CCCc1c(I)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5372	Cc1c(I)oc2cocc12.NC=CNc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5373	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)oc4cocc34)Cc3ccccc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5374	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5375	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5376	Cc1c(I)oc2cocc12.Nc1cccc(CCc2c(I)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)oc4cocc34)c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Phe
B-H	5377	Cc1c(I)oc2cocc12.Nc1cc2ccc(CCc3c(I)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)oc5cocc45)cc3cc2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_PhePhe
B-H	5378	Cc1c(I)oc2cocc12.Nc1cncc(CCc2c(I)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5379	Cc1c(I)oc2cocc12.Nc1cncc(CCc2c(I)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5380	Cc1c(I)oc2cocc12.NCCNc1ccncc1CCc1c(I)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5381	Cc1c(I)oc2cocc12.NC=CNc1ccncc1CCc1c(I)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5382	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)oc4cocc34)Cc3ccccc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5383	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)oc4cocc34)Cc3ccncc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5384	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5385	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5386	Cc1c(I)oc2cocc12.Nc1occ(CCc2c(I)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(I)oc4cocc34)c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het5
B-H	5387	Cc1c(I)oc2cocc12.Nc1oc2c(CCc3c(I)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)oc5cocc45)occ3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het5Het5
B-H	5388	Cc1c(I)oc2cocc12.Nc1oc2cc(CCc3c(I)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)oc5cocc45)ncc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het5Het6
B-H	5389	Cc1c(I)oc2cocc12.Nc1oc2ccc(CCc3c(I)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)oc5cocc45)cc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het5Phe
B-H	5390	Cc1c(I)oc2cocc12.Nc1nccc(CCc2c(I)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)oc4cocc34)c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het6
B-H	5391	Cc1c(I)oc2cocc12.Nc1c(Cc2c(I)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4cocc34)nc3cocc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het6Het5
B-H	5392	Cc1c(I)oc2cocc12.Nc1ncc2cc(CCc3c(I)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)oc5cocc45)ncc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het6Het6
B-H	5393	Cc1c(I)oc2cocc12.Nc1ncc2ccc(CCc3c(I)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)oc5cocc45)cc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_Het6Phe
B-H	5394	Cc1c(I)oc2cocc12.Nc1c(Cc2c(I)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4cocc34)cc3cocc3c2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_PheHet5
B-H	5395	Cc1c(I)oc2cocc12.Nc1cc2cncc(CCc3c(I)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)oc5cocc45)c3cc2N)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Amine_Primary_PheHet6
B-H	5396	Cc1c(I)oc2cocc12.NCc1ccccc1CCCc1c(I)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.Benzylamine_primary
B-H	5397	Cc1c(I)oc2cocc12.NCc1cnccc1CCCc1c(I)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het5.HeteroBenzylamine_primary
B-H	5398	Cc1c(I)oc2ccncc12.NCCNCCCCc1c(I)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5399	Cc1c(I)oc2ccncc12.NC=CNCCCCc1c(I)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5400	Cc1c(I)oc2ccncc12.NC=CNC=CCCc1c(I)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5401	Cc1c(I)oc2ccncc12.NC1CNCC(CCc2c(I)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)oc4ccncc34)C2)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5402	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)oc4ccncc34)C2)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5403	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)oc4ccncc34)C=C2)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5404	Cc1c(I)oc2ccncc12.NCCNCCCc1c(I)oc2ccncc12>>Cc1c(NCCNCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_SaturatedAliphatic
B-H	5405	Cc1c(I)oc2ccncc12.NC=CNCCCc1c(I)oc2ccncc12>>Cc1c(NC=CNCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5406	Cc1c(I)oc2ccncc12.Nc1cccc(CCc2c(I)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5407	Cc1c(I)oc2ccncc12.NCCNc1ccccc1CCCc1c(I)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5408	Cc1c(I)oc2ccncc12.NC=CNc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5409	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5410	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5411	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5412	Cc1c(I)oc2ccncc12.Nc1cccc(CCc2c(I)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)oc4ccncc34)c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Phe
B-H	5413	Cc1c(I)oc2ccncc12.Nc1cc2ccc(CCc3c(I)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)oc5ccncc45)cc3cc2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_PhePhe
B-H	5414	Cc1c(I)oc2ccncc12.Nc1cncc(CCc2c(I)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5415	Cc1c(I)oc2ccncc12.Nc1cncc(CCc2c(I)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5416	Cc1c(I)oc2ccncc12.NCCNc1ccncc1CCc1c(I)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5417	Cc1c(I)oc2ccncc12.NC=CNc1ccncc1CCc1c(I)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5418	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5419	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5420	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5421	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5422	Cc1c(I)oc2ccncc12.Nc1occ(CCc2c(I)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(I)oc4ccncc34)c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het5
B-H	5423	Cc1c(I)oc2ccncc12.Nc1oc2c(CCc3c(I)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)oc5ccncc45)occ3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het5Het5
B-H	5424	Cc1c(I)oc2ccncc12.Nc1oc2cc(CCc3c(I)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)oc5ccncc45)ncc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het5Het6
B-H	5425	Cc1c(I)oc2ccncc12.Nc1oc2ccc(CCc3c(I)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)oc5ccncc45)cc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het5Phe
B-H	5426	Cc1c(I)oc2ccncc12.Nc1nccc(CCc2c(I)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)oc4ccncc34)c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het6
B-H	5427	Cc1c(I)oc2ccncc12.Nc1c(Cc2c(I)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het6Het5
B-H	5428	Cc1c(I)oc2ccncc12.Nc1ncc2cc(CCc3c(I)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)oc5ccncc45)ncc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het6Het6
B-H	5429	Cc1c(I)oc2ccncc12.Nc1ncc2ccc(CCc3c(I)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)oc5ccncc45)cc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_Het6Phe
B-H	5430	Cc1c(I)oc2ccncc12.Nc1c(Cc2c(I)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_PheHet5
B-H	5431	Cc1c(I)oc2ccncc12.Nc1cc2cncc(CCc3c(I)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)oc5ccncc45)c3cc2N)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Amine_Primary_PheHet6
B-H	5432	Cc1c(I)oc2ccncc12.NCc1ccccc1CCCc1c(I)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.Benzylamine_primary
B-H	5433	Cc1c(I)oc2ccncc12.NCc1cnccc1CCCc1c(I)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Het6.HeteroBenzylamine_primary
B-H	5434	Cc1c(I)oc2ccccc12.NCCNCCCCc1c(I)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5435	Cc1c(I)oc2ccccc12.NC=CNCCCCc1c(I)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5436	Cc1c(I)oc2ccccc12.NC=CNC=CCCc1c(I)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5437	Cc1c(I)oc2ccccc12.NC1CNCC(CCc2c(I)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)oc4ccccc34)C2)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5438	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)oc4ccccc34)C2)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5439	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)oc4ccccc34)C=C2)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5440	Cc1c(I)oc2ccccc12.NCCNCCCc1c(I)oc2ccccc12>>Cc1c(NCCNCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_SaturatedAliphatic
B-H	5441	Cc1c(I)oc2ccccc12.NC=CNCCCc1c(I)oc2ccccc12>>Cc1c(NC=CNCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5442	Cc1c(I)oc2ccccc12.Nc1cccc(CCc2c(I)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5443	Cc1c(I)oc2ccccc12.NCCNc1ccccc1CCCc1c(I)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5444	Cc1c(I)oc2ccccc12.NC=CNc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5445	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5446	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5447	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5448	Cc1c(I)oc2ccccc12.Nc1cccc(CCc2c(I)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)oc4ccccc34)c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Phe
B-H	5449	Cc1c(I)oc2ccccc12.Nc1cc2ccc(CCc3c(I)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)oc5ccccc45)cc3cc2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_PhePhe
B-H	5450	Cc1c(I)oc2ccccc12.Nc1cncc(CCc2c(I)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5451	Cc1c(I)oc2ccccc12.Nc1cncc(CCc2c(I)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5452	Cc1c(I)oc2ccccc12.NCCNc1ccncc1CCc1c(I)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5453	Cc1c(I)oc2ccccc12.NC=CNc1ccncc1CCc1c(I)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5454	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5455	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5456	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5457	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5458	Cc1c(I)oc2ccccc12.Nc1occ(CCc2c(I)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(I)oc4ccccc34)c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het5
B-H	5459	Cc1c(I)oc2ccccc12.Nc1oc2c(CCc3c(I)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)oc5ccccc45)occ3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het5Het5
B-H	5460	Cc1c(I)oc2ccccc12.Nc1oc2cc(CCc3c(I)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)oc5ccccc45)ncc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het5Het6
B-H	5461	Cc1c(I)oc2ccccc12.Nc1oc2ccc(CCc3c(I)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)oc5ccccc45)cc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het5Phe
B-H	5462	Cc1c(I)oc2ccccc12.Nc1nccc(CCc2c(I)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)oc4ccccc34)c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het6
B-H	5463	Cc1c(I)oc2ccccc12.Nc1c(Cc2c(I)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het6Het5
B-H	5464	Cc1c(I)oc2ccccc12.Nc1ncc2cc(CCc3c(I)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)oc5ccccc45)ncc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het6Het6
B-H	5465	Cc1c(I)oc2ccccc12.Nc1ncc2ccc(CCc3c(I)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)oc5ccccc45)cc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_Het6Phe
B-H	5466	Cc1c(I)oc2ccccc12.Nc1c(Cc2c(I)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_PheHet5
B-H	5467	Cc1c(I)oc2ccccc12.Nc1cc2cncc(CCc3c(I)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)oc5ccccc45)c3cc2N)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Amine_Primary_PheHet6
B-H	5468	Cc1c(I)oc2ccccc12.NCc1ccccc1CCCc1c(I)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.Benzylamine_primary
B-H	5469	Cc1c(I)oc2ccccc12.NCc1cnccc1CCCc1c(I)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het5Phe.HeteroBenzylamine_primary
B-H	5470	Cc1cnccc1I.NCCNCCCCc1cnccc1I>>Cc1cnccc1N(CCN)CCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5471	Cc1cnccc1I.NC=CNCCCCc1cnccc1I>>Cc1cnccc1N(C=CN)CCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5472	Cc1cnccc1I.NC=CNC=CCCc1cnccc1I>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5473	Cc1cnccc1I.NC1CNCC(CCc2cnccc2I)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5474	Cc1cnccc1I.Ic1ccncc1CCC1CC=CNC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5475	Cc1cnccc1I.Ic1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2I)C=C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5476	Cc1cnccc1I.NCCNCCCc1cnccc1I>>Cc1cnccc1NCCNCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_SaturatedAliphatic
B-H	5477	Cc1cnccc1I.NC=CNCCCc1cnccc1I>>Cc1cnccc1NC=CNCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5478	Cc1cnccc1I.Nc1cccc(CCc2cnccc2I)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5479	Cc1cnccc1I.NCCNc1ccccc1CCCc1cnccc1I>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5480	Cc1cnccc1I.NC=CNc1ccccc1CCc1cnccc1I>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5481	Cc1cnccc1I.Ic1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5482	Cc1cnccc1I.Ic1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5483	Cc1cnccc1I.Ic1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5484	Cc1cnccc1I.Nc1cccc(CCc2cnccc2I)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Phe
B-H	5485	Cc1cnccc1I.Nc1cc2ccc(CCc3cnccc3I)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3I)cc2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_PhePhe
B-H	5486	Cc1cnccc1I.Nc1cncc(CCc2cnccc2I)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5487	Cc1cnccc1I.Nc1cncc(CCc2cnccc2I)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5488	Cc1cnccc1I.NCCNc1ccncc1CCc1cnccc1I>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5489	Cc1cnccc1I.NC=CNc1ccncc1CCc1cnccc1I>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5490	Cc1cnccc1I.Ic1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5491	Cc1cnccc1I.Ic1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2I)Cc2ccncc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5492	Cc1cnccc1I.Ic1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5493	Cc1cnccc1I.Ic1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5494	Cc1cnccc1I.Nc1occ(CCc2cnccc2I)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het5
B-H	5495	Cc1cnccc1I.Nc1oc2c(CCc3cnccc3I)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3I)occ2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het5Het5
B-H	5496	Cc1cnccc1I.Nc1oc2cc(CCc3cnccc3I)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het5Het6
B-H	5497	Cc1cnccc1I.Nc1oc2ccc(CCc3cnccc3I)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het5Phe
B-H	5498	Cc1cnccc1I.Nc1nccc(CCc2cnccc2I)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het6
B-H	5499	Cc1cnccc1I.Nc1c(Cc2cnccc2I)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2I)nc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het6Het5
B-H	5500	Cc1cnccc1I.Nc1ncc2cc(CCc3cnccc3I)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het6Het6
B-H	5501	Cc1cnccc1I.Nc1ncc2ccc(CCc3cnccc3I)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_Het6Phe
B-H	5502	Cc1cnccc1I.Nc1c(Cc2cnccc2I)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2I)cc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_PheHet5
B-H	5503	Cc1cnccc1I.Nc1cc2cncc(CCc3cnccc3I)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3I)c2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Amine_Primary_PheHet6
B-H	5504	Cc1cnccc1I.NCc1ccccc1CCCc1cnccc1I>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.Benzylamine_primary
B-H	5505	Cc1cnccc1I.NCc1cnccc1CCCc1cnccc1I>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6.HeteroBenzylamine_primary
B-H	5506	Cc1nc2cocc2cc1I.NCCNCCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5507	Cc1nc2cocc2cc1I.NC=CNCCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5508	Cc1nc2cocc2cc1I.NC=CNC=CCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5509	Cc1nc2cocc2cc1I.NC1CNCC(CCc2nc3cocc3cc2I)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5510	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CCC1CC=CNC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5511	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CCC1C=CNC=CC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2I)C=C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5512	Cc1nc2cocc2cc1I.NCCNCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_SaturatedAliphatic
B-H	5513	Cc1nc2cocc2cc1I.NC=CNCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5514	Cc1nc2cocc2cc1I.Nc1cccc(CCc2nc3cocc3cc2I)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5515	Cc1nc2cocc2cc1I.NCCNc1ccccc1CCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5516	Cc1nc2cocc2cc1I.NC=CNc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5517	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5518	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1ccc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5519	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5520	Cc1nc2cocc2cc1I.Nc1cccc(CCc2nc3cocc3cc2I)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Phe
B-H	5521	Cc1nc2cocc2cc1I.Nc1cc2ccc(CCc3nc4cocc4cc3I)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3I)cc2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_PhePhe
B-H	5522	Cc1nc2cocc2cc1I.Nc1cncc(CCc2nc3cocc3cc2I)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5523	Cc1nc2cocc2cc1I.Nc1cncc(CCc2nc3cocc3cc2I)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5524	Cc1nc2cocc2cc1I.NCCNc1ccncc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5525	Cc1nc2cocc2cc1I.NC=CNc1ccncc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5526	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5527	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2I)Cc2ccncc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5528	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1cnc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5529	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5530	Cc1nc2cocc2cc1I.Nc1occ(CCc2nc3cocc3cc2I)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het5
B-H	5531	Cc1nc2cocc2cc1I.Nc1oc2c(CCc3nc4cocc4cc3I)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3I)occ2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het5Het5
B-H	5532	Cc1nc2cocc2cc1I.Nc1oc2cc(CCc3nc4cocc4cc3I)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het5Het6
B-H	5533	Cc1nc2cocc2cc1I.Nc1oc2ccc(CCc3nc4cocc4cc3I)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het5Phe
B-H	5534	Cc1nc2cocc2cc1I.Nc1nccc(CCc2nc3cocc3cc2I)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het6
B-H	5535	Cc1nc2cocc2cc1I.Nc1c(Cc2nc3cocc3cc2I)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2I)nc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het6Het5
B-H	5536	Cc1nc2cocc2cc1I.Nc1ncc2cc(CCc3nc4cocc4cc3I)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het6Het6
B-H	5537	Cc1nc2cocc2cc1I.Nc1ncc2ccc(CCc3nc4cocc4cc3I)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_Het6Phe
B-H	5538	Cc1nc2cocc2cc1I.Nc1c(Cc2nc3cocc3cc2I)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2I)cc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_PheHet5
B-H	5539	Cc1nc2cocc2cc1I.Nc1cc2cncc(CCc3nc4cocc4cc3I)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3I)c2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Amine_Primary_PheHet6
B-H	5540	Cc1nc2cocc2cc1I.NCc1ccccc1CCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.Benzylamine_primary
B-H	5541	Cc1nc2cocc2cc1I.NCc1cnccc1CCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het5.HeteroBenzylamine_primary
B-H	5542	Cc1c(I)ncc2ccncc12.NCCNCCCCc1c(I)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5543	Cc1c(I)ncc2ccncc12.NC=CNCCCCc1c(I)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5544	Cc1c(I)ncc2ccncc12.NC=CNC=CCCc1c(I)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5545	Cc1c(I)ncc2ccncc12.NC1CNCC(CCc2c(I)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)ncc4ccncc34)C2)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5546	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)ncc4ccncc34)C2)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5547	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)ncc4ccncc34)C=C2)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5548	Cc1c(I)ncc2ccncc12.NCCNCCCc1c(I)ncc2ccncc12>>Cc1c(NCCNCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_SaturatedAliphatic
B-H	5549	Cc1c(I)ncc2ccncc12.NC=CNCCCc1c(I)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5550	Cc1c(I)ncc2ccncc12.Nc1cccc(CCc2c(I)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5551	Cc1c(I)ncc2ccncc12.NCCNc1ccccc1CCCc1c(I)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5552	Cc1c(I)ncc2ccncc12.NC=CNc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5553	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5554	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5555	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5556	Cc1c(I)ncc2ccncc12.Nc1cccc(CCc2c(I)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)ncc4ccncc34)c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Phe
B-H	5557	Cc1c(I)ncc2ccncc12.Nc1cc2ccc(CCc3c(I)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_PhePhe
B-H	5558	Cc1c(I)ncc2ccncc12.Nc1cncc(CCc2c(I)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5559	Cc1c(I)ncc2ccncc12.Nc1cncc(CCc2c(I)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5560	Cc1c(I)ncc2ccncc12.NCCNc1ccncc1CCc1c(I)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5561	Cc1c(I)ncc2ccncc12.NC=CNc1ccncc1CCc1c(I)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5562	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5563	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5564	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5565	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5566	Cc1c(I)ncc2ccncc12.Nc1occ(CCc2c(I)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(I)ncc4ccncc34)c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het5
B-H	5567	Cc1c(I)ncc2ccncc12.Nc1oc2c(CCc3c(I)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)ncc5ccncc45)occ3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het5Het5
B-H	5568	Cc1c(I)ncc2ccncc12.Nc1oc2cc(CCc3c(I)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het5Het6
B-H	5569	Cc1c(I)ncc2ccncc12.Nc1oc2ccc(CCc3c(I)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)ncc5ccncc45)cc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het5Phe
B-H	5570	Cc1c(I)ncc2ccncc12.Nc1nccc(CCc2c(I)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)ncc4ccncc34)c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het6
B-H	5571	Cc1c(I)ncc2ccncc12.Nc1c(Cc2c(I)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het6Het5
B-H	5572	Cc1c(I)ncc2ccncc12.Nc1ncc2cc(CCc3c(I)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het6Het6
B-H	5573	Cc1c(I)ncc2ccncc12.Nc1ncc2ccc(CCc3c(I)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)ncc5ccncc45)cc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_Het6Phe
B-H	5574	Cc1c(I)ncc2ccncc12.Nc1c(Cc2c(I)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_PheHet5
B-H	5575	Cc1c(I)ncc2ccncc12.Nc1cc2cncc(CCc3c(I)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)ncc5ccncc45)c3cc2N)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Amine_Primary_PheHet6
B-H	5576	Cc1c(I)ncc2ccncc12.NCc1ccccc1CCCc1c(I)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.Benzylamine_primary
B-H	5577	Cc1c(I)ncc2ccncc12.NCc1cnccc1CCCc1c(I)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Het6.HeteroBenzylamine_primary
B-H	5578	Cc1c(I)ncc2ccccc12.NCCNCCCCc1c(I)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5579	Cc1c(I)ncc2ccccc12.NC=CNCCCCc1c(I)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5580	Cc1c(I)ncc2ccccc12.NC=CNC=CCCc1c(I)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5581	Cc1c(I)ncc2ccccc12.NC1CNCC(CCc2c(I)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(I)ncc4ccccc34)C2)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5582	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(I)ncc4ccccc34)C2)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5583	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(I)ncc4ccccc34)C=C2)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5584	Cc1c(I)ncc2ccccc12.NCCNCCCc1c(I)ncc2ccccc12>>Cc1c(NCCNCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_SaturatedAliphatic
B-H	5585	Cc1c(I)ncc2ccccc12.NC=CNCCCc1c(I)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5586	Cc1c(I)ncc2ccccc12.Nc1cccc(CCc2c(I)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5587	Cc1c(I)ncc2ccccc12.NCCNc1ccccc1CCCc1c(I)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5588	Cc1c(I)ncc2ccccc12.NC=CNc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5589	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(I)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5590	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5591	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5592	Cc1c(I)ncc2ccccc12.Nc1cccc(CCc2c(I)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(I)ncc4ccccc34)c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Phe
B-H	5593	Cc1c(I)ncc2ccccc12.Nc1cc2ccc(CCc3c(I)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(I)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_PhePhe
B-H	5594	Cc1c(I)ncc2ccccc12.Nc1cncc(CCc2c(I)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5595	Cc1c(I)ncc2ccccc12.Nc1cncc(CCc2c(I)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5596	Cc1c(I)ncc2ccccc12.NCCNc1ccncc1CCc1c(I)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5597	Cc1c(I)ncc2ccccc12.NC=CNc1ccncc1CCc1c(I)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5598	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(I)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5599	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(I)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5600	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5601	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5602	Cc1c(I)ncc2ccccc12.Nc1occ(CCc2c(I)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(I)ncc4ccccc34)c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het5
B-H	5603	Cc1c(I)ncc2ccccc12.Nc1oc2c(CCc3c(I)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(I)ncc5ccccc45)occ3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het5Het5
B-H	5604	Cc1c(I)ncc2ccccc12.Nc1oc2cc(CCc3c(I)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(I)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het5Het6
B-H	5605	Cc1c(I)ncc2ccccc12.Nc1oc2ccc(CCc3c(I)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(I)ncc5ccccc45)cc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het5Phe
B-H	5606	Cc1c(I)ncc2ccccc12.Nc1nccc(CCc2c(I)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(I)ncc4ccccc34)c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het6
B-H	5607	Cc1c(I)ncc2ccccc12.Nc1c(Cc2c(I)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het6Het5
B-H	5608	Cc1c(I)ncc2ccccc12.Nc1ncc2cc(CCc3c(I)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(I)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het6Het6
B-H	5609	Cc1c(I)ncc2ccccc12.Nc1ncc2ccc(CCc3c(I)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(I)ncc5ccccc45)cc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_Het6Phe
B-H	5610	Cc1c(I)ncc2ccccc12.Nc1c(Cc2c(I)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(I)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_PheHet5
B-H	5611	Cc1c(I)ncc2ccccc12.Nc1cc2cncc(CCc3c(I)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(I)ncc5ccccc45)c3cc2N)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Amine_Primary_PheHet6
B-H	5612	Cc1c(I)ncc2ccccc12.NCc1ccccc1CCCc1c(I)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.Benzylamine_primary
B-H	5613	Cc1c(I)ncc2ccccc12.NCc1cnccc1CCCc1c(I)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_Het6Phe.HeteroBenzylamine_primary
B-H	5614	Cc1cc2cocc2cc1I.NCCNCCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(CCN)CCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5615	Cc1cc2cocc2cc1I.NC=CNCCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(C=CN)CCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5616	Cc1cc2cocc2cc1I.NC=CNC=CCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(C=CN)C=CCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5617	Cc1cc2cocc2cc1I.NC1CNCC(CCc2cc3cocc3cc2I)C1>>Cc1cc2cocc2cc1N1CC(N)CC(CCc2cc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5618	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CCC1CC=CNC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5619	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CCC1C=CNC=CC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2I)C=C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5620	Cc1cc2cocc2cc1I.NCCNCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1NCCNCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_SaturatedAliphatic
B-H	5621	Cc1cc2cocc2cc1I.NC=CNCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1NC=CNCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_UnsaturatedAliphatic
B-H	5622	Cc1cc2cocc2cc1I.Nc1cccc(CCc2cc3cocc3cc2I)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5623	Cc1cc2cocc2cc1I.NCCNc1ccccc1CCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(CCN)c1ccccc1CCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5624	Cc1cc2cocc2cc1I.NC=CNc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(C=CN)c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5625	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2ccccc2CCC(Cc2cc3cocc3cc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5626	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1ccc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ccc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5627	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1ccc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ccc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5628	Cc1cc2cocc2cc1I.Nc1cccc(CCc2cc3cocc3cc2I)c1N>>Cc1cc2cocc2cc1Nc1cccc(CCc2cc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Phe
B-H	5629	Cc1cc2cocc2cc1I.Nc1cc2ccc(CCc3cc4cocc4cc3I)cc2cc1N>>Cc1cc2cocc2cc1Nc1cc2ccc(CCc3cc4cocc4cc3I)cc2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_PhePhe
B-H	5630	Cc1cc2cocc2cc1I.Nc1cncc(CCc2cc3cocc3cc2I)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5631	Cc1cc2cocc2cc1I.Nc1cncc(CCc2cc3cocc3cc2I)c1Nc1cccnc1>>Cc1cc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5632	Cc1cc2cocc2cc1I.NCCNc1ccncc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(CCN)c1ccncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5633	Cc1cc2cocc2cc1I.NC=CNc1ccncc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1N(C=CN)c1ccncc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5634	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2cnccc2CCC(Cc2cc3cocc3cc2I)Cc2ccccc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5635	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cc2cocc2cc1N1c2ccncc2CCC(Cc2cc3cocc3cc2I)Cc2ccncc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5636	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1cnc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ncc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5637	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1cnc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ncc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5638	Cc1cc2cocc2cc1I.Nc1occ(CCc2cc3cocc3cc2I)c1N>>Cc1cc2cocc2cc1Nc1occ(CCc2cc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het5
B-H	5639	Cc1cc2cocc2cc1I.Nc1oc2c(CCc3cc4cocc4cc3I)occ2c1N>>Cc1cc2cocc2cc1Nc1oc2c(CCc3cc4cocc4cc3I)occ2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het5Het5
B-H	5640	Cc1cc2cocc2cc1I.Nc1oc2cc(CCc3cc4cocc4cc3I)ncc2c1N>>Cc1cc2cocc2cc1Nc1oc2cc(CCc3cc4cocc4cc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het5Het6
B-H	5641	Cc1cc2cocc2cc1I.Nc1oc2ccc(CCc3cc4cocc4cc3I)cc2c1N>>Cc1cc2cocc2cc1Nc1oc2ccc(CCc3cc4cocc4cc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het5Phe
B-H	5642	Cc1cc2cocc2cc1I.Nc1nccc(CCc2cc3cocc3cc2I)c1N>>Cc1cc2cocc2cc1Nc1nccc(CCc2cc3cocc3cc2I)c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het6
B-H	5643	Cc1cc2cocc2cc1I.Nc1c(Cc2cc3cocc3cc2I)nc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2I)nc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het6Het5
B-H	5644	Cc1cc2cocc2cc1I.Nc1ncc2cc(CCc3cc4cocc4cc3I)ncc2c1N>>Cc1cc2cocc2cc1Nc1ncc2cc(CCc3cc4cocc4cc3I)ncc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het6Het6
B-H	5645	Cc1cc2cocc2cc1I.Nc1ncc2ccc(CCc3cc4cocc4cc3I)cc2c1N>>Cc1cc2cocc2cc1Nc1ncc2ccc(CCc3cc4cocc4cc3I)cc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_Het6Phe
B-H	5646	Cc1cc2cocc2cc1I.Nc1c(Cc2cc3cocc3cc2I)cc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2I)cc2cocc2c1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_PheHet5
B-H	5647	Cc1cc2cocc2cc1I.Nc1cc2cncc(CCc3cc4cocc4cc3I)c2cc1N>>Cc1cc2cocc2cc1Nc1cc2cncc(CCc3cc4cocc4cc3I)c2cc1N	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Amine_Primary_PheHet6
B-H	5648	Cc1cc2cocc2cc1I.NCc1ccccc1CCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1NCc1ccccc1CCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.Benzylamine_primary
B-H	5649	Cc1cc2cocc2cc1I.NCc1cnccc1CCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1NCc1cnccc1CCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet5.HeteroBenzylamine_primary
B-H	5650	CCc1c(I)ccc2ccncc12.NCCNCCCCCc1c(I)ccc2ccncc12>>CCc1c(N(CCN)CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5651	CCc1c(I)ccc2ccncc12.NC=CNCCCCCc1c(I)ccc2ccncc12>>CCc1c(N(C=CN)CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5652	CCc1c(I)ccc2ccncc12.NC=CNC=CCCCc1c(I)ccc2ccncc12>>CCc1c(N(C=CN)C=CCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5653	CCc1c(I)ccc2ccncc12.NC1CNCC(CCCc2c(I)ccc3ccncc23)C1>>CCc1c(N2CC(N)CC(CCCc3c(I)ccc4ccncc34)C2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5654	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCCC1CC=CNC1>>CCc1c(N2C=CCC(CCCc3c(I)ccc4ccncc34)C2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5655	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCCC1C=CNC=CC1>>CCc1c(N2C=CCC(CCCc3c(I)ccc4ccncc34)C=C2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5656	CCc1c(I)ccc2ccncc12.NCCNCCCCc1c(I)ccc2ccncc12>>CCc1c(NCCNCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_SaturatedAliphatic
B-H	5657	CCc1c(I)ccc2ccncc12.NC=CNCCCCc1c(I)ccc2ccncc12>>CCc1c(NC=CNCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_UnsaturatedAliphatic
B-H	5658	CCc1c(I)ccc2ccncc12.Nc1cccc(CCCc2c(I)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5659	CCc1c(I)ccc2ccncc12.NCCNc1ccccc1CCCCc1c(I)ccc2ccncc12>>CCc1c(N(CCN)c2ccccc2CCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5660	CCc1c(I)ccc2ccncc12.NC=CNc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(N(C=CN)c2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5661	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1c(N2c3ccccc3CCC(CCc3c(I)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5662	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1ccc2c(c1)NCCC2>>CCc1c(N2CCCc3ccc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5663	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1ccc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ccc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5664	CCc1c(I)ccc2ccncc12.Nc1cccc(CCCc2c(I)ccc3ccncc23)c1N>>CCc1c(Nc2cccc(CCCc3c(I)ccc4ccncc34)c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Phe
B-H	5665	CCc1c(I)ccc2ccncc12.Nc1cc2ccc(CCCc3c(I)ccc4ccncc34)cc2cc1N>>CCc1c(Nc2cc3ccc(CCCc4c(I)ccc5ccncc45)cc3cc2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_PhePhe
B-H	5666	CCc1c(I)ccc2ccncc12.Nc1cncc(CCCc2c(I)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cncc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5667	CCc1c(I)ccc2ccncc12.Nc1cncc(CCCc2c(I)ccc3ccncc23)c1Nc1cccnc1>>CCc1c(N(c2cccnc2)c2c(N)cncc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5668	CCc1c(I)ccc2ccncc12.NCCNc1ccncc1CCCc1c(I)ccc2ccncc12>>CCc1c(N(CCN)c2ccncc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5669	CCc1c(I)ccc2ccncc12.NC=CNc1ccncc1CCCc1c(I)ccc2ccncc12>>CCc1c(N(C=CN)c2ccncc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5670	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1c(N2c3cnccc3CCC(CCc3c(I)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5671	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1c(N2c3ccncc3CCC(CCc3c(I)ccc4ccncc34)Cc3ccncc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5672	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1cnc2c(c1)NCCC2>>CCc1c(N2CCCc3ncc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5673	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1cnc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ncc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Iodide_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5674	CCc1c(I)ccc2ccncc12.Nc1occ(CCCc2c(I)ccc3ccncc23)c1N>>CCc1c(Nc2occ(CCCc3c(I)ccc4ccncc34)c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het5
B-H	5675	CCc1c(I)ccc2ccncc12.Nc1oc2c(CCCc3c(I)ccc4ccncc34)occ2c1N>>CCc1c(Nc2oc3c(CCCc4c(I)ccc5ccncc45)occ3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het5Het5
B-H	5676	CCc1c(I)ccc2ccncc12.Nc1oc2cc(CCCc3c(I)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2oc3cc(CCCc4c(I)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het5Het6
B-H	5677	CCc1c(I)ccc2ccncc12.Nc1oc2ccc(CCCc3c(I)ccc4ccncc34)cc2c1N>>CCc1c(Nc2oc3ccc(CCCc4c(I)ccc5ccncc45)cc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het5Phe
B-H	5678	CCc1c(I)ccc2ccncc12.Nc1nccc(CCCc2c(I)ccc3ccncc23)c1N>>CCc1c(Nc2nccc(CCCc3c(I)ccc4ccncc34)c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het6
B-H	5679	CCc1c(I)ccc2ccncc12.Nc1c(CCc2c(I)ccc3ccncc23)nc2cocc2c1N>>CCc1c(Nc2c(CCc3c(I)ccc4ccncc34)nc3cocc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het6Het5
B-H	5680	CCc1c(I)ccc2ccncc12.Nc1ncc2cc(CCCc3c(I)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2ncc3cc(CCCc4c(I)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het6Het6
B-H	5681	CCc1c(I)ccc2ccncc12.Nc1ncc2ccc(CCCc3c(I)ccc4ccncc34)cc2c1N>>CCc1c(Nc2ncc3ccc(CCCc4c(I)ccc5ccncc45)cc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_Het6Phe
B-H	5682	CCc1c(I)ccc2ccncc12.Nc1c(CCc2c(I)ccc3ccncc23)cc2cocc2c1N>>CCc1c(Nc2c(CCc3c(I)ccc4ccncc34)cc3cocc3c2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_PheHet5
B-H	5683	CCc1c(I)ccc2ccncc12.Nc1cc2cncc(CCCc3c(I)ccc4ccncc34)c2cc1N>>CCc1c(Nc2cc3cncc(CCCc4c(I)ccc5ccncc45)c3cc2N)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Amine_Primary_PheHet6
B-H	5684	CCc1c(I)ccc2ccncc12.NCc1ccccc1CCCCc1c(I)ccc2ccncc12>>CCc1c(NCc2ccccc2CCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.Benzylamine_primary
B-H	5685	CCc1c(I)ccc2ccncc12.NCc1cnccc1CCCCc1c(I)ccc2ccncc12>>CCc1c(NCc2cnccc2CCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Iodide_PheHet6.HeteroBenzylamine_primary
B-H	5686	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCCNCCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(CCN)CCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5687	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(C=CN)CCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5688	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(C=CN)C=CCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5689	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2cocc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5690	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCC1CC=CNC1)C(F)(F)F>>Cc1cocc1N1C=CCC(CCc2cocc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5691	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCC1C=CNC=CC1)C(F)(F)F>>Cc1cocc1N1C=CCC(CCc2cocc2OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5692	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCCNCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1NCCNCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_SaturatedAliphatic
B-H	5693	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC=CNCCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1NC=CNCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5694	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5695	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5696	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5697	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5698	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1cocc1N1CCCc2ccc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5699	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5700	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Phe
B-H	5701	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_PhePhe
B-H	5702	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5703	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5704	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5705	Cc1cocc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5706	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5707	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5708	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1cocc1N1CCCc2ncc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5709	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5710	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cocc1Nc1occ(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het5
B-H	5711	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3cocc3OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het5Het5
B-H	5712	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3cocc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het5Het6
B-H	5713	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het5Phe
B-H	5714	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het6
B-H	5715	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cocc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het6Het5
B-H	5716	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3cocc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het6Het6
B-H	5717	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_Het6Phe
B-H	5718	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cocc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_PheHet5
B-H	5719	Cc1cocc1OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3cocc3OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Amine_Primary_PheHet6
B-H	5720	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1NCc1ccccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.Benzylamine_primary
B-H	5721	Cc1cocc1OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cocc1NCc1cnccc1CCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5.HeteroBenzylamine_primary
B-H	5722	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5723	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5724	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5725	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)C2)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5726	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)C2)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5727	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)C=C2)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5728	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_SaturatedAliphatic
B-H	5729	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5730	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5731	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5732	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5733	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)Cc3ccccc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5734	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5735	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5736	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Phe
B-H	5737	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc3cc2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_PhePhe
B-H	5738	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5739	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5740	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5741	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5742	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)Cc3ccccc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5743	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)Cc3ccncc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5744	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5745	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5746	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het5
B-H	5747	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)occ3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het5Het5
B-H	5748	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)ncc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het5Het6
B-H	5749	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het5Phe
B-H	5750	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het6
B-H	5751	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)nc3cocc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het6Het5
B-H	5752	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)ncc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het6Het6
B-H	5753	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_Het6Phe
B-H	5754	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)cc3cocc3c2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_PheHet5
B-H	5755	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)c3cc2N)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Amine_Primary_PheHet6
B-H	5756	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.Benzylamine_primary
B-H	5757	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het5.HeteroBenzylamine_primary
B-H	5758	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5759	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5760	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5761	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)C2)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5762	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)C2)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5763	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)C=C2)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5764	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_SaturatedAliphatic
B-H	5765	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5766	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5767	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5768	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5769	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5770	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5771	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5772	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Phe
B-H	5773	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc3cc2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_PhePhe
B-H	5774	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5775	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5776	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5777	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5778	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5779	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5780	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5781	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5782	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het5
B-H	5783	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)occ3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het5Het5
B-H	5784	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)ncc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het5Het6
B-H	5785	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het5Phe
B-H	5786	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het6
B-H	5787	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het6Het5
B-H	5788	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)ncc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het6Het6
B-H	5789	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_Het6Phe
B-H	5790	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_PheHet5
B-H	5791	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)c3cc2N)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Amine_Primary_PheHet6
B-H	5792	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.Benzylamine_primary
B-H	5793	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Het6.HeteroBenzylamine_primary
B-H	5794	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5795	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5796	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5797	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)C2)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5798	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)C2)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5799	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)C=C2)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5800	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_SaturatedAliphatic
B-H	5801	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5802	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5803	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5804	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5805	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5806	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5807	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5808	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Phe
B-H	5809	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc3cc2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_PhePhe
B-H	5810	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5811	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5812	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5813	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5814	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5815	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5816	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5817	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5818	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het5
B-H	5819	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)occ3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het5Het5
B-H	5820	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)ncc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het5Het6
B-H	5821	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het5Phe
B-H	5822	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het6
B-H	5823	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het6Het5
B-H	5824	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)ncc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het6Het6
B-H	5825	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_Het6Phe
B-H	5826	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_PheHet5
B-H	5827	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)c3cc2N)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Amine_Primary_PheHet6
B-H	5828	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.Benzylamine_primary
B-H	5829	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het5Phe.HeteroBenzylamine_primary
B-H	5830	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCCNCCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(CCN)CCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5831	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(C=CN)CCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5832	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5833	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2cnccc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5834	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCC1CC=CNC1)C(F)(F)F>>Cc1cnccc1N1C=CCC(CCc2cnccc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5835	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCC1C=CNC=CC1)C(F)(F)F>>Cc1cnccc1N1C=CCC(CCc2cnccc2OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5836	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCCNCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1NCCNCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_SaturatedAliphatic
B-H	5837	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC=CNCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1NC=CNCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5838	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5839	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5840	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5841	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5842	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5843	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5844	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Phe
B-H	5845	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_PhePhe
B-H	5846	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5847	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5848	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5849	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5850	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5851	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5852	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5853	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5854	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het5
B-H	5855	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3cnccc3OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het5Het5
B-H	5856	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het5Het6
B-H	5857	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het5Phe
B-H	5858	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het6
B-H	5859	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cnccc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het6Het5
B-H	5860	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het6Het6
B-H	5861	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_Het6Phe
B-H	5862	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cnccc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_PheHet5
B-H	5863	Cc1cnccc1OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Amine_Primary_PheHet6
B-H	5864	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.Benzylamine_primary
B-H	5865	Cc1cnccc1OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6.HeteroBenzylamine_primary
B-H	5866	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNCCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5867	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5868	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5869	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5870	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCC1CC=CNC1)C(F)(F)F>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5871	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCC1C=CNC=CC1)C(F)(F)F>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5872	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_SaturatedAliphatic
B-H	5873	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_UnsaturatedAliphatic
B-H	5874	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5875	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5876	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5877	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5878	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5879	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5880	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Phe
B-H	5881	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_PhePhe
B-H	5882	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5883	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5884	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5885	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5886	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5887	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5888	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5889	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5890	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het5
B-H	5891	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het5Het5
B-H	5892	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het5Het6
B-H	5893	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het5Phe
B-H	5894	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het6
B-H	5895	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het6Het5
B-H	5896	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het6Het6
B-H	5897	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_Het6Phe
B-H	5898	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_PheHet5
B-H	5899	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Amine_Primary_PheHet6
B-H	5900	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.Benzylamine_primary
B-H	5901	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het5.HeteroBenzylamine_primary
B-H	5902	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5903	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5904	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5905	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)C2)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5906	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)C2)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5907	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)C=C2)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5908	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_SaturatedAliphatic
B-H	5909	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_UnsaturatedAliphatic
B-H	5910	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5911	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5912	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5913	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5914	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5915	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5916	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Phe
B-H	5917	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_PhePhe
B-H	5918	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5919	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5920	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5921	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5922	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5923	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5924	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5925	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5926	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het5
B-H	5927	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)occ3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het5Het5
B-H	5928	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het5Het6
B-H	5929	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het5Phe
B-H	5930	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het6
B-H	5931	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het6Het5
B-H	5932	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het6Het6
B-H	5933	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_Het6Phe
B-H	5934	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_PheHet5
B-H	5935	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)c3cc2N)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Amine_Primary_PheHet6
B-H	5936	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.Benzylamine_primary
B-H	5937	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Het6.HeteroBenzylamine_primary
B-H	5938	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5939	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5940	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5941	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)C2)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5942	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)C2)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5943	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)C=C2)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5944	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_SaturatedAliphatic
B-H	5945	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_UnsaturatedAliphatic
B-H	5946	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5947	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5948	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5949	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5950	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5951	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5952	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Phe
B-H	5953	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_PhePhe
B-H	5954	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5955	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5956	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5957	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5958	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5959	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5960	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5961	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5962	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het5
B-H	5963	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)occ3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het5Het5
B-H	5964	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het5Het6
B-H	5965	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het5Phe
B-H	5966	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het6
B-H	5967	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het6Het5
B-H	5968	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het6Het6
B-H	5969	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_Het6Phe
B-H	5970	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_PheHet5
B-H	5971	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)c3cc2N)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Amine_Primary_PheHet6
B-H	5972	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.Benzylamine_primary
B-H	5973	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_Het6Phe.HeteroBenzylamine_primary
B-H	5974	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNCCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(CCN)CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5975	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNCCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(C=CN)CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5976	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNC=CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(C=CN)C=CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5977	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC1CNCC(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cc2cocc2cc1N1CC(N)CC(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	5978	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCC1CC=CNC1)C(F)(F)F>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	5979	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCC1C=CNC=CC1)C(F)(F)F>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C=C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	5980	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1NCCNCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_SaturatedAliphatic
B-H	5981	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1NC=CNCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_UnsaturatedAliphatic
B-H	5982	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	5983	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNc1ccccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(CCN)c1ccccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5984	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(C=CN)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5985	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1cc2cocc2cc1N1c2ccccc2CCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	5986	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1cc2cocc2cc1N1CCCc2ccc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	5987	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1cc2cocc2cc1N1C=CCc2ccc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	5988	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cccc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cc2cocc2cc1Nc1cccc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Phe
B-H	5989	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2cc1N>>Cc1cc2cocc2cc1Nc1cc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_PhePhe
B-H	5990	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	5991	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cncc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1Nc1cccnc1>>Cc1cc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5992	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCCNc1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(CCN)c1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5993	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NC=CNc1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1N(C=CN)c1ccncc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5994	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1cc2cocc2cc1N1c2cnccc2CCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccccc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	5995	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1cc2cocc2cc1N1c2ccncc2CCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)Cc2ccncc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	5996	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1cc2cocc2cc1N1CCCc2ncc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	5997	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1cc2cocc2cc1N1C=CCc2ncc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	5998	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1occ(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cc2cocc2cc1Nc1occ(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het5
B-H	5999	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2c(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)occ2c1N>>Cc1cc2cocc2cc1Nc1oc2c(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)occ2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het5Het5
B-H	6000	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2cc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cc2cocc2cc1Nc1oc2cc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het5Het6
B-H	6001	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1oc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cc2cocc2cc1Nc1oc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het5Phe
B-H	6002	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1nccc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N>>Cc1cc2cocc2cc1Nc1nccc(CCc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het6
B-H	6003	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)nc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het6Het5
B-H	6004	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1ncc2cc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N>>Cc1cc2cocc2cc1Nc1ncc2cc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ncc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het6Het6
B-H	6005	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1ncc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N>>Cc1cc2cocc2cc1Nc1ncc2ccc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_Het6Phe
B-H	6006	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1c(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)cc2cocc2c1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_PheHet5
B-H	6007	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.Nc1cc2cncc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)c2cc1N>>Cc1cc2cocc2cc1Nc1cc2cncc(CCc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)c2cc1N	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Amine_Primary_PheHet6
B-H	6008	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCc1ccccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1NCc1ccccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.Benzylamine_primary
B-H	6009	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.NCc1cnccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cc2cocc2cc1NCc1cnccc1CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet5.HeteroBenzylamine_primary
B-H	6010	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCCNCCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(CCN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	6011	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC=CNCCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	6012	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC=CNC=CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	6013	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC1CNCC(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)C2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
B-H	6014	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCC1CC=CNC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)C2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
B-H	6015	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCC1C=CNC=CC1)C(F)(F)F>>Cc1c(N2C=CCC(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)C=C2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
B-H	6016	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCCNCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(NCCNCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_SaturatedAliphatic
B-H	6017	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC=CNCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(NC=CNCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_UnsaturatedAliphatic
B-H	6018	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_Aromatic-Aromatic
B-H	6019	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCCNc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
B-H	6020	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC=CNc1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	6021	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3ccccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_Aromatic-Aromatic
B-H	6022	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
B-H	6023	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
B-H	6024	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Phe
B-H	6025	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc3cc2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_PhePhe
B-H	6026	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
B-H	6027	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cncc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	6028	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCCNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	6029	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NC=CNc1ccncc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	6030	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1)C(F)(F)F>>Cc1c(N2c3cnccc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
B-H	6031	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1)C(F)(F)F>>Cc1c(N2c3ccncc3CCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)Cc3ccncc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
B-H	6032	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnc2c(c1)NCCC2)C(F)(F)F>>Cc1c(N2CCCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
B-H	6033	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnc2c(c1)NC=CC2)C(F)(F)F>>Cc1c(N2C=CCc3ncc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Triflate_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
B-H	6034	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1occ(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het5
B-H	6035	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1oc2c(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)occ3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het5Het5
B-H	6036	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1oc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het5Het6
B-H	6037	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1oc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het5Phe
B-H	6038	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1nccc(CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het6
B-H	6039	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)nc3cocc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het6Het5
B-H	6040	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1ncc2cc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het6Het6
B-H	6041	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1ncc2ccc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_Het6Phe
B-H	6042	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)cc3cocc3c2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_PheHet5
B-H	6043	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.Nc1cc2cncc(CCc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)c3cc2N)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Amine_Primary_PheHet6
B-H	6044	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCc1ccccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.Benzylamine_primary
B-H	6045	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.NCc1cnccc1CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Triflate_PheHet6.HeteroBenzylamine_primary
snar_alcohol	6046	Cc1ccccc1Br.OCCCCCc1ccccc1Br>>Cc1ccccc1OCCCCCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PrimaryAlcoholAliphatic
snar_alcohol	6047	Cc1ccccc1Br.OCc1ccccc1CCc1ccccc1Br>>Cc1ccccc1OCc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PrimaryAlcoholAromatic
snar_alcohol	6048	Cc1ccccc1Br.CCC(O)CCCCc1ccccc1Br>>CCC(CCCCc1ccccc1Br)Oc1ccccc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6049	Cc1ccccc1Br.OC1C2CCCCC2C2CCC(Cc3ccccc3Br)CC12>>Cc1ccccc1OC1C2CCCCC2C2CCC(Cc3ccccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6050	Cc1ccccc1Br.OC(c1ccccc1)c1ccccc1CCc1ccccc1Br>>Cc1ccccc1OC(c1ccccc1)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6051	Cc1ccccc1Br.OC1c2ccccc2-c2ccc(Cc3ccccc3Br)cc21>>Cc1ccccc1OC1c2ccccc2c2ccc(Cc3ccccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6052	Cc1ccccc1Br.CCCC(O)c1ccccc1CCc1ccccc1Br>>CCCC(Oc1ccccc1C)c1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6053	Cc1ccccc1Br.OC1c2cc(Cc3ccccc3Br)ccc2C2CCCCC12>>Cc1ccccc1OC1c2cc(Cc3ccccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6054	Cc1ccccc1Br.CC(Cc1ccccc1Br)CC(C)(C)O>>Cc1ccccc1OC(C)(C)CC(C)Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.TertiaryAlcoholAcyclic
snar_alcohol	6055	Cc1ccccc1Br.CC1(O)CCCC(Cc2ccccc2Br)C1>>Cc1ccccc1OC1(C)CCCC(Cc2ccccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.TertiaryAlcoholCyclic
snar_alcohol	6056	Cc1ccccc1Br.Oc1ccccc1CCc1ccccc1Br>>Cc1ccccc1Oc1ccccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.Phenol
snar_alcohol	6057	Cc1ccccc1Br.Oc1occc1CCc1ccccc1Br>>Cc1ccccc1Oc1occc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PhenolHeteroaromatic5membered
snar_alcohol	6058	Cc1ccccc1Br.Oc1ncccc1CCc1ccccc1Br>>Cc1ccccc1Oc1ncccc1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Phe.PhenolHeteroaromatic6membered
snar_alcohol	6059	Cc1c(Br)ccc2ccccc12.OCCCCCc1c(Br)ccc2ccccc12>>Cc1c(OCCCCCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PrimaryAlcoholAliphatic
snar_alcohol	6060	Cc1c(Br)ccc2ccccc12.OCc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PrimaryAlcoholAromatic
snar_alcohol	6061	Cc1c(Br)ccc2ccccc12.CCC(O)CCCCc1c(Br)ccc2ccccc12>>CCC(CCCCc1c(Br)ccc2ccccc12)Oc1ccc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6062	Cc1c(Br)ccc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ccc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)ccc5ccccc45)CC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6063	Cc1c(Br)ccc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6064	Cc1c(Br)ccc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ccc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)ccc5ccccc45)cc32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6065	Cc1c(Br)ccc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)ccc2ccccc12>>CCCC(Oc1ccc2ccccc2c1C)c1ccccc1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholMixAcyclic
snar_alcohol	6066	Cc1c(Br)ccc2ccccc12.OC1c2cc(Cc3c(Br)ccc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.SecondaryAlcoholMixCyclic
snar_alcohol	6067	Cc1c(Br)ccc2ccccc12.CC(Cc1c(Br)ccc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.TertiaryAlcoholAcyclic
snar_alcohol	6068	Cc1c(Br)ccc2ccccc12.CC1(O)CCCC(Cc2c(Br)ccc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)ccc4ccccc34)C2)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.TertiaryAlcoholCyclic
snar_alcohol	6069	Cc1c(Br)ccc2ccccc12.Oc1ccccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.Phenol
snar_alcohol	6070	Cc1c(Br)ccc2ccccc12.Oc1occc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PhenolHeteroaromatic5membered
snar_alcohol	6071	Cc1c(Br)ccc2ccccc12.Oc1ncccc1CCc1c(Br)ccc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PhePhe.PhenolHeteroaromatic6membered
snar_alcohol	6072	Cc1ccccc1I.OCCCCCc1ccccc1I>>Cc1ccccc1OCCCCCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PrimaryAlcoholAliphatic
snar_alcohol	6073	Cc1ccccc1I.OCc1ccccc1CCc1ccccc1I>>Cc1ccccc1OCc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PrimaryAlcoholAromatic
snar_alcohol	6074	Cc1ccccc1I.CCC(O)CCCCc1ccccc1I>>CCC(CCCCc1ccccc1I)Oc1ccccc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6075	Cc1ccccc1I.OC1C2CCCCC2C2CCC(Cc3ccccc3I)CC12>>Cc1ccccc1OC1C2CCCCC2C2CCC(Cc3ccccc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6076	Cc1ccccc1I.OC(c1ccccc1)c1ccccc1CCc1ccccc1I>>Cc1ccccc1OC(c1ccccc1)c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6077	Cc1ccccc1I.OC1c2ccccc2-c2ccc(Cc3ccccc3I)cc21>>Cc1ccccc1OC1c2ccccc2c2ccc(Cc3ccccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6078	Cc1ccccc1I.CCCC(O)c1ccccc1CCc1ccccc1I>>CCCC(Oc1ccccc1C)c1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6079	Cc1ccccc1I.OC1c2cc(Cc3ccccc3I)ccc2C2CCCCC12>>Cc1ccccc1OC1c2cc(Cc3ccccc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6080	Cc1ccccc1I.CC(Cc1ccccc1I)CC(C)(C)O>>Cc1ccccc1OC(C)(C)CC(C)Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.TertiaryAlcoholAcyclic
snar_alcohol	6081	Cc1ccccc1I.CC1(O)CCCC(Cc2ccccc2I)C1>>Cc1ccccc1OC1(C)CCCC(Cc2ccccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.TertiaryAlcoholCyclic
snar_alcohol	6082	Cc1ccccc1I.Oc1ccccc1CCc1ccccc1I>>Cc1ccccc1Oc1ccccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.Phenol
snar_alcohol	6083	Cc1ccccc1I.Oc1occc1CCc1ccccc1I>>Cc1ccccc1Oc1occc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PhenolHeteroaromatic5membered
snar_alcohol	6084	Cc1ccccc1I.Oc1ncccc1CCc1ccccc1I>>Cc1ccccc1Oc1ncccc1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Phe.PhenolHeteroaromatic6membered
snar_alcohol	6085	Cc1c(I)ccc2ccccc12.OCCCCCc1c(I)ccc2ccccc12>>Cc1c(OCCCCCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PrimaryAlcoholAliphatic
snar_alcohol	6086	Cc1c(I)ccc2ccccc12.OCc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PrimaryAlcoholAromatic
snar_alcohol	6087	Cc1c(I)ccc2ccccc12.CCC(O)CCCCc1c(I)ccc2ccccc12>>CCC(CCCCc1c(I)ccc2ccccc12)Oc1ccc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6088	Cc1c(I)ccc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(I)ccc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)ccc5ccccc45)CC32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6089	Cc1c(I)ccc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6090	Cc1c(I)ccc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(I)ccc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)ccc5ccccc45)cc32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6091	Cc1c(I)ccc2ccccc12.CCCC(O)c1ccccc1CCc1c(I)ccc2ccccc12>>CCCC(Oc1ccc2ccccc2c1C)c1ccccc1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholMixAcyclic
snar_alcohol	6092	Cc1c(I)ccc2ccccc12.OC1c2cc(Cc3c(I)ccc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.SecondaryAlcoholMixCyclic
snar_alcohol	6093	Cc1c(I)ccc2ccccc12.CC(Cc1c(I)ccc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.TertiaryAlcoholAcyclic
snar_alcohol	6094	Cc1c(I)ccc2ccccc12.CC1(O)CCCC(Cc2c(I)ccc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)ccc4ccccc34)C2)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.TertiaryAlcoholCyclic
snar_alcohol	6095	Cc1c(I)ccc2ccccc12.Oc1ccccc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.Phenol
snar_alcohol	6096	Cc1c(I)ccc2ccccc12.Oc1occc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PhenolHeteroaromatic5membered
snar_alcohol	6097	Cc1c(I)ccc2ccccc12.Oc1ncccc1CCc1c(I)ccc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PhePhe.PhenolHeteroaromatic6membered
snar_alcohol	6098	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCCCCO)c1)C(F)(F)F>>Cc1cccc(OCCCCCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PrimaryAlcoholAliphatic
snar_alcohol	6099	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2CO)c1)C(F)(F)F>>Cc1cccc(OCc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PrimaryAlcoholAromatic
snar_alcohol	6100	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CCC(O)CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCC(CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1)Oc1cccc(C)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6101	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CC2CCC3C(C2)C(O)C2CCCCC23)c1)C(F)(F)F>>Cc1cccc(OC2C3CCCCC3C3CCC(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)CC32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6102	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2C(O)c2ccccc2)c1)C(F)(F)F>>Cc1cccc(OC(c2ccccc2)c2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6103	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)C(O)c2ccccc2-3)c1)C(F)(F)F>>Cc1cccc(OC2c3ccccc3c3ccc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)cc32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6104	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CCCC(O)c1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCCC(Oc1cccc(C)c1)c1ccccc1CCc1cccc(OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6105	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccc3c(c2)C(O)C2CCCCC32)c1)C(F)(F)F>>Cc1cccc(OC2c3cc(Cc4cccc(OS(=O)(=O)C(F)(F)F)c4)ccc3C3CCCCC32)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6106	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC(Cc1cccc(OS(=O)(=O)C(F)(F)F)c1)CC(C)(C)O>>Cc1cccc(OC(C)(C)CC(C)Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.TertiaryAlcoholAcyclic
snar_alcohol	6107	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.CC1(O)CCCC(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)C1>>Cc1cccc(OC2(C)CCCC(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)C2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.TertiaryAlcoholCyclic
snar_alcohol	6108	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccccc2O)c1)C(F)(F)F>>Cc1cccc(Oc2ccccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.Phenol
snar_alcohol	6109	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2ccoc2O)c1)C(F)(F)F>>Cc1cccc(Oc2occc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PhenolHeteroaromatic5membered
snar_alcohol	6110	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2cccnc2O)c1)C(F)(F)F>>Cc1cccc(Oc2ncccc2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Phe.PhenolHeteroaromatic6membered
snar_alcohol	6111	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PrimaryAlcoholAliphatic
snar_alcohol	6112	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PrimaryAlcoholAromatic
snar_alcohol	6113	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)Oc1ccc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6114	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)CC32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6115	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6116	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)cc32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6117	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCCC(Oc1ccc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholMixAcyclic
snar_alcohol	6118	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccccc45)ccc3C3CCCCC32)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.SecondaryAlcoholMixCyclic
snar_alcohol	6119	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.TertiaryAlcoholAcyclic
snar_alcohol	6120	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccccc34)C2)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.TertiaryAlcoholCyclic
snar_alcohol	6121	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.Phenol
snar_alcohol	6122	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PhenolHeteroaromatic5membered
snar_alcohol	6123	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PhePhe.PhenolHeteroaromatic6membered
snar_alcohol	6124	Cc1cocc1Br.OCCCCCc1cocc1Br>>Cc1cocc1OCCCCCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PrimaryAlcoholAliphatic
snar_alcohol	6125	Cc1cocc1Br.OCc1ccccc1CCc1cocc1Br>>Cc1cocc1OCc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PrimaryAlcoholAromatic
snar_alcohol	6126	Cc1cocc1Br.CCC(O)CCCCc1cocc1Br>>CCC(CCCCc1cocc1Br)Oc1cocc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6127	Cc1cocc1Br.OC1C2CCCCC2C2CCC(Cc3cocc3Br)CC12>>Cc1cocc1OC1C2CCCCC2C2CCC(Cc3cocc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6128	Cc1cocc1Br.OC(c1ccccc1)c1ccccc1CCc1cocc1Br>>Cc1cocc1OC(c1ccccc1)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6129	Cc1cocc1Br.OC1c2ccccc2-c2ccc(Cc3cocc3Br)cc21>>Cc1cocc1OC1c2ccccc2c2ccc(Cc3cocc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6130	Cc1cocc1Br.CCCC(O)c1ccccc1CCc1cocc1Br>>CCCC(Oc1cocc1C)c1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6131	Cc1cocc1Br.OC1c2cc(Cc3cocc3Br)ccc2C2CCCCC12>>Cc1cocc1OC1c2cc(Cc3cocc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6132	Cc1cocc1Br.CC(Cc1cocc1Br)CC(C)(C)O>>Cc1cocc1OC(C)(C)CC(C)Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.TertiaryAlcoholAcyclic
snar_alcohol	6133	Cc1cocc1Br.CC1(O)CCCC(Cc2cocc2Br)C1>>Cc1cocc1OC1(C)CCCC(Cc2cocc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.TertiaryAlcoholCyclic
snar_alcohol	6134	Cc1cocc1Br.Oc1ccccc1CCc1cocc1Br>>Cc1cocc1Oc1ccccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.Phenol
snar_alcohol	6135	Cc1cocc1Br.Oc1occc1CCc1cocc1Br>>Cc1cocc1Oc1occc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PhenolHeteroaromatic5membered
snar_alcohol	6136	Cc1cocc1Br.Oc1ncccc1CCc1cocc1Br>>Cc1cocc1Oc1ncccc1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5.PhenolHeteroaromatic6membered
snar_alcohol	6137	Cc1c(Br)oc2cocc12.OCCCCCc1c(Br)oc2cocc12>>Cc1c(OCCCCCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PrimaryAlcoholAliphatic
snar_alcohol	6138	Cc1c(Br)oc2cocc12.OCc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(OCc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PrimaryAlcoholAromatic
snar_alcohol	6139	Cc1c(Br)oc2cocc12.CCC(O)CCCCc1c(Br)oc2cocc12>>CCC(CCCCc1c(Br)oc2cocc12)Oc1oc2cocc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6140	Cc1c(Br)oc2cocc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4cocc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)oc5cocc45)CC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6141	Cc1c(Br)oc2cocc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6142	Cc1c(Br)oc2cocc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4cocc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)oc5cocc45)cc32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6143	Cc1c(Br)oc2cocc12.CCCC(O)c1ccccc1CCc1c(Br)oc2cocc12>>CCCC(Oc1oc2cocc2c1C)c1ccccc1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6144	Cc1c(Br)oc2cocc12.OC1c2cc(Cc3c(Br)oc4cocc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6145	Cc1c(Br)oc2cocc12.CC(Cc1c(Br)oc2cocc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.TertiaryAlcoholAcyclic
snar_alcohol	6146	Cc1c(Br)oc2cocc12.CC1(O)CCCC(Cc2c(Br)oc3cocc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)oc4cocc34)C2)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.TertiaryAlcoholCyclic
snar_alcohol	6147	Cc1c(Br)oc2cocc12.Oc1ccccc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.Phenol
snar_alcohol	6148	Cc1c(Br)oc2cocc12.Oc1occc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2occc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PhenolHeteroaromatic5membered
snar_alcohol	6149	Cc1c(Br)oc2cocc12.Oc1ncccc1CCc1c(Br)oc2cocc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het5.PhenolHeteroaromatic6membered
snar_alcohol	6150	Cc1c(Br)oc2ccncc12.OCCCCCc1c(Br)oc2ccncc12>>Cc1c(OCCCCCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PrimaryAlcoholAliphatic
snar_alcohol	6151	Cc1c(Br)oc2ccncc12.OCc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(OCc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PrimaryAlcoholAromatic
snar_alcohol	6152	Cc1c(Br)oc2ccncc12.CCC(O)CCCCc1c(Br)oc2ccncc12>>CCC(CCCCc1c(Br)oc2ccncc12)Oc1oc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6153	Cc1c(Br)oc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccncc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)oc5ccncc45)CC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6154	Cc1c(Br)oc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6155	Cc1c(Br)oc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccncc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)oc5ccncc45)cc32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6156	Cc1c(Br)oc2ccncc12.CCCC(O)c1ccccc1CCc1c(Br)oc2ccncc12>>CCCC(Oc1oc2ccncc2c1C)c1ccccc1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6157	Cc1c(Br)oc2ccncc12.OC1c2cc(Cc3c(Br)oc4ccncc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6158	Cc1c(Br)oc2ccncc12.CC(Cc1c(Br)oc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.TertiaryAlcoholAcyclic
snar_alcohol	6159	Cc1c(Br)oc2ccncc12.CC1(O)CCCC(Cc2c(Br)oc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)oc4ccncc34)C2)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.TertiaryAlcoholCyclic
snar_alcohol	6160	Cc1c(Br)oc2ccncc12.Oc1ccccc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.Phenol
snar_alcohol	6161	Cc1c(Br)oc2ccncc12.Oc1occc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2occc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PhenolHeteroaromatic5membered
snar_alcohol	6162	Cc1c(Br)oc2ccncc12.Oc1ncccc1CCc1c(Br)oc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Het6.PhenolHeteroaromatic6membered
snar_alcohol	6163	Cc1c(Br)oc2ccccc12.OCCCCCc1c(Br)oc2ccccc12>>Cc1c(OCCCCCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PrimaryAlcoholAliphatic
snar_alcohol	6164	Cc1c(Br)oc2ccccc12.OCc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PrimaryAlcoholAromatic
snar_alcohol	6165	Cc1c(Br)oc2ccccc12.CCC(O)CCCCc1c(Br)oc2ccccc12>>CCC(CCCCc1c(Br)oc2ccccc12)Oc1oc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6166	Cc1c(Br)oc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)oc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)oc5ccccc45)CC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6167	Cc1c(Br)oc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6168	Cc1c(Br)oc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)oc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)oc5ccccc45)cc32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6169	Cc1c(Br)oc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)oc2ccccc12>>CCCC(Oc1oc2ccccc2c1C)c1ccccc1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6170	Cc1c(Br)oc2ccccc12.OC1c2cc(Cc3c(Br)oc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6171	Cc1c(Br)oc2ccccc12.CC(Cc1c(Br)oc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.TertiaryAlcoholAcyclic
snar_alcohol	6172	Cc1c(Br)oc2ccccc12.CC1(O)CCCC(Cc2c(Br)oc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)oc4ccccc34)C2)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.TertiaryAlcoholCyclic
snar_alcohol	6173	Cc1c(Br)oc2ccccc12.Oc1ccccc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.Phenol
snar_alcohol	6174	Cc1c(Br)oc2ccccc12.Oc1occc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PhenolHeteroaromatic5membered
snar_alcohol	6175	Cc1c(Br)oc2ccccc12.Oc1ncccc1CCc1c(Br)oc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het5Phe.PhenolHeteroaromatic6membered
snar_alcohol	6176	Cc1cnccc1Br.OCCCCCc1cnccc1Br>>Cc1cnccc1OCCCCCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PrimaryAlcoholAliphatic
snar_alcohol	6177	Cc1cnccc1Br.OCc1ccccc1CCc1cnccc1Br>>Cc1cnccc1OCc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PrimaryAlcoholAromatic
snar_alcohol	6178	Cc1cnccc1Br.CCC(O)CCCCc1cnccc1Br>>CCC(CCCCc1cnccc1Br)Oc1ccncc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6179	Cc1cnccc1Br.OC1C2CCCCC2C2CCC(Cc3cnccc3Br)CC12>>Cc1cnccc1OC1C2CCCCC2C2CCC(Cc3cnccc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6180	Cc1cnccc1Br.OC(c1ccccc1)c1ccccc1CCc1cnccc1Br>>Cc1cnccc1OC(c1ccccc1)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6181	Cc1cnccc1Br.OC1c2ccccc2-c2ccc(Cc3cnccc3Br)cc21>>Cc1cnccc1OC1c2ccccc2c2ccc(Cc3cnccc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6182	Cc1cnccc1Br.CCCC(O)c1ccccc1CCc1cnccc1Br>>CCCC(Oc1ccncc1C)c1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6183	Cc1cnccc1Br.OC1c2cc(Cc3cnccc3Br)ccc2C2CCCCC12>>Cc1cnccc1OC1c2cc(Cc3cnccc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6184	Cc1cnccc1Br.CC(Cc1cnccc1Br)CC(C)(C)O>>Cc1cnccc1OC(C)(C)CC(C)Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.TertiaryAlcoholAcyclic
snar_alcohol	6185	Cc1cnccc1Br.CC1(O)CCCC(Cc2cnccc2Br)C1>>Cc1cnccc1OC1(C)CCCC(Cc2cnccc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.TertiaryAlcoholCyclic
snar_alcohol	6186	Cc1cnccc1Br.Oc1ccccc1CCc1cnccc1Br>>Cc1cnccc1Oc1ccccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.Phenol
snar_alcohol	6187	Cc1cnccc1Br.Oc1occc1CCc1cnccc1Br>>Cc1cnccc1Oc1occc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PhenolHeteroaromatic5membered
snar_alcohol	6188	Cc1cnccc1Br.Oc1ncccc1CCc1cnccc1Br>>Cc1cnccc1Oc1ncccc1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6.PhenolHeteroaromatic6membered
snar_alcohol	6189	Cc1nc2cocc2cc1Br.OCCCCCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1OCCCCCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PrimaryAlcoholAliphatic
snar_alcohol	6190	Cc1nc2cocc2cc1Br.OCc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1OCc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PrimaryAlcoholAromatic
snar_alcohol	6191	Cc1nc2cocc2cc1Br.CCC(O)CCCCc1nc2cocc2cc1Br>>CCC(CCCCc1nc2cocc2cc1Br)Oc1cc2cocc2nc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6192	Cc1nc2cocc2cc1Br.OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC12>>Cc1nc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6193	Cc1nc2cocc2cc1Br.OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6194	Cc1nc2cocc2cc1Br.OC1c2ccccc2-c2ccc(Cc3nc4cocc4cc3Br)cc21>>Cc1nc2cocc2cc1OC1c2ccccc2c2ccc(Cc3nc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6195	Cc1nc2cocc2cc1Br.CCCC(O)c1ccccc1CCc1nc2cocc2cc1Br>>CCCC(Oc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6196	Cc1nc2cocc2cc1Br.OC1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1nc2cocc2cc1OC1c2cc(Cc3nc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6197	Cc1nc2cocc2cc1Br.CC(Cc1nc2cocc2cc1Br)CC(C)(C)O>>Cc1nc2cocc2cc1OC(C)(C)CC(C)Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.TertiaryAlcoholAcyclic
snar_alcohol	6198	Cc1nc2cocc2cc1Br.CC1(O)CCCC(Cc2nc3cocc3cc2Br)C1>>Cc1nc2cocc2cc1OC1(C)CCCC(Cc2nc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.TertiaryAlcoholCyclic
snar_alcohol	6199	Cc1nc2cocc2cc1Br.Oc1ccccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.Phenol
snar_alcohol	6200	Cc1nc2cocc2cc1Br.Oc1occc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PhenolHeteroaromatic5membered
snar_alcohol	6201	Cc1nc2cocc2cc1Br.Oc1ncccc1CCc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het5.PhenolHeteroaromatic6membered
snar_alcohol	6202	Cc1c(Br)ncc2ccncc12.OCCCCCc1c(Br)ncc2ccncc12>>Cc1c(OCCCCCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PrimaryAlcoholAliphatic
snar_alcohol	6203	Cc1c(Br)ncc2ccncc12.OCc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(OCc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PrimaryAlcoholAromatic
snar_alcohol	6204	Cc1c(Br)ncc2ccncc12.CCC(O)CCCCc1c(Br)ncc2ccncc12>>CCC(CCCCc1c(Br)ncc2ccncc12)Oc1ncc2ccncc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6205	Cc1c(Br)ncc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccncc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccncc45)CC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6206	Cc1c(Br)ncc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6207	Cc1c(Br)ncc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccncc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)ncc5ccncc45)cc32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6208	Cc1c(Br)ncc2ccncc12.CCCC(O)c1ccccc1CCc1c(Br)ncc2ccncc12>>CCCC(Oc1ncc2ccncc2c1C)c1ccccc1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6209	Cc1c(Br)ncc2ccncc12.OC1c2cc(Cc3c(Br)ncc4ccncc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6210	Cc1c(Br)ncc2ccncc12.CC(Cc1c(Br)ncc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.TertiaryAlcoholAcyclic
snar_alcohol	6211	Cc1c(Br)ncc2ccncc12.CC1(O)CCCC(Cc2c(Br)ncc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)ncc4ccncc34)C2)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.TertiaryAlcoholCyclic
snar_alcohol	6212	Cc1c(Br)ncc2ccncc12.Oc1ccccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.Phenol
snar_alcohol	6213	Cc1c(Br)ncc2ccncc12.Oc1occc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2occc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PhenolHeteroaromatic5membered
snar_alcohol	6214	Cc1c(Br)ncc2ccncc12.Oc1ncccc1CCc1c(Br)ncc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Het6.PhenolHeteroaromatic6membered
snar_alcohol	6215	Cc1c(Br)ncc2ccccc12.OCCCCCc1c(Br)ncc2ccccc12>>Cc1c(OCCCCCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PrimaryAlcoholAliphatic
snar_alcohol	6216	Cc1c(Br)ncc2ccccc12.OCc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PrimaryAlcoholAromatic
snar_alcohol	6217	Cc1c(Br)ncc2ccccc12.CCC(O)CCCCc1c(Br)ncc2ccccc12>>CCC(CCCCc1c(Br)ncc2ccccc12)Oc1ncc2ccccc2c1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6218	Cc1c(Br)ncc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(Br)ncc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(Br)ncc5ccccc45)CC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6219	Cc1c(Br)ncc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6220	Cc1c(Br)ncc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(Br)ncc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(Br)ncc5ccccc45)cc32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6221	Cc1c(Br)ncc2ccccc12.CCCC(O)c1ccccc1CCc1c(Br)ncc2ccccc12>>CCCC(Oc1ncc2ccccc2c1C)c1ccccc1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6222	Cc1c(Br)ncc2ccccc12.OC1c2cc(Cc3c(Br)ncc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(Br)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6223	Cc1c(Br)ncc2ccccc12.CC(Cc1c(Br)ncc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.TertiaryAlcoholAcyclic
snar_alcohol	6224	Cc1c(Br)ncc2ccccc12.CC1(O)CCCC(Cc2c(Br)ncc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(Br)ncc4ccccc34)C2)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.TertiaryAlcoholCyclic
snar_alcohol	6225	Cc1c(Br)ncc2ccccc12.Oc1ccccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.Phenol
snar_alcohol	6226	Cc1c(Br)ncc2ccccc12.Oc1occc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2occc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PhenolHeteroaromatic5membered
snar_alcohol	6227	Cc1c(Br)ncc2ccccc12.Oc1ncccc1CCc1c(Br)ncc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_Het6Phe.PhenolHeteroaromatic6membered
snar_alcohol	6228	Cc1cc2cocc2cc1Br.OCCCCCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1OCCCCCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PrimaryAlcoholAliphatic
snar_alcohol	6229	Cc1cc2cocc2cc1Br.OCc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1OCc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PrimaryAlcoholAromatic
snar_alcohol	6230	Cc1cc2cocc2cc1Br.CCC(O)CCCCc1cc2cocc2cc1Br>>CCC(CCCCc1cc2cocc2cc1Br)Oc1cc2cocc2cc1C	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6231	Cc1cc2cocc2cc1Br.OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC12>>Cc1cc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3Br)CC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6232	Cc1cc2cocc2cc1Br.OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6233	Cc1cc2cocc2cc1Br.OC1c2ccccc2-c2ccc(Cc3cc4cocc4cc3Br)cc21>>Cc1cc2cocc2cc1OC1c2ccccc2c2ccc(Cc3cc4cocc4cc3Br)cc21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6234	Cc1cc2cocc2cc1Br.CCCC(O)c1ccccc1CCc1cc2cocc2cc1Br>>CCCC(Oc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholMixAcyclic
snar_alcohol	6235	Cc1cc2cocc2cc1Br.OC1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC12>>Cc1cc2cocc2cc1OC1c2cc(Cc3cc4cocc4cc3Br)ccc2C2CCCCC21	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.SecondaryAlcoholMixCyclic
snar_alcohol	6236	Cc1cc2cocc2cc1Br.CC(Cc1cc2cocc2cc1Br)CC(C)(C)O>>Cc1cc2cocc2cc1OC(C)(C)CC(C)Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.TertiaryAlcoholAcyclic
snar_alcohol	6237	Cc1cc2cocc2cc1Br.CC1(O)CCCC(Cc2cc3cocc3cc2Br)C1>>Cc1cc2cocc2cc1OC1(C)CCCC(Cc2cc3cocc3cc2Br)C1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.TertiaryAlcoholCyclic
snar_alcohol	6238	Cc1cc2cocc2cc1Br.Oc1ccccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.Phenol
snar_alcohol	6239	Cc1cc2cocc2cc1Br.Oc1occc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PhenolHeteroaromatic5membered
snar_alcohol	6240	Cc1cc2cocc2cc1Br.Oc1ncccc1CCc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet5.PhenolHeteroaromatic6membered
snar_alcohol	6241	CCc1c(Br)ccc2ccncc12.OCCCCCCc1c(Br)ccc2ccncc12>>CCc1c(OCCCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PrimaryAlcoholAliphatic
snar_alcohol	6242	CCc1c(Br)ccc2ccncc12.OCc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(OCc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PrimaryAlcoholAromatic
snar_alcohol	6243	CCc1c(Br)ccc2ccncc12.CCC(O)CCCCCc1c(Br)ccc2ccncc12>>CCc1c(OC(CC)CCCCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6244	CCc1c(Br)ccc2ccncc12.OC1C2CCCCC2C2CCC(CCc3c(Br)ccc4ccncc34)CC12>>CCc1c(OC2C3CCCCC3C3CCC(CCc4c(Br)ccc5ccncc45)CC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6245	CCc1c(Br)ccc2ccncc12.OC(c1ccccc1)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(OC(c2ccccc2)c2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6246	CCc1c(Br)ccc2ccncc12.OC1c2ccccc2-c2ccc(CCc3c(Br)ccc4ccncc34)cc21>>CCc1c(OC2c3ccccc3c3ccc(CCc4c(Br)ccc5ccncc45)cc32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6247	CCc1c(Br)ccc2ccncc12.CCCC(O)c1ccccc1CCCc1c(Br)ccc2ccncc12>>CCCC(Oc1ccc2ccncc2c1CC)c1ccccc1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholMixAcyclic
snar_alcohol	6248	CCc1c(Br)ccc2ccncc12.OC1c2cc(CCc3c(Br)ccc4ccncc34)ccc2C2CCCCC12>>CCc1c(OC2c3cc(CCc4c(Br)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.SecondaryAlcoholMixCyclic
snar_alcohol	6249	CCc1c(Br)ccc2ccncc12.CC(CCc1c(Br)ccc2ccncc12)CC(C)(C)O>>CCc1c(OC(C)(C)CC(C)CCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.TertiaryAlcoholAcyclic
snar_alcohol	6250	CCc1c(Br)ccc2ccncc12.CC1(O)CCCC(CCc2c(Br)ccc3ccncc23)C1>>CCc1c(OC2(C)CCCC(CCc3c(Br)ccc4ccncc34)C2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.TertiaryAlcoholCyclic
snar_alcohol	6251	CCc1c(Br)ccc2ccncc12.Oc1ccccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2ccccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.Phenol
snar_alcohol	6252	CCc1c(Br)ccc2ccncc12.Oc1occc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2occc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PhenolHeteroaromatic5membered
snar_alcohol	6253	CCc1c(Br)ccc2ccncc12.Oc1ncccc1CCCc1c(Br)ccc2ccncc12>>CCc1c(Oc2ncccc2CCCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Bromide_PheHet6.PhenolHeteroaromatic6membered
snar_alcohol	6254	Cc1cocc1I.OCCCCCc1cocc1I>>Cc1cocc1OCCCCCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PrimaryAlcoholAliphatic
snar_alcohol	6255	Cc1cocc1I.OCc1ccccc1CCc1cocc1I>>Cc1cocc1OCc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PrimaryAlcoholAromatic
snar_alcohol	6256	Cc1cocc1I.CCC(O)CCCCc1cocc1I>>CCC(CCCCc1cocc1I)Oc1cocc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6257	Cc1cocc1I.OC1C2CCCCC2C2CCC(Cc3cocc3I)CC12>>Cc1cocc1OC1C2CCCCC2C2CCC(Cc3cocc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6258	Cc1cocc1I.OC(c1ccccc1)c1ccccc1CCc1cocc1I>>Cc1cocc1OC(c1ccccc1)c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6259	Cc1cocc1I.OC1c2ccccc2-c2ccc(Cc3cocc3I)cc21>>Cc1cocc1OC1c2ccccc2c2ccc(Cc3cocc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6260	Cc1cocc1I.CCCC(O)c1ccccc1CCc1cocc1I>>CCCC(Oc1cocc1C)c1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6261	Cc1cocc1I.OC1c2cc(Cc3cocc3I)ccc2C2CCCCC12>>Cc1cocc1OC1c2cc(Cc3cocc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6262	Cc1cocc1I.CC(Cc1cocc1I)CC(C)(C)O>>Cc1cocc1OC(C)(C)CC(C)Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.TertiaryAlcoholAcyclic
snar_alcohol	6263	Cc1cocc1I.CC1(O)CCCC(Cc2cocc2I)C1>>Cc1cocc1OC1(C)CCCC(Cc2cocc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.TertiaryAlcoholCyclic
snar_alcohol	6264	Cc1cocc1I.Oc1ccccc1CCc1cocc1I>>Cc1cocc1Oc1ccccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.Phenol
snar_alcohol	6265	Cc1cocc1I.Oc1occc1CCc1cocc1I>>Cc1cocc1Oc1occc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PhenolHeteroaromatic5membered
snar_alcohol	6266	Cc1cocc1I.Oc1ncccc1CCc1cocc1I>>Cc1cocc1Oc1ncccc1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5.PhenolHeteroaromatic6membered
snar_alcohol	6267	Cc1c(I)oc2cocc12.OCCCCCc1c(I)oc2cocc12>>Cc1c(OCCCCCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PrimaryAlcoholAliphatic
snar_alcohol	6268	Cc1c(I)oc2cocc12.OCc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(OCc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PrimaryAlcoholAromatic
snar_alcohol	6269	Cc1c(I)oc2cocc12.CCC(O)CCCCc1c(I)oc2cocc12>>CCC(CCCCc1c(I)oc2cocc12)Oc1oc2cocc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6270	Cc1c(I)oc2cocc12.OC1C2CCCCC2C2CCC(Cc3c(I)oc4cocc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)oc5cocc45)CC32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6271	Cc1c(I)oc2cocc12.OC(c1ccccc1)c1ccccc1CCc1c(I)oc2cocc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6272	Cc1c(I)oc2cocc12.OC1c2ccccc2-c2ccc(Cc3c(I)oc4cocc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)oc5cocc45)cc32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6273	Cc1c(I)oc2cocc12.CCCC(O)c1ccccc1CCc1c(I)oc2cocc12>>CCCC(Oc1oc2cocc2c1C)c1ccccc1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6274	Cc1c(I)oc2cocc12.OC1c2cc(Cc3c(I)oc4cocc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6275	Cc1c(I)oc2cocc12.CC(Cc1c(I)oc2cocc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.TertiaryAlcoholAcyclic
snar_alcohol	6276	Cc1c(I)oc2cocc12.CC1(O)CCCC(Cc2c(I)oc3cocc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)oc4cocc34)C2)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.TertiaryAlcoholCyclic
snar_alcohol	6277	Cc1c(I)oc2cocc12.Oc1ccccc1CCc1c(I)oc2cocc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.Phenol
snar_alcohol	6278	Cc1c(I)oc2cocc12.Oc1occc1CCc1c(I)oc2cocc12>>Cc1c(Oc2occc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PhenolHeteroaromatic5membered
snar_alcohol	6279	Cc1c(I)oc2cocc12.Oc1ncccc1CCc1c(I)oc2cocc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het5.PhenolHeteroaromatic6membered
snar_alcohol	6280	Cc1c(I)oc2ccncc12.OCCCCCc1c(I)oc2ccncc12>>Cc1c(OCCCCCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PrimaryAlcoholAliphatic
snar_alcohol	6281	Cc1c(I)oc2ccncc12.OCc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(OCc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PrimaryAlcoholAromatic
snar_alcohol	6282	Cc1c(I)oc2ccncc12.CCC(O)CCCCc1c(I)oc2ccncc12>>CCC(CCCCc1c(I)oc2ccncc12)Oc1oc2ccncc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6283	Cc1c(I)oc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(I)oc4ccncc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)oc5ccncc45)CC32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6284	Cc1c(I)oc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6285	Cc1c(I)oc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(I)oc4ccncc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)oc5ccncc45)cc32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6286	Cc1c(I)oc2ccncc12.CCCC(O)c1ccccc1CCc1c(I)oc2ccncc12>>CCCC(Oc1oc2ccncc2c1C)c1ccccc1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6287	Cc1c(I)oc2ccncc12.OC1c2cc(Cc3c(I)oc4ccncc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6288	Cc1c(I)oc2ccncc12.CC(Cc1c(I)oc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.TertiaryAlcoholAcyclic
snar_alcohol	6289	Cc1c(I)oc2ccncc12.CC1(O)CCCC(Cc2c(I)oc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)oc4ccncc34)C2)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.TertiaryAlcoholCyclic
snar_alcohol	6290	Cc1c(I)oc2ccncc12.Oc1ccccc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.Phenol
snar_alcohol	6291	Cc1c(I)oc2ccncc12.Oc1occc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2occc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PhenolHeteroaromatic5membered
snar_alcohol	6292	Cc1c(I)oc2ccncc12.Oc1ncccc1CCc1c(I)oc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Het6.PhenolHeteroaromatic6membered
snar_alcohol	6293	Cc1c(I)oc2ccccc12.OCCCCCc1c(I)oc2ccccc12>>Cc1c(OCCCCCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PrimaryAlcoholAliphatic
snar_alcohol	6294	Cc1c(I)oc2ccccc12.OCc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PrimaryAlcoholAromatic
snar_alcohol	6295	Cc1c(I)oc2ccccc12.CCC(O)CCCCc1c(I)oc2ccccc12>>CCC(CCCCc1c(I)oc2ccccc12)Oc1oc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6296	Cc1c(I)oc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(I)oc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)oc5ccccc45)CC32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6297	Cc1c(I)oc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6298	Cc1c(I)oc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(I)oc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)oc5ccccc45)cc32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6299	Cc1c(I)oc2ccccc12.CCCC(O)c1ccccc1CCc1c(I)oc2ccccc12>>CCCC(Oc1oc2ccccc2c1C)c1ccccc1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6300	Cc1c(I)oc2ccccc12.OC1c2cc(Cc3c(I)oc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6301	Cc1c(I)oc2ccccc12.CC(Cc1c(I)oc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.TertiaryAlcoholAcyclic
snar_alcohol	6302	Cc1c(I)oc2ccccc12.CC1(O)CCCC(Cc2c(I)oc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)oc4ccccc34)C2)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.TertiaryAlcoholCyclic
snar_alcohol	6303	Cc1c(I)oc2ccccc12.Oc1ccccc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.Phenol
snar_alcohol	6304	Cc1c(I)oc2ccccc12.Oc1occc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PhenolHeteroaromatic5membered
snar_alcohol	6305	Cc1c(I)oc2ccccc12.Oc1ncccc1CCc1c(I)oc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het5Phe.PhenolHeteroaromatic6membered
snar_alcohol	6306	Cc1cnccc1I.OCCCCCc1cnccc1I>>Cc1cnccc1OCCCCCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PrimaryAlcoholAliphatic
snar_alcohol	6307	Cc1cnccc1I.OCc1ccccc1CCc1cnccc1I>>Cc1cnccc1OCc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PrimaryAlcoholAromatic
snar_alcohol	6308	Cc1cnccc1I.CCC(O)CCCCc1cnccc1I>>CCC(CCCCc1cnccc1I)Oc1ccncc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6309	Cc1cnccc1I.OC1C2CCCCC2C2CCC(Cc3cnccc3I)CC12>>Cc1cnccc1OC1C2CCCCC2C2CCC(Cc3cnccc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6310	Cc1cnccc1I.OC(c1ccccc1)c1ccccc1CCc1cnccc1I>>Cc1cnccc1OC(c1ccccc1)c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6311	Cc1cnccc1I.OC1c2ccccc2-c2ccc(Cc3cnccc3I)cc21>>Cc1cnccc1OC1c2ccccc2c2ccc(Cc3cnccc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6312	Cc1cnccc1I.CCCC(O)c1ccccc1CCc1cnccc1I>>CCCC(Oc1ccncc1C)c1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6313	Cc1cnccc1I.OC1c2cc(Cc3cnccc3I)ccc2C2CCCCC12>>Cc1cnccc1OC1c2cc(Cc3cnccc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6314	Cc1cnccc1I.CC(Cc1cnccc1I)CC(C)(C)O>>Cc1cnccc1OC(C)(C)CC(C)Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.TertiaryAlcoholAcyclic
snar_alcohol	6315	Cc1cnccc1I.CC1(O)CCCC(Cc2cnccc2I)C1>>Cc1cnccc1OC1(C)CCCC(Cc2cnccc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.TertiaryAlcoholCyclic
snar_alcohol	6316	Cc1cnccc1I.Oc1ccccc1CCc1cnccc1I>>Cc1cnccc1Oc1ccccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.Phenol
snar_alcohol	6317	Cc1cnccc1I.Oc1occc1CCc1cnccc1I>>Cc1cnccc1Oc1occc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PhenolHeteroaromatic5membered
snar_alcohol	6318	Cc1cnccc1I.Oc1ncccc1CCc1cnccc1I>>Cc1cnccc1Oc1ncccc1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6.PhenolHeteroaromatic6membered
snar_alcohol	6319	Cc1nc2cocc2cc1I.OCCCCCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1OCCCCCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PrimaryAlcoholAliphatic
snar_alcohol	6320	Cc1nc2cocc2cc1I.OCc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1OCc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PrimaryAlcoholAromatic
snar_alcohol	6321	Cc1nc2cocc2cc1I.CCC(O)CCCCc1nc2cocc2cc1I>>CCC(CCCCc1nc2cocc2cc1I)Oc1cc2cocc2nc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6322	Cc1nc2cocc2cc1I.OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3I)CC12>>Cc1nc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6323	Cc1nc2cocc2cc1I.OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6324	Cc1nc2cocc2cc1I.OC1c2ccccc2-c2ccc(Cc3nc4cocc4cc3I)cc21>>Cc1nc2cocc2cc1OC1c2ccccc2c2ccc(Cc3nc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6325	Cc1nc2cocc2cc1I.CCCC(O)c1ccccc1CCc1nc2cocc2cc1I>>CCCC(Oc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6326	Cc1nc2cocc2cc1I.OC1c2cc(Cc3nc4cocc4cc3I)ccc2C2CCCCC12>>Cc1nc2cocc2cc1OC1c2cc(Cc3nc4cocc4cc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6327	Cc1nc2cocc2cc1I.CC(Cc1nc2cocc2cc1I)CC(C)(C)O>>Cc1nc2cocc2cc1OC(C)(C)CC(C)Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.TertiaryAlcoholAcyclic
snar_alcohol	6328	Cc1nc2cocc2cc1I.CC1(O)CCCC(Cc2nc3cocc3cc2I)C1>>Cc1nc2cocc2cc1OC1(C)CCCC(Cc2nc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.TertiaryAlcoholCyclic
snar_alcohol	6329	Cc1nc2cocc2cc1I.Oc1ccccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.Phenol
snar_alcohol	6330	Cc1nc2cocc2cc1I.Oc1occc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PhenolHeteroaromatic5membered
snar_alcohol	6331	Cc1nc2cocc2cc1I.Oc1ncccc1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het5.PhenolHeteroaromatic6membered
snar_alcohol	6332	Cc1c(I)ncc2ccncc12.OCCCCCc1c(I)ncc2ccncc12>>Cc1c(OCCCCCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PrimaryAlcoholAliphatic
snar_alcohol	6333	Cc1c(I)ncc2ccncc12.OCc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(OCc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PrimaryAlcoholAromatic
snar_alcohol	6334	Cc1c(I)ncc2ccncc12.CCC(O)CCCCc1c(I)ncc2ccncc12>>CCC(CCCCc1c(I)ncc2ccncc12)Oc1ncc2ccncc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6335	Cc1c(I)ncc2ccncc12.OC1C2CCCCC2C2CCC(Cc3c(I)ncc4ccncc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)ncc5ccncc45)CC32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6336	Cc1c(I)ncc2ccncc12.OC(c1ccccc1)c1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6337	Cc1c(I)ncc2ccncc12.OC1c2ccccc2-c2ccc(Cc3c(I)ncc4ccncc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)ncc5ccncc45)cc32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6338	Cc1c(I)ncc2ccncc12.CCCC(O)c1ccccc1CCc1c(I)ncc2ccncc12>>CCCC(Oc1ncc2ccncc2c1C)c1ccccc1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6339	Cc1c(I)ncc2ccncc12.OC1c2cc(Cc3c(I)ncc4ccncc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6340	Cc1c(I)ncc2ccncc12.CC(Cc1c(I)ncc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.TertiaryAlcoholAcyclic
snar_alcohol	6341	Cc1c(I)ncc2ccncc12.CC1(O)CCCC(Cc2c(I)ncc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)ncc4ccncc34)C2)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.TertiaryAlcoholCyclic
snar_alcohol	6342	Cc1c(I)ncc2ccncc12.Oc1ccccc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2ccccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.Phenol
snar_alcohol	6343	Cc1c(I)ncc2ccncc12.Oc1occc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2occc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PhenolHeteroaromatic5membered
snar_alcohol	6344	Cc1c(I)ncc2ccncc12.Oc1ncccc1CCc1c(I)ncc2ccncc12>>Cc1c(Oc2ncccc2CCc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Het6.PhenolHeteroaromatic6membered
snar_alcohol	6345	Cc1c(I)ncc2ccccc12.OCCCCCc1c(I)ncc2ccccc12>>Cc1c(OCCCCCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PrimaryAlcoholAliphatic
snar_alcohol	6346	Cc1c(I)ncc2ccccc12.OCc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(OCc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PrimaryAlcoholAromatic
snar_alcohol	6347	Cc1c(I)ncc2ccccc12.CCC(O)CCCCc1c(I)ncc2ccccc12>>CCC(CCCCc1c(I)ncc2ccccc12)Oc1ncc2ccccc2c1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6348	Cc1c(I)ncc2ccccc12.OC1C2CCCCC2C2CCC(Cc3c(I)ncc4ccccc34)CC12>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(I)ncc5ccccc45)CC32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6349	Cc1c(I)ncc2ccccc12.OC(c1ccccc1)c1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6350	Cc1c(I)ncc2ccccc12.OC1c2ccccc2-c2ccc(Cc3c(I)ncc4ccccc34)cc21>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(I)ncc5ccccc45)cc32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6351	Cc1c(I)ncc2ccccc12.CCCC(O)c1ccccc1CCc1c(I)ncc2ccccc12>>CCCC(Oc1ncc2ccccc2c1C)c1ccccc1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6352	Cc1c(I)ncc2ccccc12.OC1c2cc(Cc3c(I)ncc4ccccc34)ccc2C2CCCCC12>>Cc1c(OC2c3cc(Cc4c(I)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6353	Cc1c(I)ncc2ccccc12.CC(Cc1c(I)ncc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.TertiaryAlcoholAcyclic
snar_alcohol	6354	Cc1c(I)ncc2ccccc12.CC1(O)CCCC(Cc2c(I)ncc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(I)ncc4ccccc34)C2)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.TertiaryAlcoholCyclic
snar_alcohol	6355	Cc1c(I)ncc2ccccc12.Oc1ccccc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2ccccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.Phenol
snar_alcohol	6356	Cc1c(I)ncc2ccccc12.Oc1occc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2occc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PhenolHeteroaromatic5membered
snar_alcohol	6357	Cc1c(I)ncc2ccccc12.Oc1ncccc1CCc1c(I)ncc2ccccc12>>Cc1c(Oc2ncccc2CCc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_Het6Phe.PhenolHeteroaromatic6membered
snar_alcohol	6358	Cc1cc2cocc2cc1I.OCCCCCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1OCCCCCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PrimaryAlcoholAliphatic
snar_alcohol	6359	Cc1cc2cocc2cc1I.OCc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1OCc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PrimaryAlcoholAromatic
snar_alcohol	6360	Cc1cc2cocc2cc1I.CCC(O)CCCCc1cc2cocc2cc1I>>CCC(CCCCc1cc2cocc2cc1I)Oc1cc2cocc2cc1C	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6361	Cc1cc2cocc2cc1I.OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3I)CC12>>Cc1cc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3I)CC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6362	Cc1cc2cocc2cc1I.OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6363	Cc1cc2cocc2cc1I.OC1c2ccccc2-c2ccc(Cc3cc4cocc4cc3I)cc21>>Cc1cc2cocc2cc1OC1c2ccccc2c2ccc(Cc3cc4cocc4cc3I)cc21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6364	Cc1cc2cocc2cc1I.CCCC(O)c1ccccc1CCc1cc2cocc2cc1I>>CCCC(Oc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholMixAcyclic
snar_alcohol	6365	Cc1cc2cocc2cc1I.OC1c2cc(Cc3cc4cocc4cc3I)ccc2C2CCCCC12>>Cc1cc2cocc2cc1OC1c2cc(Cc3cc4cocc4cc3I)ccc2C2CCCCC21	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.SecondaryAlcoholMixCyclic
snar_alcohol	6366	Cc1cc2cocc2cc1I.CC(Cc1cc2cocc2cc1I)CC(C)(C)O>>Cc1cc2cocc2cc1OC(C)(C)CC(C)Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.TertiaryAlcoholAcyclic
snar_alcohol	6367	Cc1cc2cocc2cc1I.CC1(O)CCCC(Cc2cc3cocc3cc2I)C1>>Cc1cc2cocc2cc1OC1(C)CCCC(Cc2cc3cocc3cc2I)C1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.TertiaryAlcoholCyclic
snar_alcohol	6368	Cc1cc2cocc2cc1I.Oc1ccccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.Phenol
snar_alcohol	6369	Cc1cc2cocc2cc1I.Oc1occc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PhenolHeteroaromatic5membered
snar_alcohol	6370	Cc1cc2cocc2cc1I.Oc1ncccc1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet5.PhenolHeteroaromatic6membered
snar_alcohol	6371	CCc1c(I)ccc2ccncc12.OCCCCCCc1c(I)ccc2ccncc12>>CCc1c(OCCCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PrimaryAlcoholAliphatic
snar_alcohol	6372	CCc1c(I)ccc2ccncc12.OCc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(OCc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PrimaryAlcoholAromatic
snar_alcohol	6373	CCc1c(I)ccc2ccncc12.CCC(O)CCCCCc1c(I)ccc2ccncc12>>CCc1c(OC(CC)CCCCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6374	CCc1c(I)ccc2ccncc12.OC1C2CCCCC2C2CCC(CCc3c(I)ccc4ccncc34)CC12>>CCc1c(OC2C3CCCCC3C3CCC(CCc4c(I)ccc5ccncc45)CC32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6375	CCc1c(I)ccc2ccncc12.OC(c1ccccc1)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(OC(c2ccccc2)c2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6376	CCc1c(I)ccc2ccncc12.OC1c2ccccc2-c2ccc(CCc3c(I)ccc4ccncc34)cc21>>CCc1c(OC2c3ccccc3c3ccc(CCc4c(I)ccc5ccncc45)cc32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6377	CCc1c(I)ccc2ccncc12.CCCC(O)c1ccccc1CCCc1c(I)ccc2ccncc12>>CCCC(Oc1ccc2ccncc2c1CC)c1ccccc1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholMixAcyclic
snar_alcohol	6378	CCc1c(I)ccc2ccncc12.OC1c2cc(CCc3c(I)ccc4ccncc34)ccc2C2CCCCC12>>CCc1c(OC2c3cc(CCc4c(I)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.SecondaryAlcoholMixCyclic
snar_alcohol	6379	CCc1c(I)ccc2ccncc12.CC(CCc1c(I)ccc2ccncc12)CC(C)(C)O>>CCc1c(OC(C)(C)CC(C)CCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.TertiaryAlcoholAcyclic
snar_alcohol	6380	CCc1c(I)ccc2ccncc12.CC1(O)CCCC(CCc2c(I)ccc3ccncc23)C1>>CCc1c(OC2(C)CCCC(CCc3c(I)ccc4ccncc34)C2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.TertiaryAlcoholCyclic
snar_alcohol	6381	CCc1c(I)ccc2ccncc12.Oc1ccccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2ccccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.Phenol
snar_alcohol	6382	CCc1c(I)ccc2ccncc12.Oc1occc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2occc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PhenolHeteroaromatic5membered
snar_alcohol	6383	CCc1c(I)ccc2ccncc12.Oc1ncccc1CCCc1c(I)ccc2ccncc12>>CCc1c(Oc2ncccc2CCCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Iodide_PheHet6.PhenolHeteroaromatic6membered
snar_alcohol	6384	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCCCCO)C(F)(F)F>>Cc1cocc1OCCCCCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PrimaryAlcoholAliphatic
snar_alcohol	6385	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1CO)C(F)(F)F>>Cc1cocc1OCc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PrimaryAlcoholAromatic
snar_alcohol	6386	Cc1cocc1OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1cocc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cocc1OS(=O)(=O)C(F)(F)F)Oc1cocc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6387	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1cocc1OC1C2CCCCC2C2CCC(Cc3cocc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6388	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1cocc1OC(c1ccccc1)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6389	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1cocc1OC1c2ccccc2c2ccc(Cc3cocc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6390	Cc1cocc1OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F>>CCCC(Oc1cocc1C)c1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6391	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1cocc1OC1c2cc(Cc3cocc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6392	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC(Cc1cocc1OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1cocc1OC(C)(C)CC(C)Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.TertiaryAlcoholAcyclic
snar_alcohol	6393	Cc1cocc1OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cocc1OC1(C)CCCC(Cc2cocc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.TertiaryAlcoholCyclic
snar_alcohol	6394	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccccc1O)C(F)(F)F>>Cc1cocc1Oc1ccccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.Phenol
snar_alcohol	6395	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1ccoc1O)C(F)(F)F>>Cc1cocc1Oc1occc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PhenolHeteroaromatic5membered
snar_alcohol	6396	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1cccnc1O)C(F)(F)F>>Cc1cocc1Oc1ncccc1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5.PhenolHeteroaromatic6membered
snar_alcohol	6397	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PrimaryAlcoholAliphatic
snar_alcohol	6398	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PrimaryAlcoholAromatic
snar_alcohol	6399	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)Oc1oc2cocc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6400	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)CC32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6401	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6402	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)cc32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6403	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCCC(Oc1oc2cocc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6404	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5cocc45)ccc3C3CCCCC32)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6405	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.TertiaryAlcoholAcyclic
snar_alcohol	6406	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4cocc34)C2)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.TertiaryAlcoholCyclic
snar_alcohol	6407	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.Phenol
snar_alcohol	6408	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PhenolHeteroaromatic5membered
snar_alcohol	6409	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het5.PhenolHeteroaromatic6membered
snar_alcohol	6410	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PrimaryAlcoholAliphatic
snar_alcohol	6411	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PrimaryAlcoholAromatic
snar_alcohol	6412	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)Oc1oc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6413	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)CC32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6414	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6415	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)cc32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6416	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCCC(Oc1oc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6417	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccncc45)ccc3C3CCCCC32)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6418	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.TertiaryAlcoholAcyclic
snar_alcohol	6419	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccncc34)C2)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.TertiaryAlcoholCyclic
snar_alcohol	6420	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.Phenol
snar_alcohol	6421	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PhenolHeteroaromatic5membered
snar_alcohol	6422	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Het6.PhenolHeteroaromatic6membered
snar_alcohol	6423	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PrimaryAlcoholAliphatic
snar_alcohol	6424	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PrimaryAlcoholAromatic
snar_alcohol	6425	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)Oc1oc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6426	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)CC32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6427	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6428	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)cc32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6429	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCCC(Oc1oc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6430	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)oc5ccccc45)ccc3C3CCCCC32)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6431	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.TertiaryAlcoholAcyclic
snar_alcohol	6432	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)oc4ccccc34)C2)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.TertiaryAlcoholCyclic
snar_alcohol	6433	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.Phenol
snar_alcohol	6434	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PhenolHeteroaromatic5membered
snar_alcohol	6435	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het5Phe.PhenolHeteroaromatic6membered
snar_alcohol	6436	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCCCCO)C(F)(F)F>>Cc1cnccc1OCCCCCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PrimaryAlcoholAliphatic
snar_alcohol	6437	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1CO)C(F)(F)F>>Cc1cnccc1OCc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PrimaryAlcoholAromatic
snar_alcohol	6438	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cnccc1OS(=O)(=O)C(F)(F)F)Oc1ccncc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6439	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1cnccc1OC1C2CCCCC2C2CCC(Cc3cnccc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6440	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1cnccc1OC(c1ccccc1)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6441	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1cnccc1OC1c2ccccc2c2ccc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6442	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCCC(Oc1ccncc1C)c1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6443	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1cnccc1OC1c2cc(Cc3cnccc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6444	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC(Cc1cnccc1OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1cnccc1OC(C)(C)CC(C)Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.TertiaryAlcoholAcyclic
snar_alcohol	6445	Cc1cnccc1OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cnccc1OC1(C)CCCC(Cc2cnccc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.TertiaryAlcoholCyclic
snar_alcohol	6446	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccccc1O)C(F)(F)F>>Cc1cnccc1Oc1ccccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.Phenol
snar_alcohol	6447	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1ccoc1O)C(F)(F)F>>Cc1cnccc1Oc1occc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PhenolHeteroaromatic5membered
snar_alcohol	6448	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1cccnc1O)C(F)(F)F>>Cc1cnccc1Oc1ncccc1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6.PhenolHeteroaromatic6membered
snar_alcohol	6449	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCCCCO)C(F)(F)F>>Cc1nc2cocc2cc1OCCCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PrimaryAlcoholAliphatic
snar_alcohol	6450	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1CO)C(F)(F)F>>Cc1nc2cocc2cc1OCc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PrimaryAlcoholAromatic
snar_alcohol	6451	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)Oc1cc2cocc2nc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6452	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1nc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6453	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1nc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6454	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1nc2cocc2cc1OC1c2ccccc2c2ccc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6455	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCC(Oc1cc2cocc2nc1C)c1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholMixAcyclic
snar_alcohol	6456	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1nc2cocc2cc1OC1c2cc(Cc3nc4cocc4cc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.SecondaryAlcoholMixCyclic
snar_alcohol	6457	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC(Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1nc2cocc2cc1OC(C)(C)CC(C)Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.TertiaryAlcoholAcyclic
snar_alcohol	6458	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1nc2cocc2cc1OC1(C)CCCC(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.TertiaryAlcoholCyclic
snar_alcohol	6459	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccccc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1ccccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.Phenol
snar_alcohol	6460	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1ccoc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1occc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PhenolHeteroaromatic5membered
snar_alcohol	6461	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1cccnc1O)C(F)(F)F>>Cc1nc2cocc2cc1Oc1ncccc1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het5.PhenolHeteroaromatic6membered
snar_alcohol	6462	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PrimaryAlcoholAliphatic
snar_alcohol	6463	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PrimaryAlcoholAromatic
snar_alcohol	6464	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)Oc1ncc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6465	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)CC32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6466	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6467	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)cc32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6468	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCCC(Oc1ncc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholMixAcyclic
snar_alcohol	6469	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccncc45)ccc3C3CCCCC32)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.SecondaryAlcoholMixCyclic
snar_alcohol	6470	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.TertiaryAlcoholAcyclic
snar_alcohol	6471	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccncc34)C2)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.TertiaryAlcoholCyclic
snar_alcohol	6472	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.Phenol
snar_alcohol	6473	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PhenolHeteroaromatic5membered
snar_alcohol	6474	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Het6.PhenolHeteroaromatic6membered
snar_alcohol	6475	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PrimaryAlcoholAliphatic
snar_alcohol	6476	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PrimaryAlcoholAromatic
snar_alcohol	6477	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)Oc1ncc2ccccc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6478	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)CC32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6479	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6480	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)cc32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholAromaticCyclic
snar_alcohol	6481	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCCC(Oc1ncc2ccccc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholMixAcyclic
snar_alcohol	6482	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ncc5ccccc45)ccc3C3CCCCC32)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.SecondaryAlcoholMixCyclic
snar_alcohol	6483	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.TertiaryAlcoholAcyclic
snar_alcohol	6484	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ncc4ccccc34)C2)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.TertiaryAlcoholCyclic
snar_alcohol	6485	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.Phenol
snar_alcohol	6486	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PhenolHeteroaromatic5membered
snar_alcohol	6487	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_Het6Phe.PhenolHeteroaromatic6membered
snar_alcohol	6488	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCCCCO)C(F)(F)F>>Cc1cc2cocc2cc1OCCCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PrimaryAlcoholAliphatic
snar_alcohol	6489	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1CO)C(F)(F)F>>Cc1cc2cocc2cc1OCc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PrimaryAlcoholAromatic
snar_alcohol	6490	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCC(O)CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC(CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)Oc1cc2cocc2cc1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6491	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1cc2cocc2cc1OC1C2CCCCC2C2CCC(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)CC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6492	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1cc2cocc2cc1OC(c1ccccc1)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6493	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1cc2cocc2cc1OC1c2ccccc2c2ccc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)cc21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholAromaticCyclic
snar_alcohol	6494	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCC(Oc1cc2cocc2cc1C)c1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholMixAcyclic
snar_alcohol	6495	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1cc2cocc2cc1OC1c2cc(Cc3cc4cocc4cc3OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.SecondaryAlcoholMixCyclic
snar_alcohol	6496	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC(Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>Cc1cc2cocc2cc1OC(C)(C)CC(C)Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.TertiaryAlcoholAcyclic
snar_alcohol	6497	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1>>Cc1cc2cocc2cc1OC1(C)CCCC(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)C1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.TertiaryAlcoholCyclic
snar_alcohol	6498	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccccc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1ccccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.Phenol
snar_alcohol	6499	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1ccoc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1occc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PhenolHeteroaromatic5membered
snar_alcohol	6500	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1cccnc1O)C(F)(F)F>>Cc1cc2cocc2cc1Oc1ncccc1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet5.PhenolHeteroaromatic6membered
snar_alcohol	6501	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCCCCO)C(F)(F)F>>Cc1c(OCCCCCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PrimaryAlcoholAliphatic
snar_alcohol	6502	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1CO)C(F)(F)F>>Cc1c(OCc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PrimaryAlcoholAromatic
snar_alcohol	6503	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CCC(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCC(CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)Oc1ccc2ccncc2c1C	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholAliphaticAcyclic
snar_alcohol	6504	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CC1CCC2C(C1)C(O)C1CCCCC12)C(F)(F)F>>Cc1c(OC2C3CCCCC3C3CCC(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)CC32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholAliphaticCyclic
snar_alcohol	6505	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1C(O)c1ccccc1)C(F)(F)F>>Cc1c(OC(c2ccccc2)c2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholAromaticAcyclic
snar_alcohol	6506	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)C(O)c1ccccc1-2)C(F)(F)F>>Cc1c(OC2c3ccccc3c3ccc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)cc32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholAromaticCyclic
snar_alcohol	6507	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CCCC(O)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCCC(Oc1ccc2ccncc2c1C)c1ccccc1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholMixAcyclic
snar_alcohol	6508	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccc2c(c1)C(O)C1CCCCC21)C(F)(F)F>>Cc1c(OC2c3cc(Cc4c(OS(=O)(=O)C(F)(F)F)ccc5ccncc45)ccc3C3CCCCC32)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.SecondaryAlcoholMixCyclic
snar_alcohol	6509	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC(Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)CC(C)(C)O>>Cc1c(OC(C)(C)CC(C)Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.TertiaryAlcoholAcyclic
snar_alcohol	6510	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.CC1(O)CCCC(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)C1>>Cc1c(OC2(C)CCCC(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)C2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.TertiaryAlcoholCyclic
snar_alcohol	6511	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccccc1O)C(F)(F)F>>Cc1c(Oc2ccccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.Phenol
snar_alcohol	6512	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1ccoc1O)C(F)(F)F>>Cc1c(Oc2occc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PhenolHeteroaromatic5membered
snar_alcohol	6513	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1cccnc1O)C(F)(F)F>>Cc1c(Oc2ncccc2CCc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[a:2][O:3][#6:4]	X-Triflate_PheHet6.PhenolHeteroaromatic6membered
snar_amine	6514	Cc1ccccc1Cl.NCCNCCCCc1ccccc1Cl>>Cc1ccccc1N(CCN)CCCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6515	Cc1ccccc1Cl.NC=CNCCCCc1ccccc1Cl>>Cc1ccccc1N(C=CN)CCCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6516	Cc1ccccc1Cl.NC=CNC=CCCc1ccccc1Cl>>Cc1ccccc1N(C=CN)C=CCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6517	Cc1ccccc1Cl.NC1CNCC(CCc2ccccc2Cl)C1>>Cc1ccccc1N1CC(N)CC(CCc2ccccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6518	Cc1ccccc1Cl.Clc1ccccc1CCC1CC=CNC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6519	Cc1ccccc1Cl.Clc1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6520	Cc1ccccc1Cl.NCCNCCCc1ccccc1Cl>>Cc1ccccc1NCCNCCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_SaturatedAliphatic
snar_amine	6521	Cc1ccccc1Cl.NC=CNCCCc1ccccc1Cl>>Cc1ccccc1NC=CNCCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6522	Cc1ccccc1Cl.Nc1cccc(CCc2ccccc2Cl)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cccc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6523	Cc1ccccc1Cl.NCCNc1ccccc1CCCc1ccccc1Cl>>Cc1ccccc1N(CCN)c1ccccc1CCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6524	Cc1ccccc1Cl.NC=CNc1ccccc1CCc1ccccc1Cl>>Cc1ccccc1N(C=CN)c1ccccc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6525	Cc1ccccc1Cl.Clc1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1N1c2ccccc2CCC(Cc2ccccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6526	Cc1ccccc1Cl.Clc1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ccc(Cc3ccccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6527	Cc1ccccc1Cl.Clc1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ccc(Cc3ccccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6528	Cc1ccccc1Cl.Nc1cccc(CCc2ccccc2Cl)c1N>>Cc1ccccc1Nc1cccc(CCc2ccccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Phe
snar_amine	6529	Cc1ccccc1Cl.Nc1cc2ccc(CCc3ccccc3Cl)cc2cc1N>>Cc1ccccc1Nc1cc2ccc(CCc3ccccc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_PhePhe
snar_amine	6530	Cc1ccccc1Cl.Nc1cncc(CCc2ccccc2Cl)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cncc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6531	Cc1ccccc1Cl.Nc1cncc(CCc2ccccc2Cl)c1Nc1cccnc1>>Cc1ccccc1N(c1cccnc1)c1c(N)cncc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6532	Cc1ccccc1Cl.NCCNc1ccncc1CCc1ccccc1Cl>>Cc1ccccc1N(CCN)c1ccncc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6533	Cc1ccccc1Cl.NC=CNc1ccncc1CCc1ccccc1Cl>>Cc1ccccc1N(C=CN)c1ccncc1CCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6534	Cc1ccccc1Cl.Clc1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1N1c2cnccc2CCC(Cc2ccccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6535	Cc1ccccc1Cl.Clc1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1N1c2ccncc2CCC(Cc2ccccc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6536	Cc1ccccc1Cl.Clc1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ncc(Cc3ccccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6537	Cc1ccccc1Cl.Clc1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ncc(Cc3ccccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6538	Cc1ccccc1Cl.Nc1occ(CCc2ccccc2Cl)c1N>>Cc1ccccc1Nc1occ(CCc2ccccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het5
snar_amine	6539	Cc1ccccc1Cl.Nc1oc2c(CCc3ccccc3Cl)occ2c1N>>Cc1ccccc1Nc1oc2c(CCc3ccccc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het5Het5
snar_amine	6540	Cc1ccccc1Cl.Nc1oc2cc(CCc3ccccc3Cl)ncc2c1N>>Cc1ccccc1Nc1oc2cc(CCc3ccccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het5Het6
snar_amine	6541	Cc1ccccc1Cl.Nc1oc2ccc(CCc3ccccc3Cl)cc2c1N>>Cc1ccccc1Nc1oc2ccc(CCc3ccccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het5Phe
snar_amine	6542	Cc1ccccc1Cl.Nc1nccc(CCc2ccccc2Cl)c1N>>Cc1ccccc1Nc1nccc(CCc2ccccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het6
snar_amine	6543	Cc1ccccc1Cl.Nc1c(Cc2ccccc2Cl)nc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het6Het5
snar_amine	6544	Cc1ccccc1Cl.Nc1ncc2cc(CCc3ccccc3Cl)ncc2c1N>>Cc1ccccc1Nc1ncc2cc(CCc3ccccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het6Het6
snar_amine	6545	Cc1ccccc1Cl.Nc1ncc2ccc(CCc3ccccc3Cl)cc2c1N>>Cc1ccccc1Nc1ncc2ccc(CCc3ccccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_Het6Phe
snar_amine	6546	Cc1ccccc1Cl.Nc1c(Cc2ccccc2Cl)cc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_PheHet5
snar_amine	6547	Cc1ccccc1Cl.Nc1cc2cncc(CCc3ccccc3Cl)c2cc1N>>Cc1ccccc1Nc1cc2cncc(CCc3ccccc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Amine_Primary_PheHet6
snar_amine	6548	Cc1ccccc1Cl.NCc1ccccc1CCCc1ccccc1Cl>>Cc1ccccc1NCc1ccccc1CCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.Benzylamine_primary
snar_amine	6549	Cc1ccccc1Cl.NCc1cnccc1CCCc1ccccc1Cl>>Cc1ccccc1NCc1cnccc1CCCc1ccccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Phe.HeteroBenzylamine_primary
snar_amine	6550	Cc1c(Cl)ccc2ccccc12.NCCNCCCCc1c(Cl)ccc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6551	Cc1c(Cl)ccc2ccccc12.NC=CNCCCCc1c(Cl)ccc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6552	Cc1c(Cl)ccc2ccccc12.NC=CNC=CCCc1c(Cl)ccc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6553	Cc1c(Cl)ccc2ccccc12.NC1CNCC(CCc2c(Cl)ccc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)ccc4ccccc34)C2)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6554	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)ccc4ccccc34)C2)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6555	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)ccc4ccccc34)C=C2)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6556	Cc1c(Cl)ccc2ccccc12.NCCNCCCc1c(Cl)ccc2ccccc12>>Cc1c(NCCNCCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_SaturatedAliphatic
snar_amine	6557	Cc1c(Cl)ccc2ccccc12.NC=CNCCCc1c(Cl)ccc2ccccc12>>Cc1c(NC=CNCCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6558	Cc1c(Cl)ccc2ccccc12.Nc1cccc(CCc2c(Cl)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6559	Cc1c(Cl)ccc2ccccc12.NCCNc1ccccc1CCCc1c(Cl)ccc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6560	Cc1c(Cl)ccc2ccccc12.NC=CNc1ccccc1CCc1c(Cl)ccc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6561	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6562	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)ccc5ccccc45)cc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6563	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)ccc5ccccc45)cc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6564	Cc1c(Cl)ccc2ccccc12.Nc1cccc(CCc2c(Cl)ccc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)ccc4ccccc34)c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Phe
snar_amine	6565	Cc1c(Cl)ccc2ccccc12.Nc1cc2ccc(CCc3c(Cl)ccc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)ccc5ccccc45)cc3cc2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_PhePhe
snar_amine	6566	Cc1c(Cl)ccc2ccccc12.Nc1cncc(CCc2c(Cl)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6567	Cc1c(Cl)ccc2ccccc12.Nc1cncc(CCc2c(Cl)ccc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6568	Cc1c(Cl)ccc2ccccc12.NCCNc1ccncc1CCc1c(Cl)ccc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6569	Cc1c(Cl)ccc2ccccc12.NC=CNc1ccncc1CCc1c(Cl)ccc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6570	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6571	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)ccc4ccccc34)Cc3ccncc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6572	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)ccc5ccccc45)cc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6573	Cc1c(Cl)ccc2ccccc12.Clc1ccc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)ccc5ccccc45)cc32)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6574	Cc1c(Cl)ccc2ccccc12.Nc1occ(CCc2c(Cl)ccc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)ccc4ccccc34)c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het5
snar_amine	6575	Cc1c(Cl)ccc2ccccc12.Nc1oc2c(CCc3c(Cl)ccc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)ccc5ccccc45)occ3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het5Het5
snar_amine	6576	Cc1c(Cl)ccc2ccccc12.Nc1oc2cc(CCc3c(Cl)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het5Het6
snar_amine	6577	Cc1c(Cl)ccc2ccccc12.Nc1oc2ccc(CCc3c(Cl)ccc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)ccc5ccccc45)cc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het5Phe
snar_amine	6578	Cc1c(Cl)ccc2ccccc12.Nc1nccc(CCc2c(Cl)ccc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)ccc4ccccc34)c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het6
snar_amine	6579	Cc1c(Cl)ccc2ccccc12.Nc1c(Cc2c(Cl)ccc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ccc4ccccc34)nc3cocc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het6Het5
snar_amine	6580	Cc1c(Cl)ccc2ccccc12.Nc1ncc2cc(CCc3c(Cl)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het6Het6
snar_amine	6581	Cc1c(Cl)ccc2ccccc12.Nc1ncc2ccc(CCc3c(Cl)ccc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)ccc5ccccc45)cc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_Het6Phe
snar_amine	6582	Cc1c(Cl)ccc2ccccc12.Nc1c(Cc2c(Cl)ccc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ccc4ccccc34)cc3cocc3c2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_PheHet5
snar_amine	6583	Cc1c(Cl)ccc2ccccc12.Nc1cc2cncc(CCc3c(Cl)ccc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)ccc5ccccc45)c3cc2N)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Amine_Primary_PheHet6
snar_amine	6584	Cc1c(Cl)ccc2ccccc12.NCc1ccccc1CCCc1c(Cl)ccc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.Benzylamine_primary
snar_amine	6585	Cc1c(Cl)ccc2ccccc12.NCc1cnccc1CCCc1c(Cl)ccc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)ccc3ccccc23)ccc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PhePhe.HeteroBenzylamine_primary
snar_amine	6586	Cc1cocc1Cl.NCCNCCCCc1cocc1Cl>>Cc1cocc1N(CCN)CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6587	Cc1cocc1Cl.NC=CNCCCCc1cocc1Cl>>Cc1cocc1N(C=CN)CCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6588	Cc1cocc1Cl.NC=CNC=CCCc1cocc1Cl>>Cc1cocc1N(C=CN)C=CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6589	Cc1cocc1Cl.NC1CNCC(CCc2cocc2Cl)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6590	Cc1cocc1Cl.Clc1cocc1CCC1CC=CNC1>>Cc1cocc1N1C=CCC(CCc2cocc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6591	Cc1cocc1Cl.Clc1cocc1CCC1C=CNC=CC1>>Cc1cocc1N1C=CCC(CCc2cocc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6592	Cc1cocc1Cl.NCCNCCCc1cocc1Cl>>Cc1cocc1NCCNCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_SaturatedAliphatic
snar_amine	6593	Cc1cocc1Cl.NC=CNCCCc1cocc1Cl>>Cc1cocc1NC=CNCCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	6594	Cc1cocc1Cl.Nc1cccc(CCc2cocc2Cl)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6595	Cc1cocc1Cl.NCCNc1ccccc1CCCc1cocc1Cl>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6596	Cc1cocc1Cl.NC=CNc1ccccc1CCc1cocc1Cl>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6597	Cc1cocc1Cl.Clc1cocc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6598	Cc1cocc1Cl.Clc1cocc1Cc1ccc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ccc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6599	Cc1cocc1Cl.Clc1cocc1Cc1ccc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6600	Cc1cocc1Cl.Nc1cccc(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Phe
snar_amine	6601	Cc1cocc1Cl.Nc1cc2ccc(CCc3cocc3Cl)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PhePhe
snar_amine	6602	Cc1cocc1Cl.Nc1cncc(CCc2cocc2Cl)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6603	Cc1cocc1Cl.Nc1cncc(CCc2cocc2Cl)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6604	Cc1cocc1Cl.NCCNc1ccncc1CCc1cocc1Cl>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6605	Cc1cocc1Cl.NC=CNc1ccncc1CCc1cocc1Cl>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6606	Cc1cocc1Cl.Clc1cocc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6607	Cc1cocc1Cl.Clc1cocc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6608	Cc1cocc1Cl.Clc1cocc1Cc1cnc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ncc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6609	Cc1cocc1Cl.Clc1cocc1Cc1cnc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6610	Cc1cocc1Cl.Nc1occ(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1occ(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5
snar_amine	6611	Cc1cocc1Cl.Nc1oc2c(CCc3cocc3Cl)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Het5
snar_amine	6612	Cc1cocc1Cl.Nc1oc2cc(CCc3cocc3Cl)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Het6
snar_amine	6613	Cc1cocc1Cl.Nc1oc2ccc(CCc3cocc3Cl)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het5Phe
snar_amine	6614	Cc1cocc1Cl.Nc1nccc(CCc2cocc2Cl)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6
snar_amine	6615	Cc1cocc1Cl.Nc1c(Cc2cocc2Cl)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Het5
snar_amine	6616	Cc1cocc1Cl.Nc1ncc2cc(CCc3cocc3Cl)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Het6
snar_amine	6617	Cc1cocc1Cl.Nc1ncc2ccc(CCc3cocc3Cl)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_Het6Phe
snar_amine	6618	Cc1cocc1Cl.Nc1c(Cc2cocc2Cl)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PheHet5
snar_amine	6619	Cc1cocc1Cl.Nc1cc2cncc(CCc3cocc3Cl)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Amine_Primary_PheHet6
snar_amine	6620	Cc1cocc1Cl.NCc1ccccc1CCCc1cocc1Cl>>Cc1cocc1NCc1ccccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.Benzylamine_primary
snar_amine	6621	Cc1cocc1Cl.NCc1cnccc1CCCc1cocc1Cl>>Cc1cocc1NCc1cnccc1CCCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5.HeteroBenzylamine_primary
snar_amine	6622	Cc1c(Cl)oc2cocc12.NCCNCCCCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6623	Cc1c(Cl)oc2cocc12.NC=CNCCCCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6624	Cc1c(Cl)oc2cocc12.NC=CNC=CCCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6625	Cc1c(Cl)oc2cocc12.NC1CNCC(CCc2c(Cl)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4cocc34)C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6626	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4cocc34)C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6627	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4cocc34)C=C2)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6628	Cc1c(Cl)oc2cocc12.NCCNCCCc1c(Cl)oc2cocc12>>Cc1c(NCCNCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_SaturatedAliphatic
snar_amine	6629	Cc1c(Cl)oc2cocc12.NC=CNCCCc1c(Cl)oc2cocc12>>Cc1c(NC=CNCCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	6630	Cc1c(Cl)oc2cocc12.Nc1cccc(CCc2c(Cl)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6631	Cc1c(Cl)oc2cocc12.NCCNc1ccccc1CCCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6632	Cc1c(Cl)oc2cocc12.NC=CNc1ccccc1CCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6633	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccccc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6634	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6635	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6636	Cc1c(Cl)oc2cocc12.Nc1cccc(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Phe
snar_amine	6637	Cc1c(Cl)oc2cocc12.Nc1cc2ccc(CCc3c(Cl)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5cocc45)cc3cc2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PhePhe
snar_amine	6638	Cc1c(Cl)oc2cocc12.Nc1cncc(CCc2c(Cl)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6639	Cc1c(Cl)oc2cocc12.Nc1cncc(CCc2c(Cl)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6640	Cc1c(Cl)oc2cocc12.NCCNc1ccncc1CCc1c(Cl)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6641	Cc1c(Cl)oc2cocc12.NC=CNc1ccncc1CCc1c(Cl)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6642	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccccc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6643	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4cocc34)Cc3ccncc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6644	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6645	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5cocc45)cc32)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6646	Cc1c(Cl)oc2cocc12.Nc1occ(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5
snar_amine	6647	Cc1c(Cl)oc2cocc12.Nc1oc2c(CCc3c(Cl)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5cocc45)occ3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Het5
snar_amine	6648	Cc1c(Cl)oc2cocc12.Nc1oc2cc(CCc3c(Cl)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5cocc45)ncc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Het6
snar_amine	6649	Cc1c(Cl)oc2cocc12.Nc1oc2ccc(CCc3c(Cl)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5cocc45)cc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het5Phe
snar_amine	6650	Cc1c(Cl)oc2cocc12.Nc1nccc(CCc2c(Cl)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4cocc34)c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6
snar_amine	6651	Cc1c(Cl)oc2cocc12.Nc1c(Cc2c(Cl)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4cocc34)nc3cocc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Het5
snar_amine	6652	Cc1c(Cl)oc2cocc12.Nc1ncc2cc(CCc3c(Cl)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5cocc45)ncc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Het6
snar_amine	6653	Cc1c(Cl)oc2cocc12.Nc1ncc2ccc(CCc3c(Cl)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5cocc45)cc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_Het6Phe
snar_amine	6654	Cc1c(Cl)oc2cocc12.Nc1c(Cc2c(Cl)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4cocc34)cc3cocc3c2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PheHet5
snar_amine	6655	Cc1c(Cl)oc2cocc12.Nc1cc2cncc(CCc3c(Cl)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5cocc45)c3cc2N)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Amine_Primary_PheHet6
snar_amine	6656	Cc1c(Cl)oc2cocc12.NCc1ccccc1CCCc1c(Cl)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.Benzylamine_primary
snar_amine	6657	Cc1c(Cl)oc2cocc12.NCc1cnccc1CCCc1c(Cl)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het5.HeteroBenzylamine_primary
snar_amine	6658	Cc1c(Cl)oc2ccncc12.NCCNCCCCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6659	Cc1c(Cl)oc2ccncc12.NC=CNCCCCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6660	Cc1c(Cl)oc2ccncc12.NC=CNC=CCCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6661	Cc1c(Cl)oc2ccncc12.NC1CNCC(CCc2c(Cl)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4ccncc34)C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6662	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccncc34)C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6663	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccncc34)C=C2)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6664	Cc1c(Cl)oc2ccncc12.NCCNCCCc1c(Cl)oc2ccncc12>>Cc1c(NCCNCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_SaturatedAliphatic
snar_amine	6665	Cc1c(Cl)oc2ccncc12.NC=CNCCCc1c(Cl)oc2ccncc12>>Cc1c(NC=CNCCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	6666	Cc1c(Cl)oc2ccncc12.Nc1cccc(CCc2c(Cl)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6667	Cc1c(Cl)oc2ccncc12.NCCNc1ccccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6668	Cc1c(Cl)oc2ccncc12.NC=CNc1ccccc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6669	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6670	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6671	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6672	Cc1c(Cl)oc2ccncc12.Nc1cccc(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Phe
snar_amine	6673	Cc1c(Cl)oc2ccncc12.Nc1cc2ccc(CCc3c(Cl)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5ccncc45)cc3cc2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PhePhe
snar_amine	6674	Cc1c(Cl)oc2ccncc12.Nc1cncc(CCc2c(Cl)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6675	Cc1c(Cl)oc2ccncc12.Nc1cncc(CCc2c(Cl)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6676	Cc1c(Cl)oc2ccncc12.NCCNc1ccncc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6677	Cc1c(Cl)oc2ccncc12.NC=CNc1ccncc1CCc1c(Cl)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6678	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6679	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6680	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6681	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5ccncc45)cc32)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6682	Cc1c(Cl)oc2ccncc12.Nc1occ(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5
snar_amine	6683	Cc1c(Cl)oc2ccncc12.Nc1oc2c(CCc3c(Cl)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5ccncc45)occ3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Het5
snar_amine	6684	Cc1c(Cl)oc2ccncc12.Nc1oc2cc(CCc3c(Cl)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5ccncc45)ncc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Het6
snar_amine	6685	Cc1c(Cl)oc2ccncc12.Nc1oc2ccc(CCc3c(Cl)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5ccncc45)cc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het5Phe
snar_amine	6686	Cc1c(Cl)oc2ccncc12.Nc1nccc(CCc2c(Cl)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4ccncc34)c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6
snar_amine	6687	Cc1c(Cl)oc2ccncc12.Nc1c(Cc2c(Cl)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Het5
snar_amine	6688	Cc1c(Cl)oc2ccncc12.Nc1ncc2cc(CCc3c(Cl)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5ccncc45)ncc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Het6
snar_amine	6689	Cc1c(Cl)oc2ccncc12.Nc1ncc2ccc(CCc3c(Cl)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5ccncc45)cc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_Het6Phe
snar_amine	6690	Cc1c(Cl)oc2ccncc12.Nc1c(Cc2c(Cl)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PheHet5
snar_amine	6691	Cc1c(Cl)oc2ccncc12.Nc1cc2cncc(CCc3c(Cl)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5ccncc45)c3cc2N)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Amine_Primary_PheHet6
snar_amine	6692	Cc1c(Cl)oc2ccncc12.NCc1ccccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.Benzylamine_primary
snar_amine	6693	Cc1c(Cl)oc2ccncc12.NCc1cnccc1CCCc1c(Cl)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Het6.HeteroBenzylamine_primary
snar_amine	6694	Cc1c(Cl)oc2ccccc12.NCCNCCCCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6695	Cc1c(Cl)oc2ccccc12.NC=CNCCCCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6696	Cc1c(Cl)oc2ccccc12.NC=CNC=CCCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6697	Cc1c(Cl)oc2ccccc12.NC1CNCC(CCc2c(Cl)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)oc4ccccc34)C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6698	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccccc34)C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6699	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)oc4ccccc34)C=C2)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6700	Cc1c(Cl)oc2ccccc12.NCCNCCCc1c(Cl)oc2ccccc12>>Cc1c(NCCNCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_SaturatedAliphatic
snar_amine	6701	Cc1c(Cl)oc2ccccc12.NC=CNCCCc1c(Cl)oc2ccccc12>>Cc1c(NC=CNCCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6702	Cc1c(Cl)oc2ccccc12.Nc1cccc(CCc2c(Cl)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6703	Cc1c(Cl)oc2ccccc12.NCCNc1ccccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6704	Cc1c(Cl)oc2ccccc12.NC=CNc1ccccc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6705	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6706	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6707	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6708	Cc1c(Cl)oc2ccccc12.Nc1cccc(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Phe
snar_amine	6709	Cc1c(Cl)oc2ccccc12.Nc1cc2ccc(CCc3c(Cl)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)oc5ccccc45)cc3cc2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PhePhe
snar_amine	6710	Cc1c(Cl)oc2ccccc12.Nc1cncc(CCc2c(Cl)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6711	Cc1c(Cl)oc2ccccc12.Nc1cncc(CCc2c(Cl)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6712	Cc1c(Cl)oc2ccccc12.NCCNc1ccncc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6713	Cc1c(Cl)oc2ccccc12.NC=CNc1ccncc1CCc1c(Cl)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6714	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6715	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6716	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6717	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)oc5ccccc45)cc32)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6718	Cc1c(Cl)oc2ccccc12.Nc1occ(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5
snar_amine	6719	Cc1c(Cl)oc2ccccc12.Nc1oc2c(CCc3c(Cl)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)oc5ccccc45)occ3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Het5
snar_amine	6720	Cc1c(Cl)oc2ccccc12.Nc1oc2cc(CCc3c(Cl)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)oc5ccccc45)ncc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Het6
snar_amine	6721	Cc1c(Cl)oc2ccccc12.Nc1oc2ccc(CCc3c(Cl)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)oc5ccccc45)cc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het5Phe
snar_amine	6722	Cc1c(Cl)oc2ccccc12.Nc1nccc(CCc2c(Cl)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)oc4ccccc34)c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6
snar_amine	6723	Cc1c(Cl)oc2ccccc12.Nc1c(Cc2c(Cl)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Het5
snar_amine	6724	Cc1c(Cl)oc2ccccc12.Nc1ncc2cc(CCc3c(Cl)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)oc5ccccc45)ncc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Het6
snar_amine	6725	Cc1c(Cl)oc2ccccc12.Nc1ncc2ccc(CCc3c(Cl)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)oc5ccccc45)cc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_Het6Phe
snar_amine	6726	Cc1c(Cl)oc2ccccc12.Nc1c(Cc2c(Cl)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PheHet5
snar_amine	6727	Cc1c(Cl)oc2ccccc12.Nc1cc2cncc(CCc3c(Cl)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)oc5ccccc45)c3cc2N)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Amine_Primary_PheHet6
snar_amine	6728	Cc1c(Cl)oc2ccccc12.NCc1ccccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.Benzylamine_primary
snar_amine	6729	Cc1c(Cl)oc2ccccc12.NCc1cnccc1CCCc1c(Cl)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het5Phe.HeteroBenzylamine_primary
snar_amine	6730	Cc1cnccc1Cl.NCCNCCCCc1cnccc1Cl>>Cc1cnccc1N(CCN)CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6731	Cc1cnccc1Cl.NC=CNCCCCc1cnccc1Cl>>Cc1cnccc1N(C=CN)CCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6732	Cc1cnccc1Cl.NC=CNC=CCCc1cnccc1Cl>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6733	Cc1cnccc1Cl.NC1CNCC(CCc2cnccc2Cl)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6734	Cc1cnccc1Cl.Clc1ccncc1CCC1CC=CNC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6735	Cc1cnccc1Cl.Clc1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6736	Cc1cnccc1Cl.NCCNCCCc1cnccc1Cl>>Cc1cnccc1NCCNCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_SaturatedAliphatic
snar_amine	6737	Cc1cnccc1Cl.NC=CNCCCc1cnccc1Cl>>Cc1cnccc1NC=CNCCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	6738	Cc1cnccc1Cl.Nc1cccc(CCc2cnccc2Cl)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6739	Cc1cnccc1Cl.NCCNc1ccccc1CCCc1cnccc1Cl>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6740	Cc1cnccc1Cl.NC=CNc1ccccc1CCc1cnccc1Cl>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6741	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6742	Cc1cnccc1Cl.Clc1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6743	Cc1cnccc1Cl.Clc1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6744	Cc1cnccc1Cl.Nc1cccc(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Phe
snar_amine	6745	Cc1cnccc1Cl.Nc1cc2ccc(CCc3cnccc3Cl)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PhePhe
snar_amine	6746	Cc1cnccc1Cl.Nc1cncc(CCc2cnccc2Cl)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6747	Cc1cnccc1Cl.Nc1cncc(CCc2cnccc2Cl)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6748	Cc1cnccc1Cl.NCCNc1ccncc1CCc1cnccc1Cl>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6749	Cc1cnccc1Cl.NC=CNc1ccncc1CCc1cnccc1Cl>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6750	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6751	Cc1cnccc1Cl.Clc1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6752	Cc1cnccc1Cl.Clc1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6753	Cc1cnccc1Cl.Clc1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6754	Cc1cnccc1Cl.Nc1occ(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5
snar_amine	6755	Cc1cnccc1Cl.Nc1oc2c(CCc3cnccc3Cl)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Het5
snar_amine	6756	Cc1cnccc1Cl.Nc1oc2cc(CCc3cnccc3Cl)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Het6
snar_amine	6757	Cc1cnccc1Cl.Nc1oc2ccc(CCc3cnccc3Cl)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het5Phe
snar_amine	6758	Cc1cnccc1Cl.Nc1nccc(CCc2cnccc2Cl)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6
snar_amine	6759	Cc1cnccc1Cl.Nc1c(Cc2cnccc2Cl)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Het5
snar_amine	6760	Cc1cnccc1Cl.Nc1ncc2cc(CCc3cnccc3Cl)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Het6
snar_amine	6761	Cc1cnccc1Cl.Nc1ncc2ccc(CCc3cnccc3Cl)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_Het6Phe
snar_amine	6762	Cc1cnccc1Cl.Nc1c(Cc2cnccc2Cl)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PheHet5
snar_amine	6763	Cc1cnccc1Cl.Nc1cc2cncc(CCc3cnccc3Cl)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Amine_Primary_PheHet6
snar_amine	6764	Cc1cnccc1Cl.NCc1ccccc1CCCc1cnccc1Cl>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.Benzylamine_primary
snar_amine	6765	Cc1cnccc1Cl.NCc1cnccc1CCCc1cnccc1Cl>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6.HeteroBenzylamine_primary
snar_amine	6766	Cc1nc2cocc2cc1Cl.NCCNCCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6767	Cc1nc2cocc2cc1Cl.NC=CNCCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6768	Cc1nc2cocc2cc1Cl.NC=CNC=CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6769	Cc1nc2cocc2cc1Cl.NC1CNCC(CCc2nc3cocc3cc2Cl)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6770	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCC1CC=CNC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6771	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCC1C=CNC=CC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6772	Cc1nc2cocc2cc1Cl.NCCNCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_SaturatedAliphatic
snar_amine	6773	Cc1nc2cocc2cc1Cl.NC=CNCCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	6774	Cc1nc2cocc2cc1Cl.Nc1cccc(CCc2nc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6775	Cc1nc2cocc2cc1Cl.NCCNc1ccccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6776	Cc1nc2cocc2cc1Cl.NC=CNc1ccccc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6777	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6778	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6779	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6780	Cc1nc2cocc2cc1Cl.Nc1cccc(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Phe
snar_amine	6781	Cc1nc2cocc2cc1Cl.Nc1cc2ccc(CCc3nc4cocc4cc3Cl)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PhePhe
snar_amine	6782	Cc1nc2cocc2cc1Cl.Nc1cncc(CCc2nc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6783	Cc1nc2cocc2cc1Cl.Nc1cncc(CCc2nc3cocc3cc2Cl)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6784	Cc1nc2cocc2cc1Cl.NCCNc1ccncc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6785	Cc1nc2cocc2cc1Cl.NC=CNc1ccncc1CCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6786	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6787	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6788	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6789	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6790	Cc1nc2cocc2cc1Cl.Nc1occ(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5
snar_amine	6791	Cc1nc2cocc2cc1Cl.Nc1oc2c(CCc3nc4cocc4cc3Cl)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Het5
snar_amine	6792	Cc1nc2cocc2cc1Cl.Nc1oc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Het6
snar_amine	6793	Cc1nc2cocc2cc1Cl.Nc1oc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het5Phe
snar_amine	6794	Cc1nc2cocc2cc1Cl.Nc1nccc(CCc2nc3cocc3cc2Cl)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6
snar_amine	6795	Cc1nc2cocc2cc1Cl.Nc1c(Cc2nc3cocc3cc2Cl)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Het5
snar_amine	6796	Cc1nc2cocc2cc1Cl.Nc1ncc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Het6
snar_amine	6797	Cc1nc2cocc2cc1Cl.Nc1ncc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_Het6Phe
snar_amine	6798	Cc1nc2cocc2cc1Cl.Nc1c(Cc2nc3cocc3cc2Cl)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PheHet5
snar_amine	6799	Cc1nc2cocc2cc1Cl.Nc1cc2cncc(CCc3nc4cocc4cc3Cl)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Amine_Primary_PheHet6
snar_amine	6800	Cc1nc2cocc2cc1Cl.NCc1ccccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.Benzylamine_primary
snar_amine	6801	Cc1nc2cocc2cc1Cl.NCc1cnccc1CCCc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het5.HeteroBenzylamine_primary
snar_amine	6802	Cc1c(Cl)ncc2ccncc12.NCCNCCCCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6803	Cc1c(Cl)ncc2ccncc12.NC=CNCCCCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6804	Cc1c(Cl)ncc2ccncc12.NC=CNC=CCCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6805	Cc1c(Cl)ncc2ccncc12.NC1CNCC(CCc2c(Cl)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)ncc4ccncc34)C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6806	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccncc34)C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6807	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccncc34)C=C2)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6808	Cc1c(Cl)ncc2ccncc12.NCCNCCCc1c(Cl)ncc2ccncc12>>Cc1c(NCCNCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_SaturatedAliphatic
snar_amine	6809	Cc1c(Cl)ncc2ccncc12.NC=CNCCCc1c(Cl)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	6810	Cc1c(Cl)ncc2ccncc12.Nc1cccc(CCc2c(Cl)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6811	Cc1c(Cl)ncc2ccncc12.NCCNc1ccccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6812	Cc1c(Cl)ncc2ccncc12.NC=CNc1ccccc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6813	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6814	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6815	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6816	Cc1c(Cl)ncc2ccncc12.Nc1cccc(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Phe
snar_amine	6817	Cc1c(Cl)ncc2ccncc12.Nc1cc2ccc(CCc3c(Cl)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PhePhe
snar_amine	6818	Cc1c(Cl)ncc2ccncc12.Nc1cncc(CCc2c(Cl)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6819	Cc1c(Cl)ncc2ccncc12.Nc1cncc(CCc2c(Cl)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6820	Cc1c(Cl)ncc2ccncc12.NCCNc1ccncc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6821	Cc1c(Cl)ncc2ccncc12.NC=CNc1ccncc1CCc1c(Cl)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6822	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6823	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6824	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6825	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)ncc5ccncc45)cc32)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6826	Cc1c(Cl)ncc2ccncc12.Nc1occ(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5
snar_amine	6827	Cc1c(Cl)ncc2ccncc12.Nc1oc2c(CCc3c(Cl)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)ncc5ccncc45)occ3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Het5
snar_amine	6828	Cc1c(Cl)ncc2ccncc12.Nc1oc2cc(CCc3c(Cl)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Het6
snar_amine	6829	Cc1c(Cl)ncc2ccncc12.Nc1oc2ccc(CCc3c(Cl)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het5Phe
snar_amine	6830	Cc1c(Cl)ncc2ccncc12.Nc1nccc(CCc2c(Cl)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)ncc4ccncc34)c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6
snar_amine	6831	Cc1c(Cl)ncc2ccncc12.Nc1c(Cc2c(Cl)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Het5
snar_amine	6832	Cc1c(Cl)ncc2ccncc12.Nc1ncc2cc(CCc3c(Cl)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Het6
snar_amine	6833	Cc1c(Cl)ncc2ccncc12.Nc1ncc2ccc(CCc3c(Cl)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)ncc5ccncc45)cc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_Het6Phe
snar_amine	6834	Cc1c(Cl)ncc2ccncc12.Nc1c(Cc2c(Cl)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PheHet5
snar_amine	6835	Cc1c(Cl)ncc2ccncc12.Nc1cc2cncc(CCc3c(Cl)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)ncc5ccncc45)c3cc2N)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Amine_Primary_PheHet6
snar_amine	6836	Cc1c(Cl)ncc2ccncc12.NCc1ccccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.Benzylamine_primary
snar_amine	6837	Cc1c(Cl)ncc2ccncc12.NCc1cnccc1CCCc1c(Cl)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Het6.HeteroBenzylamine_primary
snar_amine	6838	Cc1c(Cl)ncc2ccccc12.NCCNCCCCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6839	Cc1c(Cl)ncc2ccccc12.NC=CNCCCCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6840	Cc1c(Cl)ncc2ccccc12.NC=CNC=CCCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6841	Cc1c(Cl)ncc2ccccc12.NC1CNCC(CCc2c(Cl)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(Cl)ncc4ccccc34)C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6842	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccccc34)C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6843	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(Cl)ncc4ccccc34)C=C2)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6844	Cc1c(Cl)ncc2ccccc12.NCCNCCCc1c(Cl)ncc2ccccc12>>Cc1c(NCCNCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_SaturatedAliphatic
snar_amine	6845	Cc1c(Cl)ncc2ccccc12.NC=CNCCCc1c(Cl)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6846	Cc1c(Cl)ncc2ccccc12.Nc1cccc(CCc2c(Cl)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6847	Cc1c(Cl)ncc2ccccc12.NCCNc1ccccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6848	Cc1c(Cl)ncc2ccccc12.NC=CNc1ccccc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6849	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6850	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6851	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6852	Cc1c(Cl)ncc2ccccc12.Nc1cccc(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Phe
snar_amine	6853	Cc1c(Cl)ncc2ccccc12.Nc1cc2ccc(CCc3c(Cl)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(Cl)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PhePhe
snar_amine	6854	Cc1c(Cl)ncc2ccccc12.Nc1cncc(CCc2c(Cl)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6855	Cc1c(Cl)ncc2ccccc12.Nc1cncc(CCc2c(Cl)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6856	Cc1c(Cl)ncc2ccccc12.NCCNc1ccncc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6857	Cc1c(Cl)ncc2ccccc12.NC=CNc1ccncc1CCc1c(Cl)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6858	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6859	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(Cl)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6860	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6861	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(Cl)ncc5ccccc45)cc32)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6862	Cc1c(Cl)ncc2ccccc12.Nc1occ(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5
snar_amine	6863	Cc1c(Cl)ncc2ccccc12.Nc1oc2c(CCc3c(Cl)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(Cl)ncc5ccccc45)occ3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Het5
snar_amine	6864	Cc1c(Cl)ncc2ccccc12.Nc1oc2cc(CCc3c(Cl)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(Cl)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Het6
snar_amine	6865	Cc1c(Cl)ncc2ccccc12.Nc1oc2ccc(CCc3c(Cl)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(Cl)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het5Phe
snar_amine	6866	Cc1c(Cl)ncc2ccccc12.Nc1nccc(CCc2c(Cl)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(Cl)ncc4ccccc34)c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6
snar_amine	6867	Cc1c(Cl)ncc2ccccc12.Nc1c(Cc2c(Cl)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Het5
snar_amine	6868	Cc1c(Cl)ncc2ccccc12.Nc1ncc2cc(CCc3c(Cl)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(Cl)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Het6
snar_amine	6869	Cc1c(Cl)ncc2ccccc12.Nc1ncc2ccc(CCc3c(Cl)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(Cl)ncc5ccccc45)cc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_Het6Phe
snar_amine	6870	Cc1c(Cl)ncc2ccccc12.Nc1c(Cc2c(Cl)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(Cl)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PheHet5
snar_amine	6871	Cc1c(Cl)ncc2ccccc12.Nc1cc2cncc(CCc3c(Cl)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(Cl)ncc5ccccc45)c3cc2N)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Amine_Primary_PheHet6
snar_amine	6872	Cc1c(Cl)ncc2ccccc12.NCc1ccccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.Benzylamine_primary
snar_amine	6873	Cc1c(Cl)ncc2ccccc12.NCc1cnccc1CCCc1c(Cl)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_Het6Phe.HeteroBenzylamine_primary
snar_amine	6874	Cc1cc2cocc2cc1Cl.NCCNCCCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(CCN)CCCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6875	Cc1cc2cocc2cc1Cl.NC=CNCCCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(C=CN)CCCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6876	Cc1cc2cocc2cc1Cl.NC=CNC=CCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(C=CN)C=CCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6877	Cc1cc2cocc2cc1Cl.NC1CNCC(CCc2cc3cocc3cc2Cl)C1>>Cc1cc2cocc2cc1N1CC(N)CC(CCc2cc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6878	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1CCC1CC=CNC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2Cl)C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6879	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1CCC1C=CNC=CC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2Cl)C=C1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6880	Cc1cc2cocc2cc1Cl.NCCNCCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1NCCNCCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_SaturatedAliphatic
snar_amine	6881	Cc1cc2cocc2cc1Cl.NC=CNCCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1NC=CNCCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_UnsaturatedAliphatic
snar_amine	6882	Cc1cc2cocc2cc1Cl.Nc1cccc(CCc2cc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6883	Cc1cc2cocc2cc1Cl.NCCNc1ccccc1CCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(CCN)c1ccccc1CCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6884	Cc1cc2cocc2cc1Cl.NC=CNc1ccccc1CCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(C=CN)c1ccccc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6885	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2ccccc2CCC(Cc2cc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6886	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1Cc1ccc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ccc(Cc3cc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6887	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1Cc1ccc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ccc(Cc3cc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6888	Cc1cc2cocc2cc1Cl.Nc1cccc(CCc2cc3cocc3cc2Cl)c1N>>Cc1cc2cocc2cc1Nc1cccc(CCc2cc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Phe
snar_amine	6889	Cc1cc2cocc2cc1Cl.Nc1cc2ccc(CCc3cc4cocc4cc3Cl)cc2cc1N>>Cc1cc2cocc2cc1Nc1cc2ccc(CCc3cc4cocc4cc3Cl)cc2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_PhePhe
snar_amine	6890	Cc1cc2cocc2cc1Cl.Nc1cncc(CCc2cc3cocc3cc2Cl)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6891	Cc1cc2cocc2cc1Cl.Nc1cncc(CCc2cc3cocc3cc2Cl)c1Nc1cccnc1>>Cc1cc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6892	Cc1cc2cocc2cc1Cl.NCCNc1ccncc1CCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(CCN)c1ccncc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6893	Cc1cc2cocc2cc1Cl.NC=CNc1ccncc1CCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1N(C=CN)c1ccncc1CCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6894	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2cnccc2CCC(Cc2cc3cocc3cc2Cl)Cc2ccccc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6895	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cc2cocc2cc1N1c2ccncc2CCC(Cc2cc3cocc3cc2Cl)Cc2ccncc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6896	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1Cc1cnc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ncc(Cc3cc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6897	Cc1cc2cocc2cc1Cl.Clc1cc2cocc2cc1Cc1cnc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ncc(Cc3cc4cocc4cc3Cl)cc21	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6898	Cc1cc2cocc2cc1Cl.Nc1occ(CCc2cc3cocc3cc2Cl)c1N>>Cc1cc2cocc2cc1Nc1occ(CCc2cc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het5
snar_amine	6899	Cc1cc2cocc2cc1Cl.Nc1oc2c(CCc3cc4cocc4cc3Cl)occ2c1N>>Cc1cc2cocc2cc1Nc1oc2c(CCc3cc4cocc4cc3Cl)occ2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het5Het5
snar_amine	6900	Cc1cc2cocc2cc1Cl.Nc1oc2cc(CCc3cc4cocc4cc3Cl)ncc2c1N>>Cc1cc2cocc2cc1Nc1oc2cc(CCc3cc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het5Het6
snar_amine	6901	Cc1cc2cocc2cc1Cl.Nc1oc2ccc(CCc3cc4cocc4cc3Cl)cc2c1N>>Cc1cc2cocc2cc1Nc1oc2ccc(CCc3cc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het5Phe
snar_amine	6902	Cc1cc2cocc2cc1Cl.Nc1nccc(CCc2cc3cocc3cc2Cl)c1N>>Cc1cc2cocc2cc1Nc1nccc(CCc2cc3cocc3cc2Cl)c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het6
snar_amine	6903	Cc1cc2cocc2cc1Cl.Nc1c(Cc2cc3cocc3cc2Cl)nc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2Cl)nc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het6Het5
snar_amine	6904	Cc1cc2cocc2cc1Cl.Nc1ncc2cc(CCc3cc4cocc4cc3Cl)ncc2c1N>>Cc1cc2cocc2cc1Nc1ncc2cc(CCc3cc4cocc4cc3Cl)ncc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het6Het6
snar_amine	6905	Cc1cc2cocc2cc1Cl.Nc1ncc2ccc(CCc3cc4cocc4cc3Cl)cc2c1N>>Cc1cc2cocc2cc1Nc1ncc2ccc(CCc3cc4cocc4cc3Cl)cc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_Het6Phe
snar_amine	6906	Cc1cc2cocc2cc1Cl.Nc1c(Cc2cc3cocc3cc2Cl)cc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2Cl)cc2cocc2c1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_PheHet5
snar_amine	6907	Cc1cc2cocc2cc1Cl.Nc1cc2cncc(CCc3cc4cocc4cc3Cl)c2cc1N>>Cc1cc2cocc2cc1Nc1cc2cncc(CCc3cc4cocc4cc3Cl)c2cc1N	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Amine_Primary_PheHet6
snar_amine	6908	Cc1cc2cocc2cc1Cl.NCc1ccccc1CCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1NCc1ccccc1CCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.Benzylamine_primary
snar_amine	6909	Cc1cc2cocc2cc1Cl.NCc1cnccc1CCCc1cc2cocc2cc1Cl>>Cc1cc2cocc2cc1NCc1cnccc1CCCc1cc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet5.HeteroBenzylamine_primary
snar_amine	6910	CCc1c(Cl)ccc2ccncc12.NCCNCCCCCc1c(Cl)ccc2ccncc12>>CCc1c(N(CCN)CCCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6911	CCc1c(Cl)ccc2ccncc12.NC=CNCCCCCc1c(Cl)ccc2ccncc12>>CCc1c(N(C=CN)CCCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6912	CCc1c(Cl)ccc2ccncc12.NC=CNC=CCCCc1c(Cl)ccc2ccncc12>>CCc1c(N(C=CN)C=CCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6913	CCc1c(Cl)ccc2ccncc12.NC1CNCC(CCCc2c(Cl)ccc3ccncc23)C1>>CCc1c(N2CC(N)CC(CCCc3c(Cl)ccc4ccncc34)C2)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6914	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCCC1CC=CNC1>>CCc1c(N2C=CCC(CCCc3c(Cl)ccc4ccncc34)C2)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6915	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCCC1C=CNC=CC1>>CCc1c(N2C=CCC(CCCc3c(Cl)ccc4ccncc34)C=C2)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6916	CCc1c(Cl)ccc2ccncc12.NCCNCCCCc1c(Cl)ccc2ccncc12>>CCc1c(NCCNCCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_SaturatedAliphatic
snar_amine	6917	CCc1c(Cl)ccc2ccncc12.NC=CNCCCCc1c(Cl)ccc2ccncc12>>CCc1c(NC=CNCCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_UnsaturatedAliphatic
snar_amine	6918	CCc1c(Cl)ccc2ccncc12.Nc1cccc(CCCc2c(Cl)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cccc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6919	CCc1c(Cl)ccc2ccncc12.NCCNc1ccccc1CCCCc1c(Cl)ccc2ccncc12>>CCc1c(N(CCN)c2ccccc2CCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6920	CCc1c(Cl)ccc2ccncc12.NC=CNc1ccccc1CCCc1c(Cl)ccc2ccncc12>>CCc1c(N(C=CN)c2ccccc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6921	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1c(N2c3ccccc3CCC(CCc3c(Cl)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6922	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCc1ccc2c(c1)NCCC2>>CCc1c(N2CCCc3ccc(CCc4c(Cl)ccc5ccncc45)cc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6923	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCc1ccc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ccc(CCc4c(Cl)ccc5ccncc45)cc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6924	CCc1c(Cl)ccc2ccncc12.Nc1cccc(CCCc2c(Cl)ccc3ccncc23)c1N>>CCc1c(Nc2cccc(CCCc3c(Cl)ccc4ccncc34)c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Phe
snar_amine	6925	CCc1c(Cl)ccc2ccncc12.Nc1cc2ccc(CCCc3c(Cl)ccc4ccncc34)cc2cc1N>>CCc1c(Nc2cc3ccc(CCCc4c(Cl)ccc5ccncc45)cc3cc2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_PhePhe
snar_amine	6926	CCc1c(Cl)ccc2ccncc12.Nc1cncc(CCCc2c(Cl)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cncc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6927	CCc1c(Cl)ccc2ccncc12.Nc1cncc(CCCc2c(Cl)ccc3ccncc23)c1Nc1cccnc1>>CCc1c(N(c2cccnc2)c2c(N)cncc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6928	CCc1c(Cl)ccc2ccncc12.NCCNc1ccncc1CCCc1c(Cl)ccc2ccncc12>>CCc1c(N(CCN)c2ccncc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6929	CCc1c(Cl)ccc2ccncc12.NC=CNc1ccncc1CCCc1c(Cl)ccc2ccncc12>>CCc1c(N(C=CN)c2ccncc2CCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6930	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1c(N2c3cnccc3CCC(CCc3c(Cl)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6931	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1c(N2c3ccncc3CCC(CCc3c(Cl)ccc4ccncc34)Cc3ccncc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6932	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCc1cnc2c(c1)NCCC2>>CCc1c(N2CCCc3ncc(CCc4c(Cl)ccc5ccncc45)cc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6933	CCc1c(Cl)ccc2ccncc12.Clc1ccc2ccncc2c1CCc1cnc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ncc(CCc4c(Cl)ccc5ccncc45)cc32)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Chloride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6934	CCc1c(Cl)ccc2ccncc12.Nc1occ(CCCc2c(Cl)ccc3ccncc23)c1N>>CCc1c(Nc2occ(CCCc3c(Cl)ccc4ccncc34)c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het5
snar_amine	6935	CCc1c(Cl)ccc2ccncc12.Nc1oc2c(CCCc3c(Cl)ccc4ccncc34)occ2c1N>>CCc1c(Nc2oc3c(CCCc4c(Cl)ccc5ccncc45)occ3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het5Het5
snar_amine	6936	CCc1c(Cl)ccc2ccncc12.Nc1oc2cc(CCCc3c(Cl)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2oc3cc(CCCc4c(Cl)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het5Het6
snar_amine	6937	CCc1c(Cl)ccc2ccncc12.Nc1oc2ccc(CCCc3c(Cl)ccc4ccncc34)cc2c1N>>CCc1c(Nc2oc3ccc(CCCc4c(Cl)ccc5ccncc45)cc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het5Phe
snar_amine	6938	CCc1c(Cl)ccc2ccncc12.Nc1nccc(CCCc2c(Cl)ccc3ccncc23)c1N>>CCc1c(Nc2nccc(CCCc3c(Cl)ccc4ccncc34)c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het6
snar_amine	6939	CCc1c(Cl)ccc2ccncc12.Nc1c(CCc2c(Cl)ccc3ccncc23)nc2cocc2c1N>>CCc1c(Nc2c(CCc3c(Cl)ccc4ccncc34)nc3cocc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het6Het5
snar_amine	6940	CCc1c(Cl)ccc2ccncc12.Nc1ncc2cc(CCCc3c(Cl)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2ncc3cc(CCCc4c(Cl)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het6Het6
snar_amine	6941	CCc1c(Cl)ccc2ccncc12.Nc1ncc2ccc(CCCc3c(Cl)ccc4ccncc34)cc2c1N>>CCc1c(Nc2ncc3ccc(CCCc4c(Cl)ccc5ccncc45)cc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_Het6Phe
snar_amine	6942	CCc1c(Cl)ccc2ccncc12.Nc1c(CCc2c(Cl)ccc3ccncc23)cc2cocc2c1N>>CCc1c(Nc2c(CCc3c(Cl)ccc4ccncc34)cc3cocc3c2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_PheHet5
snar_amine	6943	CCc1c(Cl)ccc2ccncc12.Nc1cc2cncc(CCCc3c(Cl)ccc4ccncc34)c2cc1N>>CCc1c(Nc2cc3cncc(CCCc4c(Cl)ccc5ccncc45)c3cc2N)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Amine_Primary_PheHet6
snar_amine	6944	CCc1c(Cl)ccc2ccncc12.NCc1ccccc1CCCCc1c(Cl)ccc2ccncc12>>CCc1c(NCc2ccccc2CCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.Benzylamine_primary
snar_amine	6945	CCc1c(Cl)ccc2ccncc12.NCc1cnccc1CCCCc1c(Cl)ccc2ccncc12>>CCc1c(NCc2cnccc2CCCCc2c(Cl)ccc3ccncc23)ccc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Chloride_PheHet6.HeteroBenzylamine_primary
snar_amine	6946	Cc1ccccc1F.NCCNCCCCc1ccccc1F>>Cc1ccccc1N(CCN)CCCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6947	Cc1ccccc1F.NC=CNCCCCc1ccccc1F>>Cc1ccccc1N(C=CN)CCCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6948	Cc1ccccc1F.NC=CNC=CCCc1ccccc1F>>Cc1ccccc1N(C=CN)C=CCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6949	Cc1ccccc1F.NC1CNCC(CCc2ccccc2F)C1>>Cc1ccccc1N1CC(N)CC(CCc2ccccc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6950	Cc1ccccc1F.Fc1ccccc1CCC1CC=CNC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6951	Cc1ccccc1F.Fc1ccccc1CCC1C=CNC=CC1>>Cc1ccccc1N1C=CCC(CCc2ccccc2F)C=C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6952	Cc1ccccc1F.NCCNCCCc1ccccc1F>>Cc1ccccc1NCCNCCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_SaturatedAliphatic
snar_amine	6953	Cc1ccccc1F.NC=CNCCCc1ccccc1F>>Cc1ccccc1NC=CNCCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6954	Cc1ccccc1F.Nc1cccc(CCc2ccccc2F)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cccc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6955	Cc1ccccc1F.NCCNc1ccccc1CCCc1ccccc1F>>Cc1ccccc1N(CCN)c1ccccc1CCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6956	Cc1ccccc1F.NC=CNc1ccccc1CCc1ccccc1F>>Cc1ccccc1N(C=CN)c1ccccc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6957	Cc1ccccc1F.Fc1ccccc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1ccccc1N1c2ccccc2CCC(Cc2ccccc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6958	Cc1ccccc1F.Fc1ccccc1Cc1ccc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ccc(Cc3ccccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6959	Cc1ccccc1F.Fc1ccccc1Cc1ccc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ccc(Cc3ccccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6960	Cc1ccccc1F.Nc1cccc(CCc2ccccc2F)c1N>>Cc1ccccc1Nc1cccc(CCc2ccccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Phe
snar_amine	6961	Cc1ccccc1F.Nc1cc2ccc(CCc3ccccc3F)cc2cc1N>>Cc1ccccc1Nc1cc2ccc(CCc3ccccc3F)cc2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_PhePhe
snar_amine	6962	Cc1ccccc1F.Nc1cncc(CCc2ccccc2F)c1Nc1ccccc1>>Cc1ccccc1N(c1ccccc1)c1c(N)cncc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6963	Cc1ccccc1F.Nc1cncc(CCc2ccccc2F)c1Nc1cccnc1>>Cc1ccccc1N(c1cccnc1)c1c(N)cncc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6964	Cc1ccccc1F.NCCNc1ccncc1CCc1ccccc1F>>Cc1ccccc1N(CCN)c1ccncc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6965	Cc1ccccc1F.NC=CNc1ccncc1CCc1ccccc1F>>Cc1ccccc1N(C=CN)c1ccncc1CCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6966	Cc1ccccc1F.Fc1ccccc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1ccccc1N1c2cnccc2CCC(Cc2ccccc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6967	Cc1ccccc1F.Fc1ccccc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1ccccc1N1c2ccncc2CCC(Cc2ccccc2F)Cc2ccncc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	6968	Cc1ccccc1F.Fc1ccccc1Cc1cnc2c(c1)NCCC2>>Cc1ccccc1N1CCCc2ncc(Cc3ccccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	6969	Cc1ccccc1F.Fc1ccccc1Cc1cnc2c(c1)NC=CC2>>Cc1ccccc1N1C=CCc2ncc(Cc3ccccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	6970	Cc1ccccc1F.Nc1occ(CCc2ccccc2F)c1N>>Cc1ccccc1Nc1occ(CCc2ccccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het5
snar_amine	6971	Cc1ccccc1F.Nc1oc2c(CCc3ccccc3F)occ2c1N>>Cc1ccccc1Nc1oc2c(CCc3ccccc3F)occ2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het5Het5
snar_amine	6972	Cc1ccccc1F.Nc1oc2cc(CCc3ccccc3F)ncc2c1N>>Cc1ccccc1Nc1oc2cc(CCc3ccccc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het5Het6
snar_amine	6973	Cc1ccccc1F.Nc1oc2ccc(CCc3ccccc3F)cc2c1N>>Cc1ccccc1Nc1oc2ccc(CCc3ccccc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het5Phe
snar_amine	6974	Cc1ccccc1F.Nc1nccc(CCc2ccccc2F)c1N>>Cc1ccccc1Nc1nccc(CCc2ccccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het6
snar_amine	6975	Cc1ccccc1F.Nc1c(Cc2ccccc2F)nc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2F)nc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het6Het5
snar_amine	6976	Cc1ccccc1F.Nc1ncc2cc(CCc3ccccc3F)ncc2c1N>>Cc1ccccc1Nc1ncc2cc(CCc3ccccc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het6Het6
snar_amine	6977	Cc1ccccc1F.Nc1ncc2ccc(CCc3ccccc3F)cc2c1N>>Cc1ccccc1Nc1ncc2ccc(CCc3ccccc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_Het6Phe
snar_amine	6978	Cc1ccccc1F.Nc1c(Cc2ccccc2F)cc2cocc2c1N>>Cc1ccccc1Nc1c(Cc2ccccc2F)cc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_PheHet5
snar_amine	6979	Cc1ccccc1F.Nc1cc2cncc(CCc3ccccc3F)c2cc1N>>Cc1ccccc1Nc1cc2cncc(CCc3ccccc3F)c2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Amine_Primary_PheHet6
snar_amine	6980	Cc1ccccc1F.NCc1ccccc1CCCc1ccccc1F>>Cc1ccccc1NCc1ccccc1CCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.Benzylamine_primary
snar_amine	6981	Cc1ccccc1F.NCc1cnccc1CCCc1ccccc1F>>Cc1ccccc1NCc1cnccc1CCCc1ccccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Phe.HeteroBenzylamine_primary
snar_amine	6982	Cc1c(F)ccc2ccccc12.NCCNCCCCc1c(F)ccc2ccccc12>>Cc1c(N(CCN)CCCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6983	Cc1c(F)ccc2ccccc12.NC=CNCCCCc1c(F)ccc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6984	Cc1c(F)ccc2ccccc12.NC=CNC=CCCc1c(F)ccc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6985	Cc1c(F)ccc2ccccc12.NC1CNCC(CCc2c(F)ccc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)ccc4ccccc34)C2)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	6986	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)ccc4ccccc34)C2)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6987	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)ccc4ccccc34)C=C2)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	6988	Cc1c(F)ccc2ccccc12.NCCNCCCc1c(F)ccc2ccccc12>>Cc1c(NCCNCCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_SaturatedAliphatic
snar_amine	6989	Cc1c(F)ccc2ccccc12.NC=CNCCCc1c(F)ccc2ccccc12>>Cc1c(NC=CNCCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_UnsaturatedAliphatic
snar_amine	6990	Cc1c(F)ccc2ccccc12.Nc1cccc(CCc2c(F)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	6991	Cc1c(F)ccc2ccccc12.NCCNc1ccccc1CCCc1c(F)ccc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6992	Cc1c(F)ccc2ccccc12.NC=CNc1ccccc1CCc1c(F)ccc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6993	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	6994	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)ccc5ccccc45)cc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	6995	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)ccc5ccccc45)cc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	6996	Cc1c(F)ccc2ccccc12.Nc1cccc(CCc2c(F)ccc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)ccc4ccccc34)c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Phe
snar_amine	6997	Cc1c(F)ccc2ccccc12.Nc1cc2ccc(CCc3c(F)ccc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)ccc5ccccc45)cc3cc2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_PhePhe
snar_amine	6998	Cc1c(F)ccc2ccccc12.Nc1cncc(CCc2c(F)ccc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	6999	Cc1c(F)ccc2ccccc12.Nc1cncc(CCc2c(F)ccc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7000	Cc1c(F)ccc2ccccc12.NCCNc1ccncc1CCc1c(F)ccc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7001	Cc1c(F)ccc2ccccc12.NC=CNc1ccncc1CCc1c(F)ccc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7002	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)ccc4ccccc34)Cc3ccccc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7003	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)ccc4ccccc34)Cc3ccncc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7004	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)ccc5ccccc45)cc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7005	Cc1c(F)ccc2ccccc12.Fc1ccc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)ccc5ccccc45)cc32)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PhePhe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7006	Cc1c(F)ccc2ccccc12.Nc1occ(CCc2c(F)ccc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(F)ccc4ccccc34)c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het5
snar_amine	7007	Cc1c(F)ccc2ccccc12.Nc1oc2c(CCc3c(F)ccc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)ccc5ccccc45)occ3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het5Het5
snar_amine	7008	Cc1c(F)ccc2ccccc12.Nc1oc2cc(CCc3c(F)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het5Het6
snar_amine	7009	Cc1c(F)ccc2ccccc12.Nc1oc2ccc(CCc3c(F)ccc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)ccc5ccccc45)cc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het5Phe
snar_amine	7010	Cc1c(F)ccc2ccccc12.Nc1nccc(CCc2c(F)ccc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)ccc4ccccc34)c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het6
snar_amine	7011	Cc1c(F)ccc2ccccc12.Nc1c(Cc2c(F)ccc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ccc4ccccc34)nc3cocc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het6Het5
snar_amine	7012	Cc1c(F)ccc2ccccc12.Nc1ncc2cc(CCc3c(F)ccc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)ccc5ccccc45)ncc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het6Het6
snar_amine	7013	Cc1c(F)ccc2ccccc12.Nc1ncc2ccc(CCc3c(F)ccc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)ccc5ccccc45)cc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_Het6Phe
snar_amine	7014	Cc1c(F)ccc2ccccc12.Nc1c(Cc2c(F)ccc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ccc4ccccc34)cc3cocc3c2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_PheHet5
snar_amine	7015	Cc1c(F)ccc2ccccc12.Nc1cc2cncc(CCc3c(F)ccc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)ccc5ccccc45)c3cc2N)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Amine_Primary_PheHet6
snar_amine	7016	Cc1c(F)ccc2ccccc12.NCc1ccccc1CCCc1c(F)ccc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.Benzylamine_primary
snar_amine	7017	Cc1c(F)ccc2ccccc12.NCc1cnccc1CCCc1c(F)ccc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(F)ccc3ccccc23)ccc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PhePhe.HeteroBenzylamine_primary
snar_amine	7018	Cc1cocc1F.NCCNCCCCc1cocc1F>>Cc1cocc1N(CCN)CCCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7019	Cc1cocc1F.NC=CNCCCCc1cocc1F>>Cc1cocc1N(C=CN)CCCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7020	Cc1cocc1F.NC=CNC=CCCc1cocc1F>>Cc1cocc1N(C=CN)C=CCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7021	Cc1cocc1F.NC1CNCC(CCc2cocc2F)C1>>Cc1cocc1N1CC(N)CC(CCc2cocc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7022	Cc1cocc1F.Fc1cocc1CCC1CC=CNC1>>Cc1cocc1N1C=CCC(CCc2cocc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7023	Cc1cocc1F.Fc1cocc1CCC1C=CNC=CC1>>Cc1cocc1N1C=CCC(CCc2cocc2F)C=C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7024	Cc1cocc1F.NCCNCCCc1cocc1F>>Cc1cocc1NCCNCCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_SaturatedAliphatic
snar_amine	7025	Cc1cocc1F.NC=CNCCCc1cocc1F>>Cc1cocc1NC=CNCCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	7026	Cc1cocc1F.Nc1cccc(CCc2cocc2F)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cccc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7027	Cc1cocc1F.NCCNc1ccccc1CCCc1cocc1F>>Cc1cocc1N(CCN)c1ccccc1CCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7028	Cc1cocc1F.NC=CNc1ccccc1CCc1cocc1F>>Cc1cocc1N(C=CN)c1ccccc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7029	Cc1cocc1F.Fc1cocc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cocc1N1c2ccccc2CCC(Cc2cocc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7030	Cc1cocc1F.Fc1cocc1Cc1ccc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ccc(Cc3cocc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7031	Cc1cocc1F.Fc1cocc1Cc1ccc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ccc(Cc3cocc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7032	Cc1cocc1F.Nc1cccc(CCc2cocc2F)c1N>>Cc1cocc1Nc1cccc(CCc2cocc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Phe
snar_amine	7033	Cc1cocc1F.Nc1cc2ccc(CCc3cocc3F)cc2cc1N>>Cc1cocc1Nc1cc2ccc(CCc3cocc3F)cc2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_PhePhe
snar_amine	7034	Cc1cocc1F.Nc1cncc(CCc2cocc2F)c1Nc1ccccc1>>Cc1cocc1N(c1ccccc1)c1c(N)cncc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7035	Cc1cocc1F.Nc1cncc(CCc2cocc2F)c1Nc1cccnc1>>Cc1cocc1N(c1cccnc1)c1c(N)cncc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7036	Cc1cocc1F.NCCNc1ccncc1CCc1cocc1F>>Cc1cocc1N(CCN)c1ccncc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7037	Cc1cocc1F.NC=CNc1ccncc1CCc1cocc1F>>Cc1cocc1N(C=CN)c1ccncc1CCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7038	Cc1cocc1F.Fc1cocc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cocc1N1c2cnccc2CCC(Cc2cocc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7039	Cc1cocc1F.Fc1cocc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cocc1N1c2ccncc2CCC(Cc2cocc2F)Cc2ccncc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7040	Cc1cocc1F.Fc1cocc1Cc1cnc2c(c1)NCCC2>>Cc1cocc1N1CCCc2ncc(Cc3cocc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7041	Cc1cocc1F.Fc1cocc1Cc1cnc2c(c1)NC=CC2>>Cc1cocc1N1C=CCc2ncc(Cc3cocc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7042	Cc1cocc1F.Nc1occ(CCc2cocc2F)c1N>>Cc1cocc1Nc1occ(CCc2cocc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het5
snar_amine	7043	Cc1cocc1F.Nc1oc2c(CCc3cocc3F)occ2c1N>>Cc1cocc1Nc1oc2c(CCc3cocc3F)occ2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het5Het5
snar_amine	7044	Cc1cocc1F.Nc1oc2cc(CCc3cocc3F)ncc2c1N>>Cc1cocc1Nc1oc2cc(CCc3cocc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het5Het6
snar_amine	7045	Cc1cocc1F.Nc1oc2ccc(CCc3cocc3F)cc2c1N>>Cc1cocc1Nc1oc2ccc(CCc3cocc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het5Phe
snar_amine	7046	Cc1cocc1F.Nc1nccc(CCc2cocc2F)c1N>>Cc1cocc1Nc1nccc(CCc2cocc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het6
snar_amine	7047	Cc1cocc1F.Nc1c(Cc2cocc2F)nc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2F)nc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het6Het5
snar_amine	7048	Cc1cocc1F.Nc1ncc2cc(CCc3cocc3F)ncc2c1N>>Cc1cocc1Nc1ncc2cc(CCc3cocc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het6Het6
snar_amine	7049	Cc1cocc1F.Nc1ncc2ccc(CCc3cocc3F)cc2c1N>>Cc1cocc1Nc1ncc2ccc(CCc3cocc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_Het6Phe
snar_amine	7050	Cc1cocc1F.Nc1c(Cc2cocc2F)cc2cocc2c1N>>Cc1cocc1Nc1c(Cc2cocc2F)cc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_PheHet5
snar_amine	7051	Cc1cocc1F.Nc1cc2cncc(CCc3cocc3F)c2cc1N>>Cc1cocc1Nc1cc2cncc(CCc3cocc3F)c2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Amine_Primary_PheHet6
snar_amine	7052	Cc1cocc1F.NCc1ccccc1CCCc1cocc1F>>Cc1cocc1NCc1ccccc1CCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.Benzylamine_primary
snar_amine	7053	Cc1cocc1F.NCc1cnccc1CCCc1cocc1F>>Cc1cocc1NCc1cnccc1CCCc1cocc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5.HeteroBenzylamine_primary
snar_amine	7054	Cc1c(F)oc2cocc12.NCCNCCCCc1c(F)oc2cocc12>>Cc1c(N(CCN)CCCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7055	Cc1c(F)oc2cocc12.NC=CNCCCCc1c(F)oc2cocc12>>Cc1c(N(C=CN)CCCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7056	Cc1c(F)oc2cocc12.NC=CNC=CCCc1c(F)oc2cocc12>>Cc1c(N(C=CN)C=CCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7057	Cc1c(F)oc2cocc12.NC1CNCC(CCc2c(F)oc3cocc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)oc4cocc34)C2)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7058	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)oc4cocc34)C2)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7059	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)oc4cocc34)C=C2)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7060	Cc1c(F)oc2cocc12.NCCNCCCc1c(F)oc2cocc12>>Cc1c(NCCNCCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_SaturatedAliphatic
snar_amine	7061	Cc1c(F)oc2cocc12.NC=CNCCCc1c(F)oc2cocc12>>Cc1c(NC=CNCCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	7062	Cc1c(F)oc2cocc12.Nc1cccc(CCc2c(F)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7063	Cc1c(F)oc2cocc12.NCCNc1ccccc1CCCc1c(F)oc2cocc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7064	Cc1c(F)oc2cocc12.NC=CNc1ccccc1CCc1c(F)oc2cocc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7065	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)oc4cocc34)Cc3ccccc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7066	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)oc5cocc45)cc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7067	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)oc5cocc45)cc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7068	Cc1c(F)oc2cocc12.Nc1cccc(CCc2c(F)oc3cocc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)oc4cocc34)c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Phe
snar_amine	7069	Cc1c(F)oc2cocc12.Nc1cc2ccc(CCc3c(F)oc4cocc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)oc5cocc45)cc3cc2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_PhePhe
snar_amine	7070	Cc1c(F)oc2cocc12.Nc1cncc(CCc2c(F)oc3cocc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7071	Cc1c(F)oc2cocc12.Nc1cncc(CCc2c(F)oc3cocc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7072	Cc1c(F)oc2cocc12.NCCNc1ccncc1CCc1c(F)oc2cocc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7073	Cc1c(F)oc2cocc12.NC=CNc1ccncc1CCc1c(F)oc2cocc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7074	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)oc4cocc34)Cc3ccccc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7075	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)oc4cocc34)Cc3ccncc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7076	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)oc5cocc45)cc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7077	Cc1c(F)oc2cocc12.Fc1oc2cocc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)oc5cocc45)cc32)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7078	Cc1c(F)oc2cocc12.Nc1occ(CCc2c(F)oc3cocc23)c1N>>Cc1c(Nc2occ(CCc3c(F)oc4cocc34)c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het5
snar_amine	7079	Cc1c(F)oc2cocc12.Nc1oc2c(CCc3c(F)oc4cocc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)oc5cocc45)occ3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het5Het5
snar_amine	7080	Cc1c(F)oc2cocc12.Nc1oc2cc(CCc3c(F)oc4cocc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)oc5cocc45)ncc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het5Het6
snar_amine	7081	Cc1c(F)oc2cocc12.Nc1oc2ccc(CCc3c(F)oc4cocc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)oc5cocc45)cc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het5Phe
snar_amine	7082	Cc1c(F)oc2cocc12.Nc1nccc(CCc2c(F)oc3cocc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)oc4cocc34)c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het6
snar_amine	7083	Cc1c(F)oc2cocc12.Nc1c(Cc2c(F)oc3cocc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4cocc34)nc3cocc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het6Het5
snar_amine	7084	Cc1c(F)oc2cocc12.Nc1ncc2cc(CCc3c(F)oc4cocc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)oc5cocc45)ncc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het6Het6
snar_amine	7085	Cc1c(F)oc2cocc12.Nc1ncc2ccc(CCc3c(F)oc4cocc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)oc5cocc45)cc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_Het6Phe
snar_amine	7086	Cc1c(F)oc2cocc12.Nc1c(Cc2c(F)oc3cocc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4cocc34)cc3cocc3c2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_PheHet5
snar_amine	7087	Cc1c(F)oc2cocc12.Nc1cc2cncc(CCc3c(F)oc4cocc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)oc5cocc45)c3cc2N)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Amine_Primary_PheHet6
snar_amine	7088	Cc1c(F)oc2cocc12.NCc1ccccc1CCCc1c(F)oc2cocc12>>Cc1c(NCc2ccccc2CCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.Benzylamine_primary
snar_amine	7089	Cc1c(F)oc2cocc12.NCc1cnccc1CCCc1c(F)oc2cocc12>>Cc1c(NCc2cnccc2CCCc2c(F)oc3cocc23)oc2cocc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het5.HeteroBenzylamine_primary
snar_amine	7090	Cc1c(F)oc2ccncc12.NCCNCCCCc1c(F)oc2ccncc12>>Cc1c(N(CCN)CCCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7091	Cc1c(F)oc2ccncc12.NC=CNCCCCc1c(F)oc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7092	Cc1c(F)oc2ccncc12.NC=CNC=CCCc1c(F)oc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7093	Cc1c(F)oc2ccncc12.NC1CNCC(CCc2c(F)oc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)oc4ccncc34)C2)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7094	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)oc4ccncc34)C2)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7095	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)oc4ccncc34)C=C2)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7096	Cc1c(F)oc2ccncc12.NCCNCCCc1c(F)oc2ccncc12>>Cc1c(NCCNCCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_SaturatedAliphatic
snar_amine	7097	Cc1c(F)oc2ccncc12.NC=CNCCCc1c(F)oc2ccncc12>>Cc1c(NC=CNCCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	7098	Cc1c(F)oc2ccncc12.Nc1cccc(CCc2c(F)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7099	Cc1c(F)oc2ccncc12.NCCNc1ccccc1CCCc1c(F)oc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7100	Cc1c(F)oc2ccncc12.NC=CNc1ccccc1CCc1c(F)oc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7101	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7102	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)oc5ccncc45)cc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7103	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)oc5ccncc45)cc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7104	Cc1c(F)oc2ccncc12.Nc1cccc(CCc2c(F)oc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)oc4ccncc34)c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Phe
snar_amine	7105	Cc1c(F)oc2ccncc12.Nc1cc2ccc(CCc3c(F)oc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)oc5ccncc45)cc3cc2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_PhePhe
snar_amine	7106	Cc1c(F)oc2ccncc12.Nc1cncc(CCc2c(F)oc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7107	Cc1c(F)oc2ccncc12.Nc1cncc(CCc2c(F)oc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7108	Cc1c(F)oc2ccncc12.NCCNc1ccncc1CCc1c(F)oc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7109	Cc1c(F)oc2ccncc12.NC=CNc1ccncc1CCc1c(F)oc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7110	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)oc4ccncc34)Cc3ccccc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7111	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)oc4ccncc34)Cc3ccncc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7112	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)oc5ccncc45)cc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7113	Cc1c(F)oc2ccncc12.Fc1oc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)oc5ccncc45)cc32)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7114	Cc1c(F)oc2ccncc12.Nc1occ(CCc2c(F)oc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(F)oc4ccncc34)c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het5
snar_amine	7115	Cc1c(F)oc2ccncc12.Nc1oc2c(CCc3c(F)oc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)oc5ccncc45)occ3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het5Het5
snar_amine	7116	Cc1c(F)oc2ccncc12.Nc1oc2cc(CCc3c(F)oc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)oc5ccncc45)ncc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het5Het6
snar_amine	7117	Cc1c(F)oc2ccncc12.Nc1oc2ccc(CCc3c(F)oc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)oc5ccncc45)cc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het5Phe
snar_amine	7118	Cc1c(F)oc2ccncc12.Nc1nccc(CCc2c(F)oc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)oc4ccncc34)c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het6
snar_amine	7119	Cc1c(F)oc2ccncc12.Nc1c(Cc2c(F)oc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4ccncc34)nc3cocc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het6Het5
snar_amine	7120	Cc1c(F)oc2ccncc12.Nc1ncc2cc(CCc3c(F)oc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)oc5ccncc45)ncc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het6Het6
snar_amine	7121	Cc1c(F)oc2ccncc12.Nc1ncc2ccc(CCc3c(F)oc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)oc5ccncc45)cc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_Het6Phe
snar_amine	7122	Cc1c(F)oc2ccncc12.Nc1c(Cc2c(F)oc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4ccncc34)cc3cocc3c2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_PheHet5
snar_amine	7123	Cc1c(F)oc2ccncc12.Nc1cc2cncc(CCc3c(F)oc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)oc5ccncc45)c3cc2N)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Amine_Primary_PheHet6
snar_amine	7124	Cc1c(F)oc2ccncc12.NCc1ccccc1CCCc1c(F)oc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.Benzylamine_primary
snar_amine	7125	Cc1c(F)oc2ccncc12.NCc1cnccc1CCCc1c(F)oc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(F)oc3ccncc23)oc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Het6.HeteroBenzylamine_primary
snar_amine	7126	Cc1c(F)oc2ccccc12.NCCNCCCCc1c(F)oc2ccccc12>>Cc1c(N(CCN)CCCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7127	Cc1c(F)oc2ccccc12.NC=CNCCCCc1c(F)oc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7128	Cc1c(F)oc2ccccc12.NC=CNC=CCCc1c(F)oc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7129	Cc1c(F)oc2ccccc12.NC1CNCC(CCc2c(F)oc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)oc4ccccc34)C2)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7130	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)oc4ccccc34)C2)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7131	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)oc4ccccc34)C=C2)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7132	Cc1c(F)oc2ccccc12.NCCNCCCc1c(F)oc2ccccc12>>Cc1c(NCCNCCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_SaturatedAliphatic
snar_amine	7133	Cc1c(F)oc2ccccc12.NC=CNCCCc1c(F)oc2ccccc12>>Cc1c(NC=CNCCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	7134	Cc1c(F)oc2ccccc12.Nc1cccc(CCc2c(F)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7135	Cc1c(F)oc2ccccc12.NCCNc1ccccc1CCCc1c(F)oc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7136	Cc1c(F)oc2ccccc12.NC=CNc1ccccc1CCc1c(F)oc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7137	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7138	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)oc5ccccc45)cc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7139	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)oc5ccccc45)cc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7140	Cc1c(F)oc2ccccc12.Nc1cccc(CCc2c(F)oc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)oc4ccccc34)c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Phe
snar_amine	7141	Cc1c(F)oc2ccccc12.Nc1cc2ccc(CCc3c(F)oc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)oc5ccccc45)cc3cc2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_PhePhe
snar_amine	7142	Cc1c(F)oc2ccccc12.Nc1cncc(CCc2c(F)oc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7143	Cc1c(F)oc2ccccc12.Nc1cncc(CCc2c(F)oc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7144	Cc1c(F)oc2ccccc12.NCCNc1ccncc1CCc1c(F)oc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7145	Cc1c(F)oc2ccccc12.NC=CNc1ccncc1CCc1c(F)oc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7146	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)oc4ccccc34)Cc3ccccc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7147	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)oc4ccccc34)Cc3ccncc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7148	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)oc5ccccc45)cc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7149	Cc1c(F)oc2ccccc12.Fc1oc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)oc5ccccc45)cc32)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het5Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7150	Cc1c(F)oc2ccccc12.Nc1occ(CCc2c(F)oc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(F)oc4ccccc34)c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het5
snar_amine	7151	Cc1c(F)oc2ccccc12.Nc1oc2c(CCc3c(F)oc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)oc5ccccc45)occ3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het5Het5
snar_amine	7152	Cc1c(F)oc2ccccc12.Nc1oc2cc(CCc3c(F)oc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)oc5ccccc45)ncc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het5Het6
snar_amine	7153	Cc1c(F)oc2ccccc12.Nc1oc2ccc(CCc3c(F)oc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)oc5ccccc45)cc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het5Phe
snar_amine	7154	Cc1c(F)oc2ccccc12.Nc1nccc(CCc2c(F)oc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)oc4ccccc34)c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het6
snar_amine	7155	Cc1c(F)oc2ccccc12.Nc1c(Cc2c(F)oc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4ccccc34)nc3cocc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het6Het5
snar_amine	7156	Cc1c(F)oc2ccccc12.Nc1ncc2cc(CCc3c(F)oc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)oc5ccccc45)ncc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het6Het6
snar_amine	7157	Cc1c(F)oc2ccccc12.Nc1ncc2ccc(CCc3c(F)oc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)oc5ccccc45)cc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_Het6Phe
snar_amine	7158	Cc1c(F)oc2ccccc12.Nc1c(Cc2c(F)oc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)oc4ccccc34)cc3cocc3c2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_PheHet5
snar_amine	7159	Cc1c(F)oc2ccccc12.Nc1cc2cncc(CCc3c(F)oc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)oc5ccccc45)c3cc2N)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Amine_Primary_PheHet6
snar_amine	7160	Cc1c(F)oc2ccccc12.NCc1ccccc1CCCc1c(F)oc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.Benzylamine_primary
snar_amine	7161	Cc1c(F)oc2ccccc12.NCc1cnccc1CCCc1c(F)oc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(F)oc3ccccc23)oc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het5Phe.HeteroBenzylamine_primary
snar_amine	7162	Cc1cnccc1F.NCCNCCCCc1cnccc1F>>Cc1cnccc1N(CCN)CCCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7163	Cc1cnccc1F.NC=CNCCCCc1cnccc1F>>Cc1cnccc1N(C=CN)CCCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7164	Cc1cnccc1F.NC=CNC=CCCc1cnccc1F>>Cc1cnccc1N(C=CN)C=CCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7165	Cc1cnccc1F.NC1CNCC(CCc2cnccc2F)C1>>Cc1cnccc1N1CC(N)CC(CCc2cnccc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7166	Cc1cnccc1F.Fc1ccncc1CCC1CC=CNC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7167	Cc1cnccc1F.Fc1ccncc1CCC1C=CNC=CC1>>Cc1cnccc1N1C=CCC(CCc2cnccc2F)C=C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7168	Cc1cnccc1F.NCCNCCCc1cnccc1F>>Cc1cnccc1NCCNCCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_SaturatedAliphatic
snar_amine	7169	Cc1cnccc1F.NC=CNCCCc1cnccc1F>>Cc1cnccc1NC=CNCCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	7170	Cc1cnccc1F.Nc1cccc(CCc2cnccc2F)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cccc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7171	Cc1cnccc1F.NCCNc1ccccc1CCCc1cnccc1F>>Cc1cnccc1N(CCN)c1ccccc1CCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7172	Cc1cnccc1F.NC=CNc1ccccc1CCc1cnccc1F>>Cc1cnccc1N(C=CN)c1ccccc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7173	Cc1cnccc1F.Fc1ccncc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cnccc1N1c2ccccc2CCC(Cc2cnccc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7174	Cc1cnccc1F.Fc1ccncc1Cc1ccc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ccc(Cc3cnccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7175	Cc1cnccc1F.Fc1ccncc1Cc1ccc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ccc(Cc3cnccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7176	Cc1cnccc1F.Nc1cccc(CCc2cnccc2F)c1N>>Cc1cnccc1Nc1cccc(CCc2cnccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Phe
snar_amine	7177	Cc1cnccc1F.Nc1cc2ccc(CCc3cnccc3F)cc2cc1N>>Cc1cnccc1Nc1cc2ccc(CCc3cnccc3F)cc2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_PhePhe
snar_amine	7178	Cc1cnccc1F.Nc1cncc(CCc2cnccc2F)c1Nc1ccccc1>>Cc1cnccc1N(c1ccccc1)c1c(N)cncc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7179	Cc1cnccc1F.Nc1cncc(CCc2cnccc2F)c1Nc1cccnc1>>Cc1cnccc1N(c1cccnc1)c1c(N)cncc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7180	Cc1cnccc1F.NCCNc1ccncc1CCc1cnccc1F>>Cc1cnccc1N(CCN)c1ccncc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7181	Cc1cnccc1F.NC=CNc1ccncc1CCc1cnccc1F>>Cc1cnccc1N(C=CN)c1ccncc1CCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7182	Cc1cnccc1F.Fc1ccncc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cnccc1N1c2cnccc2CCC(Cc2cnccc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7183	Cc1cnccc1F.Fc1ccncc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cnccc1N1c2ccncc2CCC(Cc2cnccc2F)Cc2ccncc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7184	Cc1cnccc1F.Fc1ccncc1Cc1cnc2c(c1)NCCC2>>Cc1cnccc1N1CCCc2ncc(Cc3cnccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7185	Cc1cnccc1F.Fc1ccncc1Cc1cnc2c(c1)NC=CC2>>Cc1cnccc1N1C=CCc2ncc(Cc3cnccc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7186	Cc1cnccc1F.Nc1occ(CCc2cnccc2F)c1N>>Cc1cnccc1Nc1occ(CCc2cnccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het5
snar_amine	7187	Cc1cnccc1F.Nc1oc2c(CCc3cnccc3F)occ2c1N>>Cc1cnccc1Nc1oc2c(CCc3cnccc3F)occ2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het5Het5
snar_amine	7188	Cc1cnccc1F.Nc1oc2cc(CCc3cnccc3F)ncc2c1N>>Cc1cnccc1Nc1oc2cc(CCc3cnccc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het5Het6
snar_amine	7189	Cc1cnccc1F.Nc1oc2ccc(CCc3cnccc3F)cc2c1N>>Cc1cnccc1Nc1oc2ccc(CCc3cnccc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het5Phe
snar_amine	7190	Cc1cnccc1F.Nc1nccc(CCc2cnccc2F)c1N>>Cc1cnccc1Nc1nccc(CCc2cnccc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het6
snar_amine	7191	Cc1cnccc1F.Nc1c(Cc2cnccc2F)nc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2F)nc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het6Het5
snar_amine	7192	Cc1cnccc1F.Nc1ncc2cc(CCc3cnccc3F)ncc2c1N>>Cc1cnccc1Nc1ncc2cc(CCc3cnccc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het6Het6
snar_amine	7193	Cc1cnccc1F.Nc1ncc2ccc(CCc3cnccc3F)cc2c1N>>Cc1cnccc1Nc1ncc2ccc(CCc3cnccc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_Het6Phe
snar_amine	7194	Cc1cnccc1F.Nc1c(Cc2cnccc2F)cc2cocc2c1N>>Cc1cnccc1Nc1c(Cc2cnccc2F)cc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_PheHet5
snar_amine	7195	Cc1cnccc1F.Nc1cc2cncc(CCc3cnccc3F)c2cc1N>>Cc1cnccc1Nc1cc2cncc(CCc3cnccc3F)c2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Amine_Primary_PheHet6
snar_amine	7196	Cc1cnccc1F.NCc1ccccc1CCCc1cnccc1F>>Cc1cnccc1NCc1ccccc1CCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.Benzylamine_primary
snar_amine	7197	Cc1cnccc1F.NCc1cnccc1CCCc1cnccc1F>>Cc1cnccc1NCc1cnccc1CCCc1cnccc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6.HeteroBenzylamine_primary
snar_amine	7198	Cc1nc2cocc2cc1F.NCCNCCCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(CCN)CCCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7199	Cc1nc2cocc2cc1F.NC=CNCCCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(C=CN)CCCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7200	Cc1nc2cocc2cc1F.NC=CNC=CCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(C=CN)C=CCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7201	Cc1nc2cocc2cc1F.NC1CNCC(CCc2nc3cocc3cc2F)C1>>Cc1nc2cocc2cc1N1CC(N)CC(CCc2nc3cocc3cc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7202	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1CCC1CC=CNC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7203	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1CCC1C=CNC=CC1>>Cc1nc2cocc2cc1N1C=CCC(CCc2nc3cocc3cc2F)C=C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7204	Cc1nc2cocc2cc1F.NCCNCCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1NCCNCCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_SaturatedAliphatic
snar_amine	7205	Cc1nc2cocc2cc1F.NC=CNCCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1NC=CNCCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_UnsaturatedAliphatic
snar_amine	7206	Cc1nc2cocc2cc1F.Nc1cccc(CCc2nc3cocc3cc2F)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7207	Cc1nc2cocc2cc1F.NCCNc1ccccc1CCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(CCN)c1ccccc1CCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7208	Cc1nc2cocc2cc1F.NC=CNc1ccccc1CCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(C=CN)c1ccccc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7209	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2ccccc2CCC(Cc2nc3cocc3cc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7210	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1Cc1ccc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ccc(Cc3nc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7211	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1Cc1ccc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ccc(Cc3nc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7212	Cc1nc2cocc2cc1F.Nc1cccc(CCc2nc3cocc3cc2F)c1N>>Cc1nc2cocc2cc1Nc1cccc(CCc2nc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Phe
snar_amine	7213	Cc1nc2cocc2cc1F.Nc1cc2ccc(CCc3nc4cocc4cc3F)cc2cc1N>>Cc1nc2cocc2cc1Nc1cc2ccc(CCc3nc4cocc4cc3F)cc2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_PhePhe
snar_amine	7214	Cc1nc2cocc2cc1F.Nc1cncc(CCc2nc3cocc3cc2F)c1Nc1ccccc1>>Cc1nc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7215	Cc1nc2cocc2cc1F.Nc1cncc(CCc2nc3cocc3cc2F)c1Nc1cccnc1>>Cc1nc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7216	Cc1nc2cocc2cc1F.NCCNc1ccncc1CCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(CCN)c1ccncc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7217	Cc1nc2cocc2cc1F.NC=CNc1ccncc1CCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1N(C=CN)c1ccncc1CCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7218	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1nc2cocc2cc1N1c2cnccc2CCC(Cc2nc3cocc3cc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7219	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1nc2cocc2cc1N1c2ccncc2CCC(Cc2nc3cocc3cc2F)Cc2ccncc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7220	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1Cc1cnc2c(c1)NCCC2>>Cc1nc2cocc2cc1N1CCCc2ncc(Cc3nc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7221	Cc1nc2cocc2cc1F.Fc1cc2cocc2nc1Cc1cnc2c(c1)NC=CC2>>Cc1nc2cocc2cc1N1C=CCc2ncc(Cc3nc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7222	Cc1nc2cocc2cc1F.Nc1occ(CCc2nc3cocc3cc2F)c1N>>Cc1nc2cocc2cc1Nc1occ(CCc2nc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het5
snar_amine	7223	Cc1nc2cocc2cc1F.Nc1oc2c(CCc3nc4cocc4cc3F)occ2c1N>>Cc1nc2cocc2cc1Nc1oc2c(CCc3nc4cocc4cc3F)occ2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het5Het5
snar_amine	7224	Cc1nc2cocc2cc1F.Nc1oc2cc(CCc3nc4cocc4cc3F)ncc2c1N>>Cc1nc2cocc2cc1Nc1oc2cc(CCc3nc4cocc4cc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het5Het6
snar_amine	7225	Cc1nc2cocc2cc1F.Nc1oc2ccc(CCc3nc4cocc4cc3F)cc2c1N>>Cc1nc2cocc2cc1Nc1oc2ccc(CCc3nc4cocc4cc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het5Phe
snar_amine	7226	Cc1nc2cocc2cc1F.Nc1nccc(CCc2nc3cocc3cc2F)c1N>>Cc1nc2cocc2cc1Nc1nccc(CCc2nc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het6
snar_amine	7227	Cc1nc2cocc2cc1F.Nc1c(Cc2nc3cocc3cc2F)nc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2F)nc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het6Het5
snar_amine	7228	Cc1nc2cocc2cc1F.Nc1ncc2cc(CCc3nc4cocc4cc3F)ncc2c1N>>Cc1nc2cocc2cc1Nc1ncc2cc(CCc3nc4cocc4cc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het6Het6
snar_amine	7229	Cc1nc2cocc2cc1F.Nc1ncc2ccc(CCc3nc4cocc4cc3F)cc2c1N>>Cc1nc2cocc2cc1Nc1ncc2ccc(CCc3nc4cocc4cc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_Het6Phe
snar_amine	7230	Cc1nc2cocc2cc1F.Nc1c(Cc2nc3cocc3cc2F)cc2cocc2c1N>>Cc1nc2cocc2cc1Nc1c(Cc2nc3cocc3cc2F)cc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_PheHet5
snar_amine	7231	Cc1nc2cocc2cc1F.Nc1cc2cncc(CCc3nc4cocc4cc3F)c2cc1N>>Cc1nc2cocc2cc1Nc1cc2cncc(CCc3nc4cocc4cc3F)c2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Amine_Primary_PheHet6
snar_amine	7232	Cc1nc2cocc2cc1F.NCc1ccccc1CCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1NCc1ccccc1CCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.Benzylamine_primary
snar_amine	7233	Cc1nc2cocc2cc1F.NCc1cnccc1CCCc1nc2cocc2cc1F>>Cc1nc2cocc2cc1NCc1cnccc1CCCc1nc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het5.HeteroBenzylamine_primary
snar_amine	7234	Cc1c(F)ncc2ccncc12.NCCNCCCCc1c(F)ncc2ccncc12>>Cc1c(N(CCN)CCCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7235	Cc1c(F)ncc2ccncc12.NC=CNCCCCc1c(F)ncc2ccncc12>>Cc1c(N(C=CN)CCCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7236	Cc1c(F)ncc2ccncc12.NC=CNC=CCCc1c(F)ncc2ccncc12>>Cc1c(N(C=CN)C=CCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7237	Cc1c(F)ncc2ccncc12.NC1CNCC(CCc2c(F)ncc3ccncc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)ncc4ccncc34)C2)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7238	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)ncc4ccncc34)C2)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7239	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)ncc4ccncc34)C=C2)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7240	Cc1c(F)ncc2ccncc12.NCCNCCCc1c(F)ncc2ccncc12>>Cc1c(NCCNCCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_SaturatedAliphatic
snar_amine	7241	Cc1c(F)ncc2ccncc12.NC=CNCCCc1c(F)ncc2ccncc12>>Cc1c(NC=CNCCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_UnsaturatedAliphatic
snar_amine	7242	Cc1c(F)ncc2ccncc12.Nc1cccc(CCc2c(F)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7243	Cc1c(F)ncc2ccncc12.NCCNc1ccccc1CCCc1c(F)ncc2ccncc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7244	Cc1c(F)ncc2ccncc12.NC=CNc1ccccc1CCc1c(F)ncc2ccncc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7245	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7246	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)ncc5ccncc45)cc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7247	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)ncc5ccncc45)cc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7248	Cc1c(F)ncc2ccncc12.Nc1cccc(CCc2c(F)ncc3ccncc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)ncc4ccncc34)c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Phe
snar_amine	7249	Cc1c(F)ncc2ccncc12.Nc1cc2ccc(CCc3c(F)ncc4ccncc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)ncc5ccncc45)cc3cc2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_PhePhe
snar_amine	7250	Cc1c(F)ncc2ccncc12.Nc1cncc(CCc2c(F)ncc3ccncc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7251	Cc1c(F)ncc2ccncc12.Nc1cncc(CCc2c(F)ncc3ccncc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7252	Cc1c(F)ncc2ccncc12.NCCNc1ccncc1CCc1c(F)ncc2ccncc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7253	Cc1c(F)ncc2ccncc12.NC=CNc1ccncc1CCc1c(F)ncc2ccncc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7254	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)ncc4ccncc34)Cc3ccccc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7255	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)ncc4ccncc34)Cc3ccncc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7256	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)ncc5ccncc45)cc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7257	Cc1c(F)ncc2ccncc12.Fc1ncc2ccncc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)ncc5ccncc45)cc32)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Het6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7258	Cc1c(F)ncc2ccncc12.Nc1occ(CCc2c(F)ncc3ccncc23)c1N>>Cc1c(Nc2occ(CCc3c(F)ncc4ccncc34)c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het5
snar_amine	7259	Cc1c(F)ncc2ccncc12.Nc1oc2c(CCc3c(F)ncc4ccncc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)ncc5ccncc45)occ3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het5Het5
snar_amine	7260	Cc1c(F)ncc2ccncc12.Nc1oc2cc(CCc3c(F)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het5Het6
snar_amine	7261	Cc1c(F)ncc2ccncc12.Nc1oc2ccc(CCc3c(F)ncc4ccncc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)ncc5ccncc45)cc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het5Phe
snar_amine	7262	Cc1c(F)ncc2ccncc12.Nc1nccc(CCc2c(F)ncc3ccncc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)ncc4ccncc34)c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het6
snar_amine	7263	Cc1c(F)ncc2ccncc12.Nc1c(Cc2c(F)ncc3ccncc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ncc4ccncc34)nc3cocc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het6Het5
snar_amine	7264	Cc1c(F)ncc2ccncc12.Nc1ncc2cc(CCc3c(F)ncc4ccncc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)ncc5ccncc45)ncc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het6Het6
snar_amine	7265	Cc1c(F)ncc2ccncc12.Nc1ncc2ccc(CCc3c(F)ncc4ccncc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)ncc5ccncc45)cc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_Het6Phe
snar_amine	7266	Cc1c(F)ncc2ccncc12.Nc1c(Cc2c(F)ncc3ccncc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ncc4ccncc34)cc3cocc3c2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_PheHet5
snar_amine	7267	Cc1c(F)ncc2ccncc12.Nc1cc2cncc(CCc3c(F)ncc4ccncc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)ncc5ccncc45)c3cc2N)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Amine_Primary_PheHet6
snar_amine	7268	Cc1c(F)ncc2ccncc12.NCc1ccccc1CCCc1c(F)ncc2ccncc12>>Cc1c(NCc2ccccc2CCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.Benzylamine_primary
snar_amine	7269	Cc1c(F)ncc2ccncc12.NCc1cnccc1CCCc1c(F)ncc2ccncc12>>Cc1c(NCc2cnccc2CCCc2c(F)ncc3ccncc23)ncc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][*:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Het6.HeteroBenzylamine_primary
snar_amine	7270	Cc1c(F)ncc2ccccc12.NCCNCCCCc1c(F)ncc2ccccc12>>Cc1c(N(CCN)CCCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7271	Cc1c(F)ncc2ccccc12.NC=CNCCCCc1c(F)ncc2ccccc12>>Cc1c(N(C=CN)CCCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7272	Cc1c(F)ncc2ccccc12.NC=CNC=CCCc1c(F)ncc2ccccc12>>Cc1c(N(C=CN)C=CCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7273	Cc1c(F)ncc2ccccc12.NC1CNCC(CCc2c(F)ncc3ccccc23)C1>>Cc1c(N2CC(N)CC(CCc3c(F)ncc4ccccc34)C2)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7274	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1CCC1CC=CNC1>>Cc1c(N2C=CCC(CCc3c(F)ncc4ccccc34)C2)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7275	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1CCC1C=CNC=CC1>>Cc1c(N2C=CCC(CCc3c(F)ncc4ccccc34)C=C2)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7276	Cc1c(F)ncc2ccccc12.NCCNCCCc1c(F)ncc2ccccc12>>Cc1c(NCCNCCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_SaturatedAliphatic
snar_amine	7277	Cc1c(F)ncc2ccccc12.NC=CNCCCc1c(F)ncc2ccccc12>>Cc1c(NC=CNCCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_UnsaturatedAliphatic
snar_amine	7278	Cc1c(F)ncc2ccccc12.Nc1cccc(CCc2c(F)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cccc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7279	Cc1c(F)ncc2ccccc12.NCCNc1ccccc1CCCc1c(F)ncc2ccccc12>>Cc1c(N(CCN)c2ccccc2CCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7280	Cc1c(F)ncc2ccccc12.NC=CNc1ccccc1CCc1c(F)ncc2ccccc12>>Cc1c(N(C=CN)c2ccccc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7281	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1c(N2c3ccccc3CCC(Cc3c(F)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7282	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1Cc1ccc2c(c1)NCCC2>>Cc1c(N2CCCc3ccc(Cc4c(F)ncc5ccccc45)cc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7283	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1Cc1ccc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ccc(Cc4c(F)ncc5ccccc45)cc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7284	Cc1c(F)ncc2ccccc12.Nc1cccc(CCc2c(F)ncc3ccccc23)c1N>>Cc1c(Nc2cccc(CCc3c(F)ncc4ccccc34)c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Phe
snar_amine	7285	Cc1c(F)ncc2ccccc12.Nc1cc2ccc(CCc3c(F)ncc4ccccc34)cc2cc1N>>Cc1c(Nc2cc3ccc(CCc4c(F)ncc5ccccc45)cc3cc2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_PhePhe
snar_amine	7286	Cc1c(F)ncc2ccccc12.Nc1cncc(CCc2c(F)ncc3ccccc23)c1Nc1ccccc1>>Cc1c(N(c2ccccc2)c2c(N)cncc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7287	Cc1c(F)ncc2ccccc12.Nc1cncc(CCc2c(F)ncc3ccccc23)c1Nc1cccnc1>>Cc1c(N(c2cccnc2)c2c(N)cncc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7288	Cc1c(F)ncc2ccccc12.NCCNc1ccncc1CCc1c(F)ncc2ccccc12>>Cc1c(N(CCN)c2ccncc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7289	Cc1c(F)ncc2ccccc12.NC=CNc1ccncc1CCc1c(F)ncc2ccccc12>>Cc1c(N(C=CN)c2ccncc2CCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7290	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1c(N2c3cnccc3CCC(Cc3c(F)ncc4ccccc34)Cc3ccccc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7291	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1c(N2c3ccncc3CCC(Cc3c(F)ncc4ccccc34)Cc3ccncc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7292	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1Cc1cnc2c(c1)NCCC2>>Cc1c(N2CCCc3ncc(Cc4c(F)ncc5ccccc45)cc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7293	Cc1c(F)ncc2ccccc12.Fc1ncc2ccccc2c1Cc1cnc2c(c1)NC=CC2>>Cc1c(N2C=CCc3ncc(Cc4c(F)ncc5ccccc45)cc32)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_Het6Phe.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7294	Cc1c(F)ncc2ccccc12.Nc1occ(CCc2c(F)ncc3ccccc23)c1N>>Cc1c(Nc2occ(CCc3c(F)ncc4ccccc34)c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het5
snar_amine	7295	Cc1c(F)ncc2ccccc12.Nc1oc2c(CCc3c(F)ncc4ccccc34)occ2c1N>>Cc1c(Nc2oc3c(CCc4c(F)ncc5ccccc45)occ3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het5Het5
snar_amine	7296	Cc1c(F)ncc2ccccc12.Nc1oc2cc(CCc3c(F)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2oc3cc(CCc4c(F)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het5Het6
snar_amine	7297	Cc1c(F)ncc2ccccc12.Nc1oc2ccc(CCc3c(F)ncc4ccccc34)cc2c1N>>Cc1c(Nc2oc3ccc(CCc4c(F)ncc5ccccc45)cc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het5Phe
snar_amine	7298	Cc1c(F)ncc2ccccc12.Nc1nccc(CCc2c(F)ncc3ccccc23)c1N>>Cc1c(Nc2nccc(CCc3c(F)ncc4ccccc34)c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het6
snar_amine	7299	Cc1c(F)ncc2ccccc12.Nc1c(Cc2c(F)ncc3ccccc23)nc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ncc4ccccc34)nc3cocc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het6Het5
snar_amine	7300	Cc1c(F)ncc2ccccc12.Nc1ncc2cc(CCc3c(F)ncc4ccccc34)ncc2c1N>>Cc1c(Nc2ncc3cc(CCc4c(F)ncc5ccccc45)ncc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het6Het6
snar_amine	7301	Cc1c(F)ncc2ccccc12.Nc1ncc2ccc(CCc3c(F)ncc4ccccc34)cc2c1N>>Cc1c(Nc2ncc3ccc(CCc4c(F)ncc5ccccc45)cc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_Het6Phe
snar_amine	7302	Cc1c(F)ncc2ccccc12.Nc1c(Cc2c(F)ncc3ccccc23)cc2cocc2c1N>>Cc1c(Nc2c(Cc3c(F)ncc4ccccc34)cc3cocc3c2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_PheHet5
snar_amine	7303	Cc1c(F)ncc2ccccc12.Nc1cc2cncc(CCc3c(F)ncc4ccccc34)c2cc1N>>Cc1c(Nc2cc3cncc(CCc4c(F)ncc5ccccc45)c3cc2N)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Amine_Primary_PheHet6
snar_amine	7304	Cc1c(F)ncc2ccccc12.NCc1ccccc1CCCc1c(F)ncc2ccccc12>>Cc1c(NCc2ccccc2CCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.Benzylamine_primary
snar_amine	7305	Cc1c(F)ncc2ccccc12.NCc1cnccc1CCCc1c(F)ncc2ccccc12>>Cc1c(NCc2cnccc2CCCc2c(F)ncc3ccccc23)ncc2ccccc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_Het6Phe.HeteroBenzylamine_primary
snar_amine	7306	Cc1cc2cocc2cc1F.NCCNCCCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(CCN)CCCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7307	Cc1cc2cocc2cc1F.NC=CNCCCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(C=CN)CCCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7308	Cc1cc2cocc2cc1F.NC=CNC=CCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(C=CN)C=CCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7309	Cc1cc2cocc2cc1F.NC1CNCC(CCc2cc3cocc3cc2F)C1>>Cc1cc2cocc2cc1N1CC(N)CC(CCc2cc3cocc3cc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7310	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1CCC1CC=CNC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2F)C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7311	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1CCC1C=CNC=CC1>>Cc1cc2cocc2cc1N1C=CCC(CCc2cc3cocc3cc2F)C=C1	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7312	Cc1cc2cocc2cc1F.NCCNCCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1NCCNCCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_SaturatedAliphatic
snar_amine	7313	Cc1cc2cocc2cc1F.NC=CNCCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1NC=CNCCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_UnsaturatedAliphatic
snar_amine	7314	Cc1cc2cocc2cc1F.Nc1cccc(CCc2cc3cocc3cc2F)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cccc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7315	Cc1cc2cocc2cc1F.NCCNc1ccccc1CCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(CCN)c1ccccc1CCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7316	Cc1cc2cocc2cc1F.NC=CNc1ccccc1CCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(C=CN)c1ccccc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7317	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1CC1CCc2ccccc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2ccccc2CCC(Cc2cc3cocc3cc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7318	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1Cc1ccc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ccc(Cc3cc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7319	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1Cc1ccc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ccc(Cc3cc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7320	Cc1cc2cocc2cc1F.Nc1cccc(CCc2cc3cocc3cc2F)c1N>>Cc1cc2cocc2cc1Nc1cccc(CCc2cc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Phe
snar_amine	7321	Cc1cc2cocc2cc1F.Nc1cc2ccc(CCc3cc4cocc4cc3F)cc2cc1N>>Cc1cc2cocc2cc1Nc1cc2ccc(CCc3cc4cocc4cc3F)cc2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_PhePhe
snar_amine	7322	Cc1cc2cocc2cc1F.Nc1cncc(CCc2cc3cocc3cc2F)c1Nc1ccccc1>>Cc1cc2cocc2cc1N(c1ccccc1)c1c(N)cncc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7323	Cc1cc2cocc2cc1F.Nc1cncc(CCc2cc3cocc3cc2F)c1Nc1cccnc1>>Cc1cc2cocc2cc1N(c1cccnc1)c1c(N)cncc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7324	Cc1cc2cocc2cc1F.NCCNc1ccncc1CCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(CCN)c1ccncc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7325	Cc1cc2cocc2cc1F.NC=CNc1ccncc1CCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1N(C=CN)c1ccncc1CCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7326	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1CC1CCc2ccncc2Nc2ccccc2C1>>Cc1cc2cocc2cc1N1c2cnccc2CCC(Cc2cc3cocc3cc2F)Cc2ccccc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7327	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1CC1CCc2cnccc2Nc2cnccc2C1>>Cc1cc2cocc2cc1N1c2ccncc2CCC(Cc2cc3cocc3cc2F)Cc2ccncc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7328	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1Cc1cnc2c(c1)NCCC2>>Cc1cc2cocc2cc1N1CCCc2ncc(Cc3cc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7329	Cc1cc2cocc2cc1F.Fc1cc2cocc2cc1Cc1cnc2c(c1)NC=CC2>>Cc1cc2cocc2cc1N1C=CCc2ncc(Cc3cc4cocc4cc3F)cc21	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet5.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7330	Cc1cc2cocc2cc1F.Nc1occ(CCc2cc3cocc3cc2F)c1N>>Cc1cc2cocc2cc1Nc1occ(CCc2cc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het5
snar_amine	7331	Cc1cc2cocc2cc1F.Nc1oc2c(CCc3cc4cocc4cc3F)occ2c1N>>Cc1cc2cocc2cc1Nc1oc2c(CCc3cc4cocc4cc3F)occ2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het5Het5
snar_amine	7332	Cc1cc2cocc2cc1F.Nc1oc2cc(CCc3cc4cocc4cc3F)ncc2c1N>>Cc1cc2cocc2cc1Nc1oc2cc(CCc3cc4cocc4cc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het5Het6
snar_amine	7333	Cc1cc2cocc2cc1F.Nc1oc2ccc(CCc3cc4cocc4cc3F)cc2c1N>>Cc1cc2cocc2cc1Nc1oc2ccc(CCc3cc4cocc4cc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het5Phe
snar_amine	7334	Cc1cc2cocc2cc1F.Nc1nccc(CCc2cc3cocc3cc2F)c1N>>Cc1cc2cocc2cc1Nc1nccc(CCc2cc3cocc3cc2F)c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het6
snar_amine	7335	Cc1cc2cocc2cc1F.Nc1c(Cc2cc3cocc3cc2F)nc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2F)nc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het6Het5
snar_amine	7336	Cc1cc2cocc2cc1F.Nc1ncc2cc(CCc3cc4cocc4cc3F)ncc2c1N>>Cc1cc2cocc2cc1Nc1ncc2cc(CCc3cc4cocc4cc3F)ncc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het6Het6
snar_amine	7337	Cc1cc2cocc2cc1F.Nc1ncc2ccc(CCc3cc4cocc4cc3F)cc2c1N>>Cc1cc2cocc2cc1Nc1ncc2ccc(CCc3cc4cocc4cc3F)cc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_Het6Phe
snar_amine	7338	Cc1cc2cocc2cc1F.Nc1c(Cc2cc3cocc3cc2F)cc2cocc2c1N>>Cc1cc2cocc2cc1Nc1c(Cc2cc3cocc3cc2F)cc2cocc2c1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_PheHet5
snar_amine	7339	Cc1cc2cocc2cc1F.Nc1cc2cncc(CCc3cc4cocc4cc3F)c2cc1N>>Cc1cc2cocc2cc1Nc1cc2cncc(CCc3cc4cocc4cc3F)c2cc1N	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Amine_Primary_PheHet6
snar_amine	7340	Cc1cc2cocc2cc1F.NCc1ccccc1CCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1NCc1ccccc1CCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.Benzylamine_primary
snar_amine	7341	Cc1cc2cocc2cc1F.NCc1cnccc1CCCc1cc2cocc2cc1F>>Cc1cc2cocc2cc1NCc1cnccc1CCCc1cc2cocc2cc1F	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet5.HeteroBenzylamine_primary
snar_amine	7342	CCc1c(F)ccc2ccncc12.NCCNCCCCCc1c(F)ccc2ccncc12>>CCc1c(N(CCN)CCCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7343	CCc1c(F)ccc2ccncc12.NC=CNCCCCCc1c(F)ccc2ccncc12>>CCc1c(N(C=CN)CCCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7344	CCc1c(F)ccc2ccncc12.NC=CNC=CCCCc1c(F)ccc2ccncc12>>CCc1c(N(C=CN)C=CCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7345	CCc1c(F)ccc2ccncc12.NC1CNCC(CCCc2c(F)ccc3ccncc23)C1>>CCc1c(N2CC(N)CC(CCCc3c(F)ccc4ccncc34)C2)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[!$(C=C);!$(C#C);!$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-SaturatedAliphatic
snar_amine	7346	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCCC1CC=CNC1>>CCc1c(N2C=CCC(CCCc3c(F)ccc4ccncc34)C2)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);R;D2;$([N;X3;!+;!-;!$(N=*);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$(C=N),$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7347	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCCC1C=CNC=CC1>>CCc1c(N2C=CCC(CCCc3c(F)ccc4ccncc34)C=C2)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$(C=C),$(C#C),$(C#N);!$(a)]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-UnsaturatedAliphatic
snar_amine	7348	CCc1c(F)ccc2ccncc12.NCCNCCCCc1c(F)ccc2ccncc12>>CCc1c(NCCNCCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N[C;X4][c;$(a1aaaa1),$(a1aaaaa1)]);!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([!$(*C=C);!$(*C#C);!$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_SaturatedAliphatic
snar_amine	7349	CCc1c(F)ccc2ccncc12.NC=CNCCCCc1c(F)ccc2ccncc12>>CCc1c(NC=CNCCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*C=C),$(*C#C),$(*C#N);!$(*a)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_UnsaturatedAliphatic
snar_amine	7350	CCc1c(F)ccc2ccncc12.Nc1cccc(CCCc2c(F)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cccc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_Aromatic-Aromatic
snar_amine	7351	CCc1c(F)ccc2ccncc12.NCCNc1ccccc1CCCCc1c(F)ccc2ccncc12>>CCc1c(N(CCN)c2ccccc2CCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7352	CCc1c(F)ccc2ccncc12.NC=CNc1ccccc1CCCc1c(F)ccc2ccncc12>>CCc1c(N(C=CN)c2ccccc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7353	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCC1CCc2ccccc2Nc2ccccc2C1>>CCc1c(N2c3ccccc3CCC(CCc3c(F)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_Aromatic-Aromatic
snar_amine	7354	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCc1ccc2c(c1)NCCC2>>CCc1c(N2CCCc3ccc(CCc4c(F)ccc5ccncc45)cc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Aromatic
snar_amine	7355	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCc1ccc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ccc(CCc4c(F)ccc5ccncc45)cc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Aromatic
snar_amine	7356	CCc1c(F)ccc2ccncc12.Nc1cccc(CCCc2c(F)ccc3ccncc23)c1N>>CCc1c(Nc2cccc(CCCc3c(F)ccc4ccncc34)c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Phe
snar_amine	7357	CCc1c(F)ccc2ccncc12.Nc1cc2ccc(CCCc3c(F)ccc4ccncc34)cc2cc1N>>CCc1c(Nc2cc3ccc(CCCc4c(F)ccc5ccncc45)cc3cc2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_PhePhe
snar_amine	7358	CCc1c(F)ccc2ccncc12.Nc1cncc(CCCc2c(F)ccc3ccncc23)c1Nc1ccccc1>>CCc1c(N(c2ccccc2)c2c(N)cncc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7359	CCc1c(F)ccc2ccncc12.Nc1cncc(CCCc2c(F)ccc3ccncc23)c1Nc1cccnc1>>CCc1c(N(c2cccnc2)c2c(N)cncc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7360	CCc1c(F)ccc2ccncc12.NCCNc1ccncc1CCCc1c(F)ccc2ccncc12>>CCc1c(N(CCN)c2ccncc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7361	CCc1c(F)ccc2ccncc12.NC=CNc1ccncc1CCCc1c(F)ccc2ccncc12>>CCc1c(N(C=CN)c2ccncc2CCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);!R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_AcyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7362	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCC1CCc2ccncc2Nc2ccccc2C1>>CCc1c(N2c3cnccc3CCC(CCc3c(F)ccc4ccncc34)Cc3ccccc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([c;$(c1ccccc1)]),$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_Aromatic-Heteroaromatic
snar_amine	7363	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCC1CCc2cnccc2Nc2cnccc2C1>>CCc1c(N2c3ccncc3CCC(CCc3c(F)ccc4ccncc34)Cc3ccncc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_Heteroaromatic-Heteroaromatic
snar_amine	7364	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCc1cnc2c(c1)NCCC2>>CCc1c(N2CCCc3ncc(CCc4c(F)ccc5ccncc45)cc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([!$(C=C);!$(C#C);!$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_SaturatedAliphatic-Heteroaromatic
snar_amine	7365	CCc1c(F)ccc2ccncc12.Fc1ccc2ccncc2c1CCc1cnc2c(c1)NC=CC2>>CCc1c(N2C=CCc3ncc(CCc4c(F)ccc5ccncc45)cc32)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2;$([N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);R;D2]([$(C=C),$(C#C),$(C#N);!$(a)])[$([a;$(a1aaaaa1)]),$([a;$(a1aaaa1)]);!$([c;$(c1ccccc1)]);!$([c;$(c1cccc1)])]):3]([#6:4])[#6:5]>>[a:2][N:3]([#6:4])[#6:5]	X-Fluoride_PheHet6.Amine_CyclicSecondary_UnsaturatedAliphatic-Heteroaromatic
snar_amine	7366	CCc1c(F)ccc2ccncc12.Nc1occ(CCCc2c(F)ccc3ccncc23)c1N>>CCc1c(Nc2occ(CCCc3c(F)ccc4ccncc34)c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het5
snar_amine	7367	CCc1c(F)ccc2ccncc12.Nc1oc2c(CCCc3c(F)ccc4ccncc34)occ2c1N>>CCc1c(Nc2oc3c(CCCc4c(F)ccc5ccncc45)occ3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het5Het5
snar_amine	7368	CCc1c(F)ccc2ccncc12.Nc1oc2cc(CCCc3c(F)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2oc3cc(CCCc4c(F)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het5Het6
snar_amine	7369	CCc1c(F)ccc2ccncc12.Nc1oc2ccc(CCCc3c(F)ccc4ccncc34)cc2c1N>>CCc1c(Nc2oc3ccc(CCCc4c(F)ccc5ccncc45)cc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het5Phe
snar_amine	7370	CCc1c(F)ccc2ccncc12.Nc1nccc(CCCc2c(F)ccc3ccncc23)c1N>>CCc1c(Nc2nccc(CCCc3c(F)ccc4ccncc34)c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het6
snar_amine	7371	CCc1c(F)ccc2ccncc12.Nc1c(CCc2c(F)ccc3ccncc23)nc2cocc2c1N>>CCc1c(Nc2c(CCc3c(F)ccc4ccncc34)nc3cocc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het6Het5
snar_amine	7372	CCc1c(F)ccc2ccncc12.Nc1ncc2cc(CCCc3c(F)ccc4ccncc34)ncc2c1N>>CCc1c(Nc2ncc3cc(CCCc4c(F)ccc5ccncc45)ncc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het6Het6
snar_amine	7373	CCc1c(F)ccc2ccncc12.Nc1ncc2ccc(CCCc3c(F)ccc4ccncc34)cc2c1N>>CCc1c(Nc2ncc3ccc(CCCc4c(F)ccc5ccncc45)cc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_Het6Phe
snar_amine	7374	CCc1c(F)ccc2ccncc12.Nc1c(CCc2c(F)ccc3ccncc23)cc2cocc2c1N>>CCc1c(Nc2c(CCc3c(F)ccc4ccncc34)cc3cocc3c2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_PheHet5
snar_amine	7375	CCc1c(F)ccc2ccncc12.Nc1cc2cncc(CCCc3c(F)ccc4ccncc34)c2cc1N>>CCc1c(Nc2cc3cncc(CCCc4c(F)ccc5ccncc45)c3cc2N)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;!+;!-;!$(N=*);$([N;!$(N~[*;!#6])]);!$(N[*]=[*;O,S,P,N]);D1;$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Amine_Primary_PheHet6
snar_amine	7376	CCc1c(F)ccc2ccncc12.NCc1ccccc1CCCCc1c(F)ccc2ccncc12>>CCc1c(NCc2ccccc2CCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.Benzylamine_primary
snar_amine	7377	CCc1c(F)ccc2ccncc12.NCc1cnccc1CCCCc1c(F)ccc2ccncc12>>CCc1c(NCc2cnccc2CCCCc2c(F)ccc3ccncc23)ccc2ccncc12	[F;$([F][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]);!$(FC(F)F):1][a:2].[N;X3;D1;$(N[C;X4][c;!$(c1ccccc1)]):3][#6:4]>>[a:2][N:3][#6:4]	X-Fluoride_PheHet6.HeteroBenzylamine_primary
C_C_decarboxylation	7378	CCCC(=O)OC.COC(=O)CCCc1ccccc1Br>>CCCc1ccccc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Phe
C_C_decarboxylation	7379	CCCC(=O)OC.COC(=O)CCCc1c(Br)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_PhePhe
C_C_decarboxylation	7380	CCCC(=O)OC.COC(=O)CCCc1ccccc1I>>CCCc1ccccc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Phe
C_C_decarboxylation	7381	CCCC(=O)OC.COC(=O)CCCc1c(I)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_PhePhe
C_C_decarboxylation	7382	CCCC(=O)OC.COC(=O)CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCCc1cccc(CCCC(=O)OC)c1	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Phe
C_C_decarboxylation	7383	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCCc1ccc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_PhePhe
C_C_decarboxylation	7384	CCCC(=O)OC.COC(=O)CCCc1cocc1Br>>CCCc1cocc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het5
C_C_decarboxylation	7385	CCCC(=O)OC.COC(=O)CCCc1c(Br)oc2cocc12>>CCCc1oc2cocc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het5Het5
C_C_decarboxylation	7386	CCCC(=O)OC.COC(=O)CCCc1c(Br)oc2ccncc12>>CCCc1oc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het5Het6
C_C_decarboxylation	7387	CCCC(=O)OC.COC(=O)CCCc1c(Br)oc2ccccc12>>CCCc1oc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het5Phe
C_C_decarboxylation	7388	CCCC(=O)OC.COC(=O)CCCc1cnccc1Br>>CCCc1ccncc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het6
C_C_decarboxylation	7389	CCCC(=O)OC.COC(=O)CCCc1nc2cocc2cc1Br>>CCCc1cc2cocc2nc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het6Het5
C_C_decarboxylation	7390	CCCC(=O)OC.COC(=O)CCCc1c(Br)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het6Het6
C_C_decarboxylation	7391	CCCC(=O)OC.COC(=O)CCCc1c(Br)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_Het6Phe
C_C_decarboxylation	7392	CCCC(=O)OC.COC(=O)CCCc1cc2cocc2cc1Br>>CCCc1cc2cocc2cc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_PheHet5
C_C_decarboxylation	7393	CCCC(=O)OC.COC(=O)CCCCc1c(Br)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Bromide_PheHet6
C_C_decarboxylation	7394	CCCC(=O)OC.COC(=O)CCCc1cocc1Cl>>CCCc1cocc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het5
C_C_decarboxylation	7395	CCCC(=O)OC.COC(=O)CCCc1c(Cl)oc2cocc12>>CCCc1oc2cocc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het5Het5
C_C_decarboxylation	7396	CCCC(=O)OC.COC(=O)CCCc1c(Cl)oc2ccncc12>>CCCc1oc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het5Het6
C_C_decarboxylation	7397	CCCC(=O)OC.COC(=O)CCCc1c(Cl)oc2ccccc12>>CCCc1oc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het5Phe
C_C_decarboxylation	7398	CCCC(=O)OC.COC(=O)CCCc1cnccc1Cl>>CCCc1ccncc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het6
C_C_decarboxylation	7399	CCCC(=O)OC.COC(=O)CCCc1nc2cocc2cc1Cl>>CCCc1cc2cocc2nc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het6Het5
C_C_decarboxylation	7400	CCCC(=O)OC.COC(=O)CCCc1c(Cl)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het6Het6
C_C_decarboxylation	7401	CCCC(=O)OC.COC(=O)CCCc1c(Cl)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Chloride_Het6Phe
C_C_decarboxylation	7402	CCCC(=O)OC.COC(=O)CCCc1cocc1I>>CCCc1cocc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het5
C_C_decarboxylation	7403	CCCC(=O)OC.COC(=O)CCCc1c(I)oc2cocc12>>CCCc1oc2cocc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het5Het5
C_C_decarboxylation	7404	CCCC(=O)OC.COC(=O)CCCc1c(I)oc2ccncc12>>CCCc1oc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het5Het6
C_C_decarboxylation	7405	CCCC(=O)OC.COC(=O)CCCc1c(I)oc2ccccc12>>CCCc1oc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het5Phe
C_C_decarboxylation	7406	CCCC(=O)OC.COC(=O)CCCc1cnccc1I>>CCCc1ccncc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het6
C_C_decarboxylation	7407	CCCC(=O)OC.COC(=O)CCCc1nc2cocc2cc1I>>CCCc1cc2cocc2nc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het6Het5
C_C_decarboxylation	7408	CCCC(=O)OC.COC(=O)CCCc1c(I)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het6Het6
C_C_decarboxylation	7409	CCCC(=O)OC.COC(=O)CCCc1c(I)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_Het6Phe
C_C_decarboxylation	7410	CCCC(=O)OC.COC(=O)CCCc1cc2cocc2cc1I>>CCCc1cc2cocc2cc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_PheHet5
C_C_decarboxylation	7411	CCCC(=O)OC.COC(=O)CCCCc1c(I)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Iodide_PheHet6
C_C_decarboxylation	7412	CCCC(=O)OC.COC(=O)CCCc1cocc1OS(=O)(=O)C(F)(F)F>>CCCc1cocc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het5
C_C_decarboxylation	7413	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCCc1oc2cocc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het5Het5
C_C_decarboxylation	7414	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCCc1oc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het5Het6
C_C_decarboxylation	7415	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCCc1oc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het5Phe
C_C_decarboxylation	7416	CCCC(=O)OC.COC(=O)CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCCc1ccncc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het6
C_C_decarboxylation	7417	CCCC(=O)OC.COC(=O)CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCc1cc2cocc2nc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het6Het5
C_C_decarboxylation	7418	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCCc1ncc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het6Het6
C_C_decarboxylation	7419	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCCc1ncc2ccccc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_Het6Phe
C_C_decarboxylation	7420	CCCC(=O)OC.COC(=O)CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCc1cc2cocc2cc1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_PheHet5
C_C_decarboxylation	7421	CCCC(=O)OC.COC(=O)CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCCc1ccc2ccncc2c1CCCC(=O)OC	[O;D2;!R;$(O([#6])[C;D3;!R;$(C([#6])(=O)O[#6])]);!$(OC(=O)C(C)(C)C):1]C(=O)[*;$(C(C=O)):2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*;$(*=*):2][a:4]	EsterAcyclic.X-Triflate_PheHet6
C_C_decarboxylation	7422	CCCCC(=O)O.O=C(O)CCCCc1ccccc1Br>>CCCCc1ccccc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Phe
C_C_decarboxylation	7423	CCCCC(=O)O.O=C(O)CCCCc1c(Br)ccc2ccccc12>>CCCCc1ccc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_PhePhe
C_C_decarboxylation	7424	CCCCC(=O)O.O=C(O)CCCCc1ccccc1I>>CCCCc1ccccc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Phe
C_C_decarboxylation	7425	CCCCC(=O)O.O=C(O)CCCCc1c(I)ccc2ccccc12>>CCCCc1ccc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_PhePhe
C_C_decarboxylation	7426	CCCCC(=O)O.O=C(O)CCCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCCCc1cccc(CCCCC(=O)O)c1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Phe
C_C_decarboxylation	7427	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCCCc1ccc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_PhePhe
C_C_decarboxylation	7428	CCCCC(=O)O.O=C(O)CCCCc1cocc1Br>>CCCCc1cocc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het5
C_C_decarboxylation	7429	CCCCC(=O)O.O=C(O)CCCCc1c(Br)oc2cocc12>>CCCCc1oc2cocc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het5Het5
C_C_decarboxylation	7430	CCCCC(=O)O.O=C(O)CCCCc1c(Br)oc2ccncc12>>CCCCc1oc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het5Het6
C_C_decarboxylation	7431	CCCCC(=O)O.O=C(O)CCCCc1c(Br)oc2ccccc12>>CCCCc1oc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het5Phe
C_C_decarboxylation	7432	CCCCC(=O)O.O=C(O)CCCCc1cnccc1Br>>CCCCc1ccncc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het6
C_C_decarboxylation	7433	CCCCC(=O)O.O=C(O)CCCCc1nc2cocc2cc1Br>>CCCCc1cc2cocc2nc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het6Het5
C_C_decarboxylation	7434	CCCCC(=O)O.O=C(O)CCCCc1c(Br)ncc2ccncc12>>CCCCc1ncc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het6Het6
C_C_decarboxylation	7435	CCCCC(=O)O.O=C(O)CCCCc1c(Br)ncc2ccccc12>>CCCCc1ncc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_Het6Phe
C_C_decarboxylation	7436	CCCCC(=O)O.O=C(O)CCCCc1cc2cocc2cc1Br>>CCCCc1cc2cocc2cc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_PheHet5
C_C_decarboxylation	7437	CCCCC(=O)O.O=C(O)CCCCCc1c(Br)ccc2ccncc12>>CCCCc1ccc2ccncc2c1CCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Bromide_PheHet6
C_C_decarboxylation	7438	CCCCC(=O)O.O=C(O)CCCCc1cocc1Cl>>CCCCc1cocc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het5
C_C_decarboxylation	7439	CCCCC(=O)O.O=C(O)CCCCc1c(Cl)oc2cocc12>>CCCCc1oc2cocc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het5Het5
C_C_decarboxylation	7440	CCCCC(=O)O.O=C(O)CCCCc1c(Cl)oc2ccncc12>>CCCCc1oc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het5Het6
C_C_decarboxylation	7441	CCCCC(=O)O.O=C(O)CCCCc1c(Cl)oc2ccccc12>>CCCCc1oc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het5Phe
C_C_decarboxylation	7442	CCCCC(=O)O.O=C(O)CCCCc1cnccc1Cl>>CCCCc1ccncc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het6
C_C_decarboxylation	7443	CCCCC(=O)O.O=C(O)CCCCc1nc2cocc2cc1Cl>>CCCCc1cc2cocc2nc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het6Het5
C_C_decarboxylation	7444	CCCCC(=O)O.O=C(O)CCCCc1c(Cl)ncc2ccncc12>>CCCCc1ncc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het6Het6
C_C_decarboxylation	7445	CCCCC(=O)O.O=C(O)CCCCc1c(Cl)ncc2ccccc12>>CCCCc1ncc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Chloride_Het6Phe
C_C_decarboxylation	7446	CCCCC(=O)O.O=C(O)CCCCc1cocc1I>>CCCCc1cocc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het5
C_C_decarboxylation	7447	CCCCC(=O)O.O=C(O)CCCCc1c(I)oc2cocc12>>CCCCc1oc2cocc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het5Het5
C_C_decarboxylation	7448	CCCCC(=O)O.O=C(O)CCCCc1c(I)oc2ccncc12>>CCCCc1oc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het5Het6
C_C_decarboxylation	7449	CCCCC(=O)O.O=C(O)CCCCc1c(I)oc2ccccc12>>CCCCc1oc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het5Phe
C_C_decarboxylation	7450	CCCCC(=O)O.O=C(O)CCCCc1cnccc1I>>CCCCc1ccncc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het6
C_C_decarboxylation	7451	CCCCC(=O)O.O=C(O)CCCCc1nc2cocc2cc1I>>CCCCc1cc2cocc2nc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het6Het5
C_C_decarboxylation	7452	CCCCC(=O)O.O=C(O)CCCCc1c(I)ncc2ccncc12>>CCCCc1ncc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het6Het6
C_C_decarboxylation	7453	CCCCC(=O)O.O=C(O)CCCCc1c(I)ncc2ccccc12>>CCCCc1ncc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_Het6Phe
C_C_decarboxylation	7454	CCCCC(=O)O.O=C(O)CCCCc1cc2cocc2cc1I>>CCCCc1cc2cocc2cc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_PheHet5
C_C_decarboxylation	7455	CCCCC(=O)O.O=C(O)CCCCCc1c(I)ccc2ccncc12>>CCCCc1ccc2ccncc2c1CCCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Iodide_PheHet6
C_C_decarboxylation	7456	CCCCC(=O)O.O=C(O)CCCCc1cocc1OS(=O)(=O)C(F)(F)F>>CCCCc1cocc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het5
C_C_decarboxylation	7457	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCCCc1oc2cocc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het5Het5
C_C_decarboxylation	7458	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCCCc1oc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het5Het6
C_C_decarboxylation	7459	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCCCc1oc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het5Phe
C_C_decarboxylation	7460	CCCCC(=O)O.O=C(O)CCCCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCCCc1ccncc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het6
C_C_decarboxylation	7461	CCCCC(=O)O.O=C(O)CCCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCCc1cc2cocc2nc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het6Het5
C_C_decarboxylation	7462	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCCCc1ncc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het6Het6
C_C_decarboxylation	7463	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCCCc1ncc2ccccc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_Het6Phe
C_C_decarboxylation	7464	CCCCC(=O)O.O=C(O)CCCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCCCc1cc2cocc2cc1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_PheHet5
C_C_decarboxylation	7465	CCCCC(=O)O.O=C(O)CCCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCCCc1ccc2ccncc2c1CCCCC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([!$(**[C]=[C]);!$(**[C]#[C]);!$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_SaturatedAliphatic.X-Triflate_PheHet6
C_C_decarboxylation	7466	CCC=CC(=O)O.O=C(O)C=CCCc1ccccc1Br>>CCC=Cc1ccccc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Phe
C_C_decarboxylation	7467	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)ccc2ccccc12>>CCC=Cc1ccc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_PhePhe
C_C_decarboxylation	7468	CCC=CC(=O)O.O=C(O)C=CCCc1ccccc1I>>CCC=Cc1ccccc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Phe
C_C_decarboxylation	7469	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)ccc2ccccc12>>CCC=Cc1ccc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_PhePhe
C_C_decarboxylation	7470	CCC=CC(=O)O.O=C(O)C=CCCc1cccc(OS(=O)(=O)C(F)(F)F)c1>>CCC=Cc1cccc(CCC=CC(=O)O)c1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Phe
C_C_decarboxylation	7471	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>CCC=Cc1ccc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_PhePhe
C_C_decarboxylation	7472	CCC=CC(=O)O.O=C(O)C=CCCc1cocc1Br>>CCC=Cc1cocc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het5
C_C_decarboxylation	7473	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)oc2cocc12>>CCC=Cc1oc2cocc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het5Het5
C_C_decarboxylation	7474	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)oc2ccncc12>>CCC=Cc1oc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het5Het6
C_C_decarboxylation	7475	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)oc2ccccc12>>CCC=Cc1oc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het5Phe
C_C_decarboxylation	7476	CCC=CC(=O)O.O=C(O)C=CCCc1cnccc1Br>>CCC=Cc1ccncc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het6
C_C_decarboxylation	7477	CCC=CC(=O)O.O=C(O)C=CCCc1nc2cocc2cc1Br>>CCC=Cc1cc2cocc2nc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het6Het5
C_C_decarboxylation	7478	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)ncc2ccncc12>>CCC=Cc1ncc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het6Het6
C_C_decarboxylation	7479	CCC=CC(=O)O.O=C(O)C=CCCc1c(Br)ncc2ccccc12>>CCC=Cc1ncc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_Het6Phe
C_C_decarboxylation	7480	CCC=CC(=O)O.O=C(O)C=CCCc1cc2cocc2cc1Br>>CCC=Cc1cc2cocc2cc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_PheHet5
C_C_decarboxylation	7481	CCC=CC(=O)O.O=C(O)C=CCCCc1c(Br)ccc2ccncc12>>CCC=Cc1ccc2ccncc2c1CCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Bromide_PheHet6
C_C_decarboxylation	7482	CCC=CC(=O)O.O=C(O)C=CCCc1cocc1Cl>>CCC=Cc1cocc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het5
C_C_decarboxylation	7483	CCC=CC(=O)O.O=C(O)C=CCCc1c(Cl)oc2cocc12>>CCC=Cc1oc2cocc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het5Het5
C_C_decarboxylation	7484	CCC=CC(=O)O.O=C(O)C=CCCc1c(Cl)oc2ccncc12>>CCC=Cc1oc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het5Het6
C_C_decarboxylation	7485	CCC=CC(=O)O.O=C(O)C=CCCc1c(Cl)oc2ccccc12>>CCC=Cc1oc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het5Phe
C_C_decarboxylation	7486	CCC=CC(=O)O.O=C(O)C=CCCc1cnccc1Cl>>CCC=Cc1ccncc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het6
C_C_decarboxylation	7487	CCC=CC(=O)O.O=C(O)C=CCCc1nc2cocc2cc1Cl>>CCC=Cc1cc2cocc2nc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het6Het5
C_C_decarboxylation	7488	CCC=CC(=O)O.O=C(O)C=CCCc1c(Cl)ncc2ccncc12>>CCC=Cc1ncc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het6Het6
C_C_decarboxylation	7489	CCC=CC(=O)O.O=C(O)C=CCCc1c(Cl)ncc2ccccc12>>CCC=Cc1ncc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Chloride_Het6Phe
C_C_decarboxylation	7490	CCC=CC(=O)O.O=C(O)C=CCCc1cocc1I>>CCC=Cc1cocc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het5
C_C_decarboxylation	7491	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)oc2cocc12>>CCC=Cc1oc2cocc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het5Het5
C_C_decarboxylation	7492	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)oc2ccncc12>>CCC=Cc1oc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het5Het6
C_C_decarboxylation	7493	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)oc2ccccc12>>CCC=Cc1oc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het5Phe
C_C_decarboxylation	7494	CCC=CC(=O)O.O=C(O)C=CCCc1cnccc1I>>CCC=Cc1ccncc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het6
C_C_decarboxylation	7495	CCC=CC(=O)O.O=C(O)C=CCCc1nc2cocc2cc1I>>CCC=Cc1cc2cocc2nc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het6Het5
C_C_decarboxylation	7496	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)ncc2ccncc12>>CCC=Cc1ncc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het6Het6
C_C_decarboxylation	7497	CCC=CC(=O)O.O=C(O)C=CCCc1c(I)ncc2ccccc12>>CCC=Cc1ncc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_Het6Phe
C_C_decarboxylation	7498	CCC=CC(=O)O.O=C(O)C=CCCc1cc2cocc2cc1I>>CCC=Cc1cc2cocc2cc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_PheHet5
C_C_decarboxylation	7499	CCC=CC(=O)O.O=C(O)C=CCCCc1c(I)ccc2ccncc12>>CCC=Cc1ccc2ccncc2c1CCCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Iodide_PheHet6
C_C_decarboxylation	7500	CCC=CC(=O)O.O=C(O)C=CCCc1cocc1OS(=O)(=O)C(F)(F)F>>CCC=Cc1cocc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het5
C_C_decarboxylation	7501	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>CCC=Cc1oc2cocc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het5Het5
C_C_decarboxylation	7502	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>CCC=Cc1oc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het5Het6
C_C_decarboxylation	7503	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>CCC=Cc1oc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het5Phe
C_C_decarboxylation	7504	CCC=CC(=O)O.O=C(O)C=CCCc1cnccc1OS(=O)(=O)C(F)(F)F>>CCC=Cc1ccncc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het6
C_C_decarboxylation	7505	CCC=CC(=O)O.O=C(O)C=CCCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC=Cc1cc2cocc2nc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het6Het5
C_C_decarboxylation	7506	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>CCC=Cc1ncc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het6Het6
C_C_decarboxylation	7507	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>CCC=Cc1ncc2ccccc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_Het6Phe
C_C_decarboxylation	7508	CCC=CC(=O)O.O=C(O)C=CCCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>CCC=Cc1cc2cocc2cc1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_PheHet5
C_C_decarboxylation	7509	CCC=CC(=O)O.O=C(O)C=CCCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>CCC=Cc1ccc2ccncc2c1CCC=CC(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[C]=[C]),$(**[C]#[C]),$(**[C]#[N]);!$(**a)]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_UnsaturatedAliphatic.X-Triflate_PheHet6
C_C_decarboxylation	7510	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccccc1Br>>Cc1ccccc1c1ccccc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Phe
C_C_decarboxylation	7511	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_PhePhe
C_C_decarboxylation	7512	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1ccccc1I>>Cc1ccccc1c1ccccc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Phe
C_C_decarboxylation	7513	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_PhePhe
C_C_decarboxylation	7514	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1ccccc1c1cccc(Cc2ccccc2C(=O)O)c1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Phe
C_C_decarboxylation	7515	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_PhePhe
C_C_decarboxylation	7516	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cocc1Br>>Cc1ccccc1c1cocc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het5
C_C_decarboxylation	7517	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het5Het5
C_C_decarboxylation	7518	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het5Het6
C_C_decarboxylation	7519	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het5Phe
C_C_decarboxylation	7520	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnccc1Br>>Cc1ccccc1c1ccncc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het6
C_C_decarboxylation	7521	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1nc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het6Het5
C_C_decarboxylation	7522	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het6Het6
C_C_decarboxylation	7523	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Br)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_Het6Phe
C_C_decarboxylation	7524	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_PheHet5
C_C_decarboxylation	7525	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1c(Br)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Bromide_PheHet6
C_C_decarboxylation	7526	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cocc1Cl>>Cc1ccccc1c1cocc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het5
C_C_decarboxylation	7527	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Cl)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het5Het5
C_C_decarboxylation	7528	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Cl)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het5Het6
C_C_decarboxylation	7529	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Cl)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het5Phe
C_C_decarboxylation	7530	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnccc1Cl>>Cc1ccccc1c1ccncc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het6
C_C_decarboxylation	7531	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1nc2cocc2cc1Cl>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het6Het5
C_C_decarboxylation	7532	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Cl)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het6Het6
C_C_decarboxylation	7533	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(Cl)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Chloride_Het6Phe
C_C_decarboxylation	7534	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cocc1I>>Cc1ccccc1c1cocc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het5
C_C_decarboxylation	7535	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het5Het5
C_C_decarboxylation	7536	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het5Het6
C_C_decarboxylation	7537	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het5Phe
C_C_decarboxylation	7538	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnccc1I>>Cc1ccccc1c1ccncc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het6
C_C_decarboxylation	7539	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1nc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het6Het5
C_C_decarboxylation	7540	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het6Het6
C_C_decarboxylation	7541	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(I)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_Het6Phe
C_C_decarboxylation	7542	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_PheHet5
C_C_decarboxylation	7543	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1CCc1c(I)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Iodide_PheHet6
C_C_decarboxylation	7544	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1ccccc1c1cocc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het5
C_C_decarboxylation	7545	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het5Het5
C_C_decarboxylation	7546	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het5Het6
C_C_decarboxylation	7547	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het5Phe
C_C_decarboxylation	7548	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1ccccc1c1ccncc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het6
C_C_decarboxylation	7549	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het6Het5
C_C_decarboxylation	7550	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het6Het6
C_C_decarboxylation	7551	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_Het6Phe
C_C_decarboxylation	7552	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_PheHet5
C_C_decarboxylation	7553	Cc1ccccc1C(=O)O.O=C(O)c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1Cc1ccccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[c;$(c1ccccc1)]),$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Aromatic.X-Triflate_PheHet6
C_C_decarboxylation	7554	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccccc1Br>>Cc1cnccc1c1ccccc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Phe
C_C_decarboxylation	7555	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_PhePhe
C_C_decarboxylation	7556	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1ccccc1I>>Cc1cnccc1c1ccccc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Phe
C_C_decarboxylation	7557	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_PhePhe
C_C_decarboxylation	7558	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cccc(OS(=O)(=O)C(F)(F)F)c1>>Cc1cnccc1c1cccc(Cc2cnccc2C(=O)O)c1	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Phe
C_C_decarboxylation	7559	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_PhePhe
C_C_decarboxylation	7560	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cocc1Br>>Cc1cnccc1c1cocc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het5
C_C_decarboxylation	7561	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het5Het5
C_C_decarboxylation	7562	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het5Het6
C_C_decarboxylation	7563	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het5Phe
C_C_decarboxylation	7564	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnccc1Br>>Cc1cnccc1c1ccncc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het6
C_C_decarboxylation	7565	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1nc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het6Het5
C_C_decarboxylation	7566	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het6Het6
C_C_decarboxylation	7567	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_Het6Phe
C_C_decarboxylation	7568	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_PheHet5
C_C_decarboxylation	7569	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1c(Br)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Bromide_PheHet6
C_C_decarboxylation	7570	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cocc1Cl>>Cc1cnccc1c1cocc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het5
C_C_decarboxylation	7571	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Cl)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het5Het5
C_C_decarboxylation	7572	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Cl)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het5Het6
C_C_decarboxylation	7573	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Cl)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het5Phe
C_C_decarboxylation	7574	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnccc1Cl>>Cc1cnccc1c1ccncc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het6
C_C_decarboxylation	7575	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1nc2cocc2cc1Cl>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het6Het5
C_C_decarboxylation	7576	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Cl)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het6Het6
C_C_decarboxylation	7577	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(Cl)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Chloride_Het6Phe
C_C_decarboxylation	7578	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cocc1I>>Cc1cnccc1c1cocc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het5
C_C_decarboxylation	7579	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het5Het5
C_C_decarboxylation	7580	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het5Het6
C_C_decarboxylation	7581	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het5Phe
C_C_decarboxylation	7582	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het6
C_C_decarboxylation	7583	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1nc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het6Het5
C_C_decarboxylation	7584	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het6Het6
C_C_decarboxylation	7585	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(I)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_Het6Phe
C_C_decarboxylation	7586	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_PheHet5
C_C_decarboxylation	7587	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1CCc1c(I)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Iodide_PheHet6
C_C_decarboxylation	7588	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het5
C_C_decarboxylation	7589	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het5Het5
C_C_decarboxylation	7590	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het5Het6
C_C_decarboxylation	7591	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het5Phe
C_C_decarboxylation	7592	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het6
C_C_decarboxylation	7593	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het6Het5
C_C_decarboxylation	7594	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het6Het6
C_C_decarboxylation	7595	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_Het6Phe
C_C_decarboxylation	7596	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_PheHet5
C_C_decarboxylation	7597	Cc1cnccc1C(=O)O.O=C(O)c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1Cc1cnccc1C(=O)O	[O;D1;$(O[C;D2,D3;$(C(=O));!$(C(O)(=O)[!#6])]);$([$(**[a;$(a1aaaaa1)]),$(**[a;$(a1aaaa1)]);!$(**[c;$(c1ccccc1)]);!$(**[c;$(c1cccc1)])]):1]C(=O)[*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[*:2][a:4]	Acid_Heteroaromatic.X-Triflate_PheHet6
ester_sulfonic_schotten_baumann	7598	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCCCCO>>CCCS(=O)(=O)OCCCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7599	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCc1ccccc1CO>>CCCS(=O)(=O)OCc1ccccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7600	CCCS(=O)(=O)Br.CCC(O)CCCCCCS(=O)(=O)Br>>CCCS(=O)(=O)OC(CC)CCCCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7601	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCS(=O)(=O)OC1C2CCCCC2C2CCC(CCCS(=O)(=O)Br)CC21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7602	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCc1ccccc1C(O)c1ccccc1>>CCCS(=O)(=O)OC(c1ccccc1)c1ccccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7603	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCS(=O)(=O)OC1c2ccccc2c2ccc(CCCS(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7604	CCCS(=O)(=O)Br.CCCC(O)c1ccccc1CCCCS(=O)(=O)Br>>CCCC(OS(=O)(=O)CCC)c1ccccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7605	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCS(=O)(=O)OC1c2cc(CCCS(=O)(=O)Br)ccc2C2CCCCC21	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7606	CCCS(=O)(=O)Br.CC(CCCS(=O)(=O)Br)CC(C)(C)O>>CCCS(=O)(=O)OC(C)(C)CC(C)CCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7607	CCCS(=O)(=O)Br.CC1(O)CCCC(CCCS(=O)(=O)Br)C1>>CCCS(=O)(=O)OC1(C)CCCC(CCCS(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7608	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCc1ccccc1O>>CCCS(=O)(=O)Oc1ccccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.Phenol
ester_sulfonic_schotten_baumann	7609	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCc1ccoc1O>>CCCS(=O)(=O)Oc1occc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7610	CCCS(=O)(=O)Br.O=S(=O)(Br)CCCCc1cccnc1O>>CCCS(=O)(=O)Oc1ncccc1CCCCS(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aliphatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7611	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCCCCO>>CCCS(=O)(=O)OCCCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7612	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCc1ccccc1CO>>CCCS(=O)(=O)OCc1ccccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7613	CCCS(=O)(=O)Cl.CCC(O)CCCCCCS(=O)(=O)Cl>>CCCS(=O)(=O)OC(CC)CCCCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7614	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCS(=O)(=O)OC1C2CCCCC2C2CCC(CCCS(=O)(=O)Cl)CC21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7615	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCc1ccccc1C(O)c1ccccc1>>CCCS(=O)(=O)OC(c1ccccc1)c1ccccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7616	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCS(=O)(=O)OC1c2ccccc2c2ccc(CCCS(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7617	CCCS(=O)(=O)Cl.CCCC(O)c1ccccc1CCCCS(=O)(=O)Cl>>CCCC(OS(=O)(=O)CCC)c1ccccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7618	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCS(=O)(=O)OC1c2cc(CCCS(=O)(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7619	CCCS(=O)(=O)Cl.CC(CCCS(=O)(=O)Cl)CC(C)(C)O>>CCCS(=O)(=O)OC(C)(C)CC(C)CCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7620	CCCS(=O)(=O)Cl.CC1(O)CCCC(CCCS(=O)(=O)Cl)C1>>CCCS(=O)(=O)OC1(C)CCCC(CCCS(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7621	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCc1ccccc1O>>CCCS(=O)(=O)Oc1ccccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.Phenol
ester_sulfonic_schotten_baumann	7622	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCc1ccoc1O>>CCCS(=O)(=O)Oc1occc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7623	CCCS(=O)(=O)Cl.O=S(=O)(Cl)CCCCc1cccnc1O>>CCCS(=O)(=O)Oc1ncccc1CCCCS(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aliphatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7624	CCCS(=O)(=O)F.O=S(=O)(F)CCCCCCCO>>CCCS(=O)(=O)OCCCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7625	CCCS(=O)(=O)F.O=S(=O)(F)CCCCc1ccccc1CO>>CCCS(=O)(=O)OCc1ccccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7626	CCCS(=O)(=O)F.CCC(O)CCCCCCS(=O)(=O)F>>CCCS(=O)(=O)OC(CC)CCCCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7627	CCCS(=O)(=O)F.O=S(=O)(F)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCS(=O)(=O)OC1C2CCCCC2C2CCC(CCCS(=O)(=O)F)CC21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7628	CCCS(=O)(=O)F.O=S(=O)(F)CCCCc1ccccc1C(O)c1ccccc1>>CCCS(=O)(=O)OC(c1ccccc1)c1ccccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7629	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCS(=O)(=O)OC1c2ccccc2c2ccc(CCCS(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7630	CCCS(=O)(=O)F.CCCC(O)c1ccccc1CCCCS(=O)(=O)F>>CCCC(OS(=O)(=O)CCC)c1ccccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7631	CCCS(=O)(=O)F.O=S(=O)(F)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCS(=O)(=O)OC1c2cc(CCCS(=O)(=O)F)ccc2C2CCCCC21	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7632	CCCS(=O)(=O)F.CC(CCCS(=O)(=O)F)CC(C)(C)O>>CCCS(=O)(=O)OC(C)(C)CC(C)CCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7633	CCCS(=O)(=O)F.CC1(O)CCCC(CCCS(=O)(=O)F)C1>>CCCS(=O)(=O)OC1(C)CCCC(CCCS(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7634	CCCS(=O)(=O)F.O=S(=O)(F)CCCCc1ccccc1O>>CCCS(=O)(=O)Oc1ccccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.Phenol
ester_sulfonic_schotten_baumann	7635	CCCS(=O)(=O)F.O=S(=O)(F)CCCCc1ccoc1O>>CCCS(=O)(=O)Oc1occc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7636	CCCS(=O)(=O)F.O=S(=O)(F)CCCCc1cccnc1O>>CCCS(=O)(=O)Oc1ncccc1CCCCS(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aliphatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7637	CCCS(=O)(=O)I.O=S(=O)(I)CCCCCCCO>>CCCS(=O)(=O)OCCCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7638	CCCS(=O)(=O)I.O=S(=O)(I)CCCCc1ccccc1CO>>CCCS(=O)(=O)OCc1ccccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7639	CCCS(=O)(=O)I.CCC(O)CCCCCCS(=O)(=O)I>>CCCS(=O)(=O)OC(CC)CCCCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7640	CCCS(=O)(=O)I.O=S(=O)(I)CCCC1CCC2C(C1)C(O)C1CCCCC12>>CCCS(=O)(=O)OC1C2CCCCC2C2CCC(CCCS(=O)(=O)I)CC21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7641	CCCS(=O)(=O)I.O=S(=O)(I)CCCCc1ccccc1C(O)c1ccccc1>>CCCS(=O)(=O)OC(c1ccccc1)c1ccccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7642	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1ccc2c(c1)C(O)c1ccccc1-2>>CCCS(=O)(=O)OC1c2ccccc2c2ccc(CCCS(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7643	CCCS(=O)(=O)I.CCCC(O)c1ccccc1CCCCS(=O)(=O)I>>CCCC(OS(=O)(=O)CCC)c1ccccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7644	CCCS(=O)(=O)I.O=S(=O)(I)CCCc1ccc2c(c1)C(O)C1CCCCC21>>CCCS(=O)(=O)OC1c2cc(CCCS(=O)(=O)I)ccc2C2CCCCC21	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7645	CCCS(=O)(=O)I.CC(CCCS(=O)(=O)I)CC(C)(C)O>>CCCS(=O)(=O)OC(C)(C)CC(C)CCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7646	CCCS(=O)(=O)I.CC1(O)CCCC(CCCS(=O)(=O)I)C1>>CCCS(=O)(=O)OC1(C)CCCC(CCCS(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7647	CCCS(=O)(=O)I.O=S(=O)(I)CCCCc1ccccc1O>>CCCS(=O)(=O)Oc1ccccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.Phenol
ester_sulfonic_schotten_baumann	7648	CCCS(=O)(=O)I.O=S(=O)(I)CCCCc1ccoc1O>>CCCS(=O)(=O)Oc1occc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7649	CCCS(=O)(=O)I.O=S(=O)(I)CCCCc1cccnc1O>>CCCS(=O)(=O)Oc1ncccc1CCCCS(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([!$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aliphatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7650	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCCCCO)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OCCCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7651	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCc1ccccc1CO)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OCc1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7652	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OC(CC)CCCCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7653	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCC1CCC2C(C1)C(O)C1CCCCC12)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OC1C2CCCCC2C2CCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7654	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCc1ccccc1C(O)c1ccccc1)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OC(c1ccccc1)c1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7655	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1ccc2c(c1)C(O)c1ccccc1-2)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OC1c2ccccc2c2ccc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7656	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCC(OS(=O)(=O)CCC)c1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7657	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCc1ccc2c(c1)C(O)C1CCCCC21)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)OC1c2cc(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7658	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.CC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CCCS(=O)(=O)OC(C)(C)CC(C)CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7659	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C1>>CCCS(=O)(=O)OC1(C)CCCC(CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7660	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCc1ccccc1O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)Oc1ccccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.Phenol
ester_sulfonic_schotten_baumann	7661	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCc1ccoc1O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)Oc1occc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7662	CCCS(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(CCCCc1cccnc1O)OS(=O)(=O)C(F)(F)F>>CCCS(=O)(=O)Oc1ncccc1CCCCS(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(#,=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([!$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aliphatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7663	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCCCCO>>CCc1ccccc1S(=O)(=O)OCCCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7664	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCc1ccccc1CO>>CCc1ccccc1S(=O)(=O)OCc1ccccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7665	CCc1ccccc1S(=O)(=O)Br.CCC(O)CCCCCc1ccccc1S(=O)(=O)Br>>CCc1ccccc1S(=O)(=O)OC(CC)CCCCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7666	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1S(=O)(=O)OC1C2CCCCC2C2CCC(CCc3ccccc3S(=O)(=O)Br)CC21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7667	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1S(=O)(=O)OC(c1ccccc1)c1ccccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7668	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1S(=O)(=O)OC1c2ccccc2c2ccc(CCc3ccccc3S(=O)(=O)Br)cc21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7669	CCc1ccccc1S(=O)(=O)Br.CCCC(O)c1ccccc1CCCc1ccccc1S(=O)(=O)Br>>CCCC(OS(=O)(=O)c1ccccc1CC)c1ccccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7670	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1S(=O)(=O)OC1c2cc(CCc3ccccc3S(=O)(=O)Br)ccc2C2CCCCC21	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7671	CCc1ccccc1S(=O)(=O)Br.CC(CCc1ccccc1S(=O)(=O)Br)CC(C)(C)O>>CCc1ccccc1S(=O)(=O)OC(C)(C)CC(C)CCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7672	CCc1ccccc1S(=O)(=O)Br.CC1(O)CCCC(CCc2ccccc2S(=O)(=O)Br)C1>>CCc1ccccc1S(=O)(=O)OC1(C)CCCC(CCc2ccccc2S(=O)(=O)Br)C1	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7673	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCc1ccccc1O>>CCc1ccccc1S(=O)(=O)Oc1ccccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.Phenol
ester_sulfonic_schotten_baumann	7674	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCc1ccoc1O>>CCc1ccccc1S(=O)(=O)Oc1occc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7675	CCc1ccccc1S(=O)(=O)Br.O=S(=O)(Br)c1ccccc1CCCc1cccnc1O>>CCc1ccccc1S(=O)(=O)Oc1ncccc1CCCc1ccccc1S(=O)(=O)Br	[Br;$([Br][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Bromide_Aromatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7676	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCCCCO>>CCc1ccccc1S(=O)(=O)OCCCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7677	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCc1ccccc1CO>>CCc1ccccc1S(=O)(=O)OCc1ccccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7678	CCc1ccccc1S(=O)(=O)Cl.CCC(O)CCCCCc1ccccc1S(=O)(=O)Cl>>CCc1ccccc1S(=O)(=O)OC(CC)CCCCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7679	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1S(=O)(=O)OC1C2CCCCC2C2CCC(CCc3ccccc3S(=O)(=O)Cl)CC21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7680	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1S(=O)(=O)OC(c1ccccc1)c1ccccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7681	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1S(=O)(=O)OC1c2ccccc2c2ccc(CCc3ccccc3S(=O)(=O)Cl)cc21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7682	CCc1ccccc1S(=O)(=O)Cl.CCCC(O)c1ccccc1CCCc1ccccc1S(=O)(=O)Cl>>CCCC(OS(=O)(=O)c1ccccc1CC)c1ccccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7683	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1S(=O)(=O)OC1c2cc(CCc3ccccc3S(=O)(=O)Cl)ccc2C2CCCCC21	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7684	CCc1ccccc1S(=O)(=O)Cl.CC(CCc1ccccc1S(=O)(=O)Cl)CC(C)(C)O>>CCc1ccccc1S(=O)(=O)OC(C)(C)CC(C)CCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7685	CCc1ccccc1S(=O)(=O)Cl.CC1(O)CCCC(CCc2ccccc2S(=O)(=O)Cl)C1>>CCc1ccccc1S(=O)(=O)OC1(C)CCCC(CCc2ccccc2S(=O)(=O)Cl)C1	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7686	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCc1ccccc1O>>CCc1ccccc1S(=O)(=O)Oc1ccccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.Phenol
ester_sulfonic_schotten_baumann	7687	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCc1ccoc1O>>CCc1ccccc1S(=O)(=O)Oc1occc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7688	CCc1ccccc1S(=O)(=O)Cl.O=S(=O)(Cl)c1ccccc1CCCc1cccnc1O>>CCc1ccccc1S(=O)(=O)Oc1ncccc1CCCc1ccccc1S(=O)(=O)Cl	[Cl;$([Cl][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Chloride_Aromatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7689	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCCCCO>>CCc1ccccc1S(=O)(=O)OCCCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7690	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCc1ccccc1CO>>CCc1ccccc1S(=O)(=O)OCc1ccccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7691	CCc1ccccc1S(=O)(=O)F.CCC(O)CCCCCc1ccccc1S(=O)(=O)F>>CCc1ccccc1S(=O)(=O)OC(CC)CCCCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7692	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1S(=O)(=O)OC1C2CCCCC2C2CCC(CCc3ccccc3S(=O)(=O)F)CC21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7693	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1S(=O)(=O)OC(c1ccccc1)c1ccccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7694	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1S(=O)(=O)OC1c2ccccc2c2ccc(CCc3ccccc3S(=O)(=O)F)cc21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7695	CCc1ccccc1S(=O)(=O)F.CCCC(O)c1ccccc1CCCc1ccccc1S(=O)(=O)F>>CCCC(OS(=O)(=O)c1ccccc1CC)c1ccccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7696	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1S(=O)(=O)OC1c2cc(CCc3ccccc3S(=O)(=O)F)ccc2C2CCCCC21	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7697	CCc1ccccc1S(=O)(=O)F.CC(CCc1ccccc1S(=O)(=O)F)CC(C)(C)O>>CCc1ccccc1S(=O)(=O)OC(C)(C)CC(C)CCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7698	CCc1ccccc1S(=O)(=O)F.CC1(O)CCCC(CCc2ccccc2S(=O)(=O)F)C1>>CCc1ccccc1S(=O)(=O)OC1(C)CCCC(CCc2ccccc2S(=O)(=O)F)C1	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7699	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCc1ccccc1O>>CCc1ccccc1S(=O)(=O)Oc1ccccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.Phenol
ester_sulfonic_schotten_baumann	7700	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCc1ccoc1O>>CCc1ccccc1S(=O)(=O)Oc1occc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7701	CCc1ccccc1S(=O)(=O)F.O=S(=O)(F)c1ccccc1CCCc1cccnc1O>>CCc1ccccc1S(=O)(=O)Oc1ncccc1CCCc1ccccc1S(=O)(=O)F	[F;$([F][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Fluoride_Aromatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7702	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCCCCO>>CCc1ccccc1S(=O)(=O)OCCCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7703	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCc1ccccc1CO>>CCc1ccccc1S(=O)(=O)OCc1ccccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7704	CCc1ccccc1S(=O)(=O)I.CCC(O)CCCCCc1ccccc1S(=O)(=O)I>>CCc1ccccc1S(=O)(=O)OC(CC)CCCCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7705	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1S(=O)(=O)OC1C2CCCCC2C2CCC(CCc3ccccc3S(=O)(=O)I)CC21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7706	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1S(=O)(=O)OC(c1ccccc1)c1ccccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7707	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1S(=O)(=O)OC1c2ccccc2c2ccc(CCc3ccccc3S(=O)(=O)I)cc21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7708	CCc1ccccc1S(=O)(=O)I.CCCC(O)c1ccccc1CCCc1ccccc1S(=O)(=O)I>>CCCC(OS(=O)(=O)c1ccccc1CC)c1ccccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7709	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1S(=O)(=O)OC1c2cc(CCc3ccccc3S(=O)(=O)I)ccc2C2CCCCC21	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7710	CCc1ccccc1S(=O)(=O)I.CC(CCc1ccccc1S(=O)(=O)I)CC(C)(C)O>>CCc1ccccc1S(=O)(=O)OC(C)(C)CC(C)CCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7711	CCc1ccccc1S(=O)(=O)I.CC1(O)CCCC(CCc2ccccc2S(=O)(=O)I)C1>>CCc1ccccc1S(=O)(=O)OC1(C)CCCC(CCc2ccccc2S(=O)(=O)I)C1	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7712	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCc1ccccc1O>>CCc1ccccc1S(=O)(=O)Oc1ccccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.Phenol
ester_sulfonic_schotten_baumann	7713	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCc1ccoc1O>>CCc1ccccc1S(=O)(=O)Oc1occc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7714	CCc1ccccc1S(=O)(=O)I.O=S(=O)(I)c1ccccc1CCCc1cccnc1O>>CCc1ccccc1S(=O)(=O)Oc1ncccc1CCCc1ccccc1S(=O)(=O)I	[I;$([I][S;D4](=O)(=O));$([$(**a)]):1][*:2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Iodide_Aromatic.PhenolHeteroaromatic6membered
ester_sulfonic_schotten_baumann	7715	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCCCCO>>CCc1ccccc1S(=O)(=O)OCCCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.PrimaryAlcoholAliphatic
ester_sulfonic_schotten_baumann	7716	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCc1ccccc1CO>>CCc1ccccc1S(=O)(=O)OCc1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;D2][a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.PrimaryAlcoholAromatic
ester_sulfonic_schotten_baumann	7717	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.CCC(O)CCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCc1ccccc1S(=O)(=O)OC(CC)CCCCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholAliphaticAcyclic
ester_sulfonic_schotten_baumann	7718	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1S(=O)(=O)OC1C2CCCCC2C2CCC(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)CC21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholAliphaticCyclic
ester_sulfonic_schotten_baumann	7719	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1S(=O)(=O)OC(c1ccccc1)c1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholAromaticAcyclic
ester_sulfonic_schotten_baumann	7720	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1S(=O)(=O)OC1c2ccccc2c2ccc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)cc21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholAromaticCyclic
ester_sulfonic_schotten_baumann	7721	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.CCCC(O)c1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F>>CCCC(OS(=O)(=O)c1ccccc1CC)c1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholMixAcyclic
ester_sulfonic_schotten_baumann	7722	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1S(=O)(=O)OC1c2cc(CCc3ccccc3S(=O)(=O)OS(=O)(=O)C(F)(F)F)ccc2C2CCCCC21	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.SecondaryAlcoholMixCyclic
ester_sulfonic_schotten_baumann	7723	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.CC(CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F)CC(C)(C)O>>CCc1ccccc1S(=O)(=O)OC(C)(C)CC(C)CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.TertiaryAlcoholAcyclic
ester_sulfonic_schotten_baumann	7724	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.CC1(O)CCCC(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C1>>CCc1ccccc1S(=O)(=O)OC1(C)CCCC(CCc2ccccc2S(=O)(=O)OS(=O)(=O)C(F)(F)F)C1	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.TertiaryAlcoholCyclic
ester_sulfonic_schotten_baumann	7725	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCc1ccccc1O>>CCc1ccccc1S(=O)(=O)Oc1ccccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.Phenol
ester_sulfonic_schotten_baumann	7726	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCc1ccoc1O>>CCc1ccccc1S(=O)(=O)Oc1occc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.PhenolHeteroaromatic5membered
ester_sulfonic_schotten_baumann	7727	CCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F.O=S(=O)(OS(=O)(=O)C(F)(F)F)c1ccccc1CCCc1cccnc1O>>CCc1ccccc1S(=O)(=O)Oc1ncccc1CCCc1ccccc1S(=O)(=O)OS(=O)(=O)C(F)(F)F	[O;$(O(S(=O)(=O)C(F)(F)F)S(=O)(=O));$([O;$(OS(=O)(=O)C(F)(F)F);!$(OC(=*));!$(O[C;D2][C;D3](=[O,S]));!$(O[S;D3](=O));!$(O[S;D4](=N)(=O))][S;D4](=O)(=O));$([$(**a)]):1][*;!$(S(=O)(=O)C(F)(F)F):2].[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):3][#6:4]>>[*:2]O[#6:4]	Sulfonyl-Triflate_Aromatic.PhenolHeteroaromatic6membered
mitsunobu	7728	CCc1ccccc1O.OCCCCCCc1ccccc1O>>CCc1ccccc1OCCCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.PrimaryAlcoholAliphatic
mitsunobu	7729	CCc1ccccc1O.OCc1ccccc1CCCc1ccccc1O>>CCc1ccccc1OCc1ccccc1CCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.PrimaryAlcoholAromatic
mitsunobu	7730	CCc1ccccc1O.CCC(O)CCCCCc1ccccc1O>>CCc1ccccc1OC(CC)CCCCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7731	CCc1ccccc1O.Oc1ccccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccccc1OC1C2CCCCC2C2CCC(CCc3ccccc3O)CC21	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholAliphaticCyclic
mitsunobu	7732	CCc1ccccc1O.Oc1ccccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccccc1OC(c1ccccc1)c1ccccc1CCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholAromaticAcyclic
mitsunobu	7733	CCc1ccccc1O.Oc1ccccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccccc1OC1c2ccccc2-c2ccc(CCc3ccccc3O)cc21	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholAromaticCyclic
mitsunobu	7734	CCc1ccccc1O.CCCC(O)c1ccccc1CCCc1ccccc1O>>CCCC(Oc1ccccc1CC)c1ccccc1CCCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholMixAcyclic
mitsunobu	7735	CCc1ccccc1O.Oc1ccccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccccc1OC1c2cc(CCc3ccccc3O)ccc2C2CCCCC21	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.SecondaryAlcoholMixCyclic
mitsunobu	7736	CCc1ccccc1O.CC(CCc1ccccc1O)CC(C)(C)O>>CCc1ccccc1OC(C)(C)CC(C)CCc1ccccc1O	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.TertiaryAlcoholAcyclic
mitsunobu	7737	CCc1ccccc1O.CC1(O)CCCC(CCc2ccccc2O)C1>>CCc1ccccc1OC1(C)CCCC(CCc2ccccc2O)C1	[O;H1;D1;$(Oc1ccccc1),$(Oc1cccc1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	Phenol.TertiaryAlcoholCyclic
mitsunobu	7738	CCc1ccoc1O.OCCCCCCc1ccoc1O>>CCc1ccoc1OCCCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.PrimaryAlcoholAliphatic
mitsunobu	7739	CCc1ccoc1O.OCc1ccccc1CCCc1ccoc1O>>CCc1ccoc1OCc1ccccc1CCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.PrimaryAlcoholAromatic
mitsunobu	7740	CCc1ccoc1O.CCC(O)CCCCCc1ccoc1O>>CCc1ccoc1OC(CC)CCCCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7741	CCc1ccoc1O.Oc1occc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1ccoc1OC1C2CCCCC2C2CCC(CCc3ccoc3O)CC21	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholAliphaticCyclic
mitsunobu	7742	CCc1ccoc1O.Oc1occc1CCCc1ccccc1C(O)c1ccccc1>>CCc1ccoc1OC(c1ccccc1)c1ccccc1CCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholAromaticAcyclic
mitsunobu	7743	CCc1ccoc1O.Oc1occc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1ccoc1OC1c2ccccc2-c2ccc(CCc3ccoc3O)cc21	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholAromaticCyclic
mitsunobu	7744	CCc1ccoc1O.CCCC(O)c1ccccc1CCCc1ccoc1O>>CCCC(Oc1occc1CC)c1ccccc1CCCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholMixAcyclic
mitsunobu	7745	CCc1ccoc1O.Oc1occc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1ccoc1OC1c2cc(CCc3ccoc3O)ccc2C2CCCCC21	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.SecondaryAlcoholMixCyclic
mitsunobu	7746	CCc1ccoc1O.CC(CCc1ccoc1O)CC(C)(C)O>>CCc1ccoc1OC(C)(C)CC(C)CCc1ccoc1O	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.TertiaryAlcoholAcyclic
mitsunobu	7747	CCc1ccoc1O.CC1(O)CCCC(CCc2ccoc2O)C1>>CCc1ccoc1OC1(C)CCCC(CCc2ccoc2O)C1	[O;H1;D1;!$(Oc1cccc1);$(Oc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic5membered.TertiaryAlcoholCyclic
mitsunobu	7748	CCc1cccnc1O.OCCCCCCc1cccnc1O>>CCc1cccnc1OCCCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.PrimaryAlcoholAliphatic
mitsunobu	7749	CCc1cccnc1O.OCc1ccccc1CCCc1cccnc1O>>CCc1cccnc1OCc1ccccc1CCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.PrimaryAlcoholAromatic
mitsunobu	7750	CCc1cccnc1O.CCC(O)CCCCCc1cccnc1O>>CCc1cccnc1OC(CC)CCCCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7751	CCc1cccnc1O.Oc1ncccc1CCC1CCC2C(C1)C(O)C1CCCCC12>>CCc1cccnc1OC1C2CCCCC2C2CCC(CCc3cccnc3O)CC21	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholAliphaticCyclic
mitsunobu	7752	CCc1cccnc1O.Oc1ncccc1CCCc1ccccc1C(O)c1ccccc1>>CCc1cccnc1OC(c1ccccc1)c1ccccc1CCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholAromaticAcyclic
mitsunobu	7753	CCc1cccnc1O.Oc1ncccc1CCc1ccc2c(c1)C(O)c1ccccc1-2>>CCc1cccnc1OC1c2ccccc2-c2ccc(CCc3cccnc3O)cc21	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholAromaticCyclic
mitsunobu	7754	CCc1cccnc1O.CCCC(O)c1ccccc1CCCc1cccnc1O>>CCCC(Oc1ncccc1CC)c1ccccc1CCCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholMixAcyclic
mitsunobu	7755	CCc1cccnc1O.Oc1ncccc1CCc1ccc2c(c1)C(O)C1CCCCC21>>CCc1cccnc1OC1c2cc(CCc3cccnc3O)ccc2C2CCCCC21	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.SecondaryAlcoholMixCyclic
mitsunobu	7756	CCc1cccnc1O.CC(CCc1cccnc1O)CC(C)(C)O>>CCc1cccnc1OC(C)(C)CC(C)CCc1cccnc1O	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.TertiaryAlcoholAcyclic
mitsunobu	7757	CCc1cccnc1O.CC1(O)CCCC(CCc2cccnc2O)C1>>CCc1cccnc1OC1(C)CCCC(CCc2cccnc2O)C1	[O;H1;D1;!$(Oc1ccccc1);$(Oc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]O[#6@@:4]	PhenolHeteroaromatic6membered.TertiaryAlcoholCyclic
mitsunobu	7758	CCc1ccccc1S.OCCCCCCc1ccccc1S>>CCc1ccccc1SCCCCCCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.PrimaryAlcoholAliphatic
mitsunobu	7759	CCc1ccccc1S.OCc1ccccc1CCCc1ccccc1S>>CCc1ccccc1SCc1ccccc1CCCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.PrimaryAlcoholAromatic
mitsunobu	7760	CCc1ccccc1S.CCC(O)CCCCCc1ccccc1S>>CCc1ccccc1SC(CC)CCCCCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7761	CCc1ccccc1S.OC1C2CCCCC2C2CCC(CCc3ccccc3S)CC12>>CCc1ccccc1SC1C2CCCCC2C2CCC(CCc3ccccc3S)CC21	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholAliphaticCyclic
mitsunobu	7762	CCc1ccccc1S.OC(c1ccccc1)c1ccccc1CCCc1ccccc1S>>CCc1ccccc1SC(c1ccccc1)c1ccccc1CCCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholAromaticAcyclic
mitsunobu	7763	CCc1ccccc1S.OC1c2ccccc2-c2ccc(CCc3ccccc3S)cc21>>CCc1ccccc1SC1c2ccccc2-c2ccc(CCc3ccccc3S)cc21	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholAromaticCyclic
mitsunobu	7764	CCc1ccccc1S.CCCC(O)c1ccccc1CCCc1ccccc1S>>CCCC(Sc1ccccc1CC)c1ccccc1CCCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholMixAcyclic
mitsunobu	7765	CCc1ccccc1S.OC1c2cc(CCc3ccccc3S)ccc2C2CCCCC12>>CCc1ccccc1SC1c2cc(CCc3ccccc3S)ccc2C2CCCCC21	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.SecondaryAlcoholMixCyclic
mitsunobu	7766	CCc1ccccc1S.CC(CCc1ccccc1S)CC(C)(C)O>>CCc1ccccc1SC(C)(C)CC(C)CCc1ccccc1S	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.TertiaryAlcoholAcyclic
mitsunobu	7767	CCc1ccccc1S.CC1(O)CCCC(CCc2ccccc2S)C1>>CCc1ccccc1SC1(C)CCCC(CCc2ccccc2S)C1	[S;H1;D1;$(Sc1ccccc1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	Thiophenol.TertiaryAlcoholCyclic
mitsunobu	7768	CCc1ccoc1S.OCCCCCCc1ccoc1S>>CCc1ccoc1SCCCCCCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.PrimaryAlcoholAliphatic
mitsunobu	7769	CCc1ccoc1S.OCc1ccccc1CCCc1ccoc1S>>CCc1ccoc1SCc1ccccc1CCCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.PrimaryAlcoholAromatic
mitsunobu	7770	CCc1ccoc1S.CCC(O)CCCCCc1ccoc1S>>CCc1ccoc1SC(CC)CCCCCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7771	CCc1ccoc1S.OC1C2CCCCC2C2CCC(CCc3ccoc3S)CC12>>CCc1ccoc1SC1C2CCCCC2C2CCC(CCc3ccoc3S)CC21	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholAliphaticCyclic
mitsunobu	7772	CCc1ccoc1S.OC(c1ccccc1)c1ccccc1CCCc1ccoc1S>>CCc1ccoc1SC(c1ccccc1)c1ccccc1CCCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholAromaticAcyclic
mitsunobu	7773	CCc1ccoc1S.OC1c2ccccc2-c2ccc(CCc3ccoc3S)cc21>>CCc1ccoc1SC1c2ccccc2-c2ccc(CCc3ccoc3S)cc21	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholAromaticCyclic
mitsunobu	7774	CCc1ccoc1S.CCCC(O)c1ccccc1CCCc1ccoc1S>>CCCC(Sc1occc1CC)c1ccccc1CCCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholMixAcyclic
mitsunobu	7775	CCc1ccoc1S.OC1c2cc(CCc3ccoc3S)ccc2C2CCCCC12>>CCc1ccoc1SC1c2cc(CCc3ccoc3S)ccc2C2CCCCC21	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.SecondaryAlcoholMixCyclic
mitsunobu	7776	CCc1ccoc1S.CC(CCc1ccoc1S)CC(C)(C)O>>CCc1ccoc1SC(C)(C)CC(C)CCc1ccoc1S	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.TertiaryAlcoholAcyclic
mitsunobu	7777	CCc1ccoc1S.CC1(O)CCCC(CCc2ccoc2S)C1>>CCc1ccoc1SC1(C)CCCC(CCc2ccoc2S)C1	[S;H1;D1;!$(Sc1cccc1);$(Sc1aaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic5membered.TertiaryAlcoholCyclic
mitsunobu	7778	CCc1cccnc1S.OCCCCCCc1cccnc1S>>CCc1cccnc1SCCCCCCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;D2,D1;!$(C[a])]);!$(OC=*);!$(OC#*):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.PrimaryAlcoholAliphatic
mitsunobu	7779	CCc1cccnc1S.OCc1ccccc1CCCc1cccnc1S>>CCc1cccnc1SCc1ccccc1CCCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;D2][a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.PrimaryAlcoholAromatic
mitsunobu	7780	CCc1cccnc1S.CCC(O)CCCCCc1cccnc1S>>CCc1cccnc1SC(CC)CCCCCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholAliphaticAcyclic
mitsunobu	7781	CCc1cccnc1S.OC1C2CCCCC2C2CCC(CCc3cccnc3S)CC12>>CCc1cccnc1SC1C2CCCCC2C2CCC(CCc3cccnc3S)CC21	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([A])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholAliphaticCyclic
mitsunobu	7782	CCc1cccnc1S.OC(c1ccccc1)c1ccccc1CCCc1cccnc1S>>CCc1cccnc1SC(c1ccccc1)c1ccccc1CCCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholAromaticAcyclic
mitsunobu	7783	CCc1cccnc1S.OC1c2ccccc2-c2ccc(CCc3cccnc3S)cc21>>CCc1cccnc1SC1c2ccccc2-c2ccc(CCc3cccnc3S)cc21	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[a]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholAromaticCyclic
mitsunobu	7784	CCc1cccnc1S.CCCC(O)c1ccccc1CCCc1cccnc1S>>CCCC(Sc1ncccc1CC)c1ccccc1CCCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholMixAcyclic
mitsunobu	7785	CCc1cccnc1S.OC1c2cc(CCc3cccnc3S)ccc2C2CCCCC12>>CCc1cccnc1SC1c2cc(CCc3cccnc3S)ccc2C2CCCCC21	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D3]([a])[A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.SecondaryAlcoholMixCyclic
mitsunobu	7786	CCc1cccnc1S.CC(CCc1cccnc1S)CC(C)(C)O>>CCc1cccnc1SC(C)(C)CC(C)CCc1cccnc1S	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;!R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.TertiaryAlcoholAcyclic
mitsunobu	7787	CCc1cccnc1S.CC1(O)CCCC(CCc2cccnc2S)C1>>CCc1cccnc1SC1(C)CCCC(CCc2cccnc2S)C1	[S;H1;D1;!$(Sc1ccccc1);$(Sc1aaaaa1):1][#6:2].[O;H1;D1;$(O[C;R;D4]([a,A])([a,A])[a,A]):3][#6@:4]>>[#6:2]S[#6@@:4]	ThiophenolHeteroaromatic6membered.TertiaryAlcoholCyclic
negishi_batch	7788	Cc1ccccc1Br.[Zn]Cc1ccccc1Br>>Cc1ccccc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Phe.Metals
negishi_batch	7789	Cc1c(Br)ccc2ccccc12.[Zn]Cc1c(Br)ccc2ccccc12>>Cc1c(Cc2c(Br)ccc3ccccc23)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_PhePhe.Metals
negishi_batch	7790	Cc1ccccc1I.[Zn]Cc1ccccc1I>>Cc1ccccc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Phe.Metals
negishi_batch	7791	Cc1c(I)ccc2ccccc12.[Zn]Cc1c(I)ccc2ccccc12>>Cc1c(Cc2c(I)ccc3ccccc23)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_PhePhe.Metals
negishi_batch	7792	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(C[Zn])c1)C(F)(F)F>>Cc1cccc(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Phe.Metals
negishi_batch	7793	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_PhePhe.Metals
negishi_batch	7794	Cc1cocc1Br.[Zn]Cc1cocc1Br>>Cc1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het5.Metals
negishi_batch	7795	Cc1c(Br)oc2cocc12.[Zn]Cc1c(Br)oc2cocc12>>Cc1c(Cc2c(Br)oc3cocc23)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het5Het5.Metals
negishi_batch	7796	Cc1c(Br)oc2ccncc12.[Zn]Cc1c(Br)oc2ccncc12>>Cc1c(Cc2c(Br)oc3ccncc23)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het5Het6.Metals
negishi_batch	7797	Cc1c(Br)oc2ccccc12.[Zn]Cc1c(Br)oc2ccccc12>>Cc1c(Cc2c(Br)oc3ccccc23)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het5Phe.Metals
negishi_batch	7798	Cc1cnccc1Br.[Zn]Cc1cnccc1Br>>Cc1cnccc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het6.Metals
negishi_batch	7799	Cc1nc2cocc2cc1Br.[Zn]Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het6Het5.Metals
negishi_batch	7800	Cc1c(Br)ncc2ccncc12.[Zn]Cc1c(Br)ncc2ccncc12>>Cc1c(Cc2c(Br)ncc3ccncc23)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het6Het6.Metals
negishi_batch	7801	Cc1c(Br)ncc2ccccc12.[Zn]Cc1c(Br)ncc2ccccc12>>Cc1c(Cc2c(Br)ncc3ccccc23)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_Het6Phe.Metals
negishi_batch	7802	Cc1cc2cocc2cc1Br.[Zn]Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_PheHet5.Metals
negishi_batch	7803	CCc1c(Br)ccc2ccncc12.[Zn]CCc1c(Br)ccc2ccncc12>>CCc1c(CCc2c(Br)ccc3ccncc23)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Bromide_PheHet6.Metals
negishi_batch	7804	Cc1cocc1Cl.Clc1cocc1C[Zn]>>Cc1cocc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het5.Metals
negishi_batch	7805	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1C[Zn]>>Cc1c(Cc2c(Cl)oc3cocc23)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het5Het5.Metals
negishi_batch	7806	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1C[Zn]>>Cc1c(Cc2c(Cl)oc3ccncc23)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het5Het6.Metals
negishi_batch	7807	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1C[Zn]>>Cc1c(Cc2c(Cl)oc3ccccc23)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het5Phe.Metals
negishi_batch	7808	Cc1cnccc1Cl.Clc1ccncc1C[Zn]>>Cc1cnccc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het6.Metals
negishi_batch	7809	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1C[Zn]>>Cc1nc2cocc2cc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het6Het5.Metals
negishi_batch	7810	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1C[Zn]>>Cc1c(Cc2c(Cl)ncc3ccncc23)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het6Het6.Metals
negishi_batch	7811	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1C[Zn]>>Cc1c(Cc2c(Cl)ncc3ccccc23)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Chloride_Het6Phe.Metals
negishi_batch	7812	Cc1cocc1I.[Zn]Cc1cocc1I>>Cc1cocc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het5.Metals
negishi_batch	7813	Cc1c(I)oc2cocc12.[Zn]Cc1c(I)oc2cocc12>>Cc1c(Cc2c(I)oc3cocc23)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het5Het5.Metals
negishi_batch	7814	Cc1c(I)oc2ccncc12.[Zn]Cc1c(I)oc2ccncc12>>Cc1c(Cc2c(I)oc3ccncc23)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het5Het6.Metals
negishi_batch	7815	Cc1c(I)oc2ccccc12.[Zn]Cc1c(I)oc2ccccc12>>Cc1c(Cc2c(I)oc3ccccc23)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het5Phe.Metals
negishi_batch	7816	Cc1cnccc1I.[Zn]Cc1cnccc1I>>Cc1cnccc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het6.Metals
negishi_batch	7817	Cc1nc2cocc2cc1I.[Zn]Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het6Het5.Metals
negishi_batch	7818	Cc1c(I)ncc2ccncc12.[Zn]Cc1c(I)ncc2ccncc12>>Cc1c(Cc2c(I)ncc3ccncc23)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het6Het6.Metals
negishi_batch	7819	Cc1c(I)ncc2ccccc12.[Zn]Cc1c(I)ncc2ccccc12>>Cc1c(Cc2c(I)ncc3ccccc23)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_Het6Phe.Metals
negishi_batch	7820	Cc1cc2cocc2cc1I.[Zn]Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_PheHet5.Metals
negishi_batch	7821	CCc1c(I)ccc2ccncc12.[Zn]CCc1c(I)ccc2ccncc12>>CCc1c(CCc2c(I)ccc3ccncc23)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Iodide_PheHet6.Metals
negishi_batch	7822	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1C[Zn])C(F)(F)F>>Cc1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het5.Metals
negishi_batch	7823	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het5Het5.Metals
negishi_batch	7824	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het5Het6.Metals
negishi_batch	7825	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het5Phe.Metals
negishi_batch	7826	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1C[Zn])C(F)(F)F>>Cc1cnccc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het6.Metals
negishi_batch	7827	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1C[Zn])C(F)(F)F>>Cc1nc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het6Het5.Metals
negishi_batch	7828	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het6Het6.Metals
negishi_batch	7829	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_Het6Phe.Metals
negishi_batch	7830	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1C[Zn])C(F)(F)F>>Cc1cc2cocc2cc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_PheHet5.Metals
negishi_batch	7831	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1C[Zn])C(F)(F)F>>Cc1c(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Zn:3][*:4]>>[a:2][*:4]	X-Triflate_PheHet6.Metals
pinacolatoborylation	7832	CCOB(OCC)B(OCC)OC(C)C.C=CCCCC(C)OB(OCC)B(OCC)OCC>>CCOB(OCC)B(OCC)OC(C)CCCCBC(OCC)OC(C)C	[B;$(B([O;D2][A])([O;D2][A])B([O;D2][A])[O;D2][A]):1][B:2].[C;D1;$(C=[c,C][*;!$(*=C)]):3]=[#6:4]>>[#6:2]B[#6:4]	AliphaticDiboronate.AlkeneTerminal
triazole_synthesis_1	7833	CCCN=[N+]=[N-].C#Cc1ccccc1CCCCN=[N+]=[N-]>>CCCn1nncc1c1ccccc1CCCCN=[N+]=[N]	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$([C;D2]([a])#[C;D1]):3][a:4]>>[*:2]n1:n:n:c:c:1[a:4]	Azide.AlkyneTerminalAromatic
triazole_synthesis_1	7834	CCCN=[N+]=[N-].C#CCCCCCN=[N+]=[N-]>>CCCn1nncc1CCCCCN=[N+]=[N]	[N;!R;$([N;+,-]=[N;+,-]=[N;+,-]),$(N=[N;+,-]=N):1][*:2].[C;$([C;D2]([A])#[C;D1]);!$(C[F,Cl,Br,I,$(OS(=O)(=O)C(F)(F)F)]):3][A:4]>>[*:2]n1:n:n:c:c:1[A:4]	Azide.AlkyneTerminalAliphatic
ullmann_X	7835	Cc1ccccc1Br.Brc1ccccc1Cc1ccccc1Br>>Cc1ccccc1c1ccccc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Phe
ullmann_X	7836	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PhePhe
ullmann_X	7837	Cc1ccccc1Br.Brc1ccccc1Cc1ccccc1I>>Cc1ccccc1c1ccccc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Phe
ullmann_X	7838	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_PhePhe
ullmann_X	7839	Cc1ccccc1Br.O=S(=O)(Oc1cccc(Cc2ccccc2Br)c1)C(F)(F)F>>Cc1ccccc1c1cccc(Cc2ccccc2Br)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Phe
ullmann_X	7840	Cc1ccccc1Br.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_PhePhe
ullmann_X	7841	Cc1ccccc1Br.Brc1ccccc1Cc1cocc1Br>>Cc1ccccc1c1cocc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5
ullmann_X	7842	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Het5
ullmann_X	7843	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Het6
ullmann_X	7844	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het5Phe
ullmann_X	7845	Cc1ccccc1Br.Brc1ccccc1Cc1cnccc1Br>>Cc1ccccc1c1ccncc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6
ullmann_X	7846	Cc1ccccc1Br.Brc1ccccc1Cc1nc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Het5
ullmann_X	7847	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Het6
ullmann_X	7848	Cc1ccccc1Br.Brc1ccccc1Cc1c(Br)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_Het6Phe
ullmann_X	7849	Cc1ccccc1Br.Brc1ccccc1Cc1cc2cocc2cc1Br>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PheHet5
ullmann_X	7850	Cc1ccccc1Br.Brc1ccccc1CCc1c(Br)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Bromide_PheHet6
ullmann_X	7851	Cc1ccccc1Br.Clc1cocc1Cc1ccccc1Br>>Cc1ccccc1c1cocc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het5
ullmann_X	7852	Cc1ccccc1Br.Clc1oc2cocc2c1Cc1ccccc1Br>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het5Het5
ullmann_X	7853	Cc1ccccc1Br.Clc1oc2ccncc2c1Cc1ccccc1Br>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het5Het6
ullmann_X	7854	Cc1ccccc1Br.Clc1oc2ccccc2c1Cc1ccccc1Br>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het5Phe
ullmann_X	7855	Cc1ccccc1Br.Clc1ccncc1Cc1ccccc1Br>>Cc1ccccc1c1ccncc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het6
ullmann_X	7856	Cc1ccccc1Br.Clc1cc2cocc2nc1Cc1ccccc1Br>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het6Het5
ullmann_X	7857	Cc1ccccc1Br.Clc1ncc2ccncc2c1Cc1ccccc1Br>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het6Het6
ullmann_X	7858	Cc1ccccc1Br.Clc1ncc2ccccc2c1Cc1ccccc1Br>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Chloride_Het6Phe
ullmann_X	7859	Cc1ccccc1Br.Brc1ccccc1Cc1cocc1I>>Cc1ccccc1c1cocc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het5
ullmann_X	7860	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het5Het5
ullmann_X	7861	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het5Het6
ullmann_X	7862	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het5Phe
ullmann_X	7863	Cc1ccccc1Br.Brc1ccccc1Cc1cnccc1I>>Cc1ccccc1c1ccncc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het6
ullmann_X	7864	Cc1ccccc1Br.Brc1ccccc1Cc1nc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het6Het5
ullmann_X	7865	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het6Het6
ullmann_X	7866	Cc1ccccc1Br.Brc1ccccc1Cc1c(I)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_Het6Phe
ullmann_X	7867	Cc1ccccc1Br.Brc1ccccc1Cc1cc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_PheHet5
ullmann_X	7868	Cc1ccccc1Br.Brc1ccccc1CCc1c(I)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Iodide_PheHet6
ullmann_X	7869	Cc1ccccc1Br.O=S(=O)(Oc1cocc1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1cocc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het5
ullmann_X	7870	Cc1ccccc1Br.O=S(=O)(Oc1oc2cocc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het5Het5
ullmann_X	7871	Cc1ccccc1Br.O=S(=O)(Oc1oc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het5Het6
ullmann_X	7872	Cc1ccccc1Br.O=S(=O)(Oc1oc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het5Phe
ullmann_X	7873	Cc1ccccc1Br.O=S(=O)(Oc1ccncc1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1ccncc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het6
ullmann_X	7874	Cc1ccccc1Br.O=S(=O)(Oc1cc2cocc2nc1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het6Het5
ullmann_X	7875	Cc1ccccc1Br.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het6Het6
ullmann_X	7876	Cc1ccccc1Br.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_Het6Phe
ullmann_X	7877	Cc1ccccc1Br.O=S(=O)(Oc1cc2cocc2cc1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_PheHet5
ullmann_X	7878	Cc1ccccc1Br.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1ccccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Phe.X-Triflate_PheHet6
ullmann_X	7879	Cc1c(Br)ccc2ccccc12.Brc1ccccc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Phe
ullmann_X	7880	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PhePhe
ullmann_X	7881	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1ccccc1I>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Phe
ullmann_X	7882	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_PhePhe
ullmann_X	7883	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(Br)ccc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2ccc1c1cccc(Cc2c(Br)ccc3ccccc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Phe
ullmann_X	7884	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_PhePhe
ullmann_X	7885	Cc1c(Br)ccc2ccccc12.Brc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5
ullmann_X	7886	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Het5
ullmann_X	7887	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Het6
ullmann_X	7888	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het5Phe
ullmann_X	7889	Cc1c(Br)ccc2ccccc12.Brc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6
ullmann_X	7890	Cc1c(Br)ccc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Het5
ullmann_X	7891	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Het6
ullmann_X	7892	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_Het6Phe
ullmann_X	7893	Cc1c(Br)ccc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PheHet5
ullmann_X	7894	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Bromide_PheHet6
ullmann_X	7895	Cc1c(Br)ccc2ccccc12.Clc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het5
ullmann_X	7896	Cc1c(Br)ccc2ccccc12.Clc1oc2cocc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het5Het5
ullmann_X	7897	Cc1c(Br)ccc2ccccc12.Clc1oc2ccncc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het5Het6
ullmann_X	7898	Cc1c(Br)ccc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het5Phe
ullmann_X	7899	Cc1c(Br)ccc2ccccc12.Clc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het6
ullmann_X	7900	Cc1c(Br)ccc2ccccc12.Clc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het6Het5
ullmann_X	7901	Cc1c(Br)ccc2ccccc12.Clc1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het6Het6
ullmann_X	7902	Cc1c(Br)ccc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Chloride_Het6Phe
ullmann_X	7903	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1cocc1I>>Cc1c2ccccc2ccc1c1cocc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het5
ullmann_X	7904	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het5Het5
ullmann_X	7905	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het5Het6
ullmann_X	7906	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het5Phe
ullmann_X	7907	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1cnccc1I>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het6
ullmann_X	7908	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het6Het5
ullmann_X	7909	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het6Het6
ullmann_X	7910	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_Het6Phe
ullmann_X	7911	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_PheHet5
ullmann_X	7912	Cc1c(Br)ccc2ccccc12.Brc1ccc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Iodide_PheHet6
ullmann_X	7913	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het5
ullmann_X	7914	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het5Het5
ullmann_X	7915	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het5Het6
ullmann_X	7916	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het5Phe
ullmann_X	7917	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het6
ullmann_X	7918	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het6Het5
ullmann_X	7919	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het6Het6
ullmann_X	7920	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_Het6Phe
ullmann_X	7921	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(Br)ccc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_PheHet5
ullmann_X	7922	Cc1c(Br)ccc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PhePhe.X-Triflate_PheHet6
ullmann_X	7923	Cc1ccccc1I.Brc1ccccc1Cc1ccccc1I>>Cc1ccccc1c1ccccc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Phe
ullmann_X	7924	Cc1ccccc1I.Brc1ccc2ccccc2c1Cc1ccccc1I>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_PhePhe
ullmann_X	7925	Cc1ccccc1I.Ic1ccccc1Cc1ccccc1I>>Cc1ccccc1c1ccccc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Phe
ullmann_X	7926	Cc1ccccc1I.Ic1ccccc1Cc1c(I)ccc2ccccc12>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_PhePhe
ullmann_X	7927	Cc1ccccc1I.O=S(=O)(Oc1cccc(Cc2ccccc2I)c1)C(F)(F)F>>Cc1ccccc1c1cccc(Cc2ccccc2I)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Phe
ullmann_X	7928	Cc1ccccc1I.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1ccc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_PhePhe
ullmann_X	7929	Cc1ccccc1I.Brc1cocc1Cc1ccccc1I>>Cc1ccccc1c1cocc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het5
ullmann_X	7930	Cc1ccccc1I.Brc1oc2cocc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het5Het5
ullmann_X	7931	Cc1ccccc1I.Brc1oc2ccncc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het5Het6
ullmann_X	7932	Cc1ccccc1I.Brc1oc2ccccc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het5Phe
ullmann_X	7933	Cc1ccccc1I.Brc1ccncc1Cc1ccccc1I>>Cc1ccccc1c1ccncc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het6
ullmann_X	7934	Cc1ccccc1I.Brc1cc2cocc2nc1Cc1ccccc1I>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het6Het5
ullmann_X	7935	Cc1ccccc1I.Brc1ncc2ccncc2c1Cc1ccccc1I>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het6Het6
ullmann_X	7936	Cc1ccccc1I.Brc1ncc2ccccc2c1Cc1ccccc1I>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_Het6Phe
ullmann_X	7937	Cc1ccccc1I.Brc1cc2cocc2cc1Cc1ccccc1I>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_PheHet5
ullmann_X	7938	Cc1ccccc1I.Brc1ccc2ccncc2c1CCc1ccccc1I>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Bromide_PheHet6
ullmann_X	7939	Cc1ccccc1I.Clc1cocc1Cc1ccccc1I>>Cc1ccccc1c1cocc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het5
ullmann_X	7940	Cc1ccccc1I.Clc1oc2cocc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het5Het5
ullmann_X	7941	Cc1ccccc1I.Clc1oc2ccncc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het5Het6
ullmann_X	7942	Cc1ccccc1I.Clc1oc2ccccc2c1Cc1ccccc1I>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het5Phe
ullmann_X	7943	Cc1ccccc1I.Clc1ccncc1Cc1ccccc1I>>Cc1ccccc1c1ccncc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het6
ullmann_X	7944	Cc1ccccc1I.Clc1cc2cocc2nc1Cc1ccccc1I>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het6Het5
ullmann_X	7945	Cc1ccccc1I.Clc1ncc2ccncc2c1Cc1ccccc1I>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het6Het6
ullmann_X	7946	Cc1ccccc1I.Clc1ncc2ccccc2c1Cc1ccccc1I>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Chloride_Het6Phe
ullmann_X	7947	Cc1ccccc1I.Ic1ccccc1Cc1cocc1I>>Cc1ccccc1c1cocc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het5
ullmann_X	7948	Cc1ccccc1I.Ic1ccccc1Cc1c(I)oc2cocc12>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het5Het5
ullmann_X	7949	Cc1ccccc1I.Ic1ccccc1Cc1c(I)oc2ccncc12>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het5Het6
ullmann_X	7950	Cc1ccccc1I.Ic1ccccc1Cc1c(I)oc2ccccc12>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het5Phe
ullmann_X	7951	Cc1ccccc1I.Ic1ccccc1Cc1cnccc1I>>Cc1ccccc1c1ccncc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het6
ullmann_X	7952	Cc1ccccc1I.Ic1ccccc1Cc1nc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het6Het5
ullmann_X	7953	Cc1ccccc1I.Ic1ccccc1Cc1c(I)ncc2ccncc12>>Cc1ccccc1c1ncc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het6Het6
ullmann_X	7954	Cc1ccccc1I.Ic1ccccc1Cc1c(I)ncc2ccccc12>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_Het6Phe
ullmann_X	7955	Cc1ccccc1I.Ic1ccccc1Cc1cc2cocc2cc1I>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_PheHet5
ullmann_X	7956	Cc1ccccc1I.Ic1ccccc1CCc1c(I)ccc2ccncc12>>Cc1ccccc1c1ccc2ccncc2c1CCc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Iodide_PheHet6
ullmann_X	7957	Cc1ccccc1I.O=S(=O)(Oc1cocc1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1cocc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het5
ullmann_X	7958	Cc1ccccc1I.O=S(=O)(Oc1oc2cocc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1oc2cocc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het5Het5
ullmann_X	7959	Cc1ccccc1I.O=S(=O)(Oc1oc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1oc2ccncc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het5Het6
ullmann_X	7960	Cc1ccccc1I.O=S(=O)(Oc1oc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1oc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het5Phe
ullmann_X	7961	Cc1ccccc1I.O=S(=O)(Oc1ccncc1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1ccncc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het6
ullmann_X	7962	Cc1ccccc1I.O=S(=O)(Oc1cc2cocc2nc1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1cc2cocc2nc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het6Het5
ullmann_X	7963	Cc1ccccc1I.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het6Het6
ullmann_X	7964	Cc1ccccc1I.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1ncc2ccccc2c1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_Het6Phe
ullmann_X	7965	Cc1ccccc1I.O=S(=O)(Oc1cc2cocc2cc1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1c1cc2cocc2cc1Cc1ccccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_PheHet5
ullmann_X	7966	Cc1ccccc1I.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1ccccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Phe.X-Triflate_PheHet6
ullmann_X	7967	Cc1c(I)ccc2ccccc12.Brc1ccccc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Phe
ullmann_X	7968	Cc1c(I)ccc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_PhePhe
ullmann_X	7969	Cc1c(I)ccc2ccccc12.Ic1ccccc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Phe
ullmann_X	7970	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_PhePhe
ullmann_X	7971	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(I)ccc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2ccc1c1cccc(Cc2c(I)ccc3ccccc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Phe
ullmann_X	7972	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_PhePhe
ullmann_X	7973	Cc1c(I)ccc2ccccc12.Brc1cocc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het5
ullmann_X	7974	Cc1c(I)ccc2ccccc12.Brc1oc2cocc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het5Het5
ullmann_X	7975	Cc1c(I)ccc2ccccc12.Brc1oc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het5Het6
ullmann_X	7976	Cc1c(I)ccc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het5Phe
ullmann_X	7977	Cc1c(I)ccc2ccccc12.Brc1ccncc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het6
ullmann_X	7978	Cc1c(I)ccc2ccccc12.Brc1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het6Het5
ullmann_X	7979	Cc1c(I)ccc2ccccc12.Brc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het6Het6
ullmann_X	7980	Cc1c(I)ccc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_Het6Phe
ullmann_X	7981	Cc1c(I)ccc2ccccc12.Brc1cc2cocc2cc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_PheHet5
ullmann_X	7982	Cc1c(I)ccc2ccccc12.Brc1ccc2ccncc2c1CCc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Bromide_PheHet6
ullmann_X	7983	Cc1c(I)ccc2ccccc12.Clc1cocc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het5
ullmann_X	7984	Cc1c(I)ccc2ccccc12.Clc1oc2cocc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het5Het5
ullmann_X	7985	Cc1c(I)ccc2ccccc12.Clc1oc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het5Het6
ullmann_X	7986	Cc1c(I)ccc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het5Phe
ullmann_X	7987	Cc1c(I)ccc2ccccc12.Clc1ccncc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het6
ullmann_X	7988	Cc1c(I)ccc2ccccc12.Clc1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het6Het5
ullmann_X	7989	Cc1c(I)ccc2ccccc12.Clc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het6Het6
ullmann_X	7990	Cc1c(I)ccc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Chloride_Het6Phe
ullmann_X	7991	Cc1c(I)ccc2ccccc12.Ic1cocc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cocc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het5
ullmann_X	7992	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het5Het5
ullmann_X	7993	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het5Het6
ullmann_X	7994	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het5Phe
ullmann_X	7995	Cc1c(I)ccc2ccccc12.Ic1ccncc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het6
ullmann_X	7996	Cc1c(I)ccc2ccccc12.Ic1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het6Het5
ullmann_X	7997	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het6Het6
ullmann_X	7998	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_Het6Phe
ullmann_X	7999	Cc1c(I)ccc2ccccc12.Ic1cc2cocc2cc1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_PheHet5
ullmann_X	8000	Cc1c(I)ccc2ccccc12.Ic1ccc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Iodide_PheHet6
ullmann_X	8001	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het5
ullmann_X	8002	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het5Het5
ullmann_X	8003	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het5Het6
ullmann_X	8004	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het5Phe
ullmann_X	8005	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het6
ullmann_X	8006	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het6Het5
ullmann_X	8007	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het6Het6
ullmann_X	8008	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_Het6Phe
ullmann_X	8009	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(I)ccc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_PheHet5
ullmann_X	8010	Cc1c(I)ccc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PhePhe.X-Triflate_PheHet6
ullmann_X	8011	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccccc2Br)c1)C(F)(F)F>>Cc1cccc(c2ccccc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Phe
ullmann_X	8012	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)ccc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_PhePhe
ullmann_X	8013	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2ccccc2I)c1)C(F)(F)F>>Cc1cccc(c2ccccc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Phe
ullmann_X	8014	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)ccc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_PhePhe
ullmann_X	8015	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1)C(F)(F)F>>Cc1cccc(c2cccc(Cc3cccc(OS(=O)(=O)C(F)(F)F)c3)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Phe
ullmann_X	8016	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_PhePhe
ullmann_X	8017	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cocc2Br)c1)C(F)(F)F>>Cc1cccc(c2cocc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het5
ullmann_X	8018	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)oc3cocc23)c1)C(F)(F)F>>Cc1cccc(c2oc3cocc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het5Het5
ullmann_X	8019	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)oc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het5Het6
ullmann_X	8020	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)oc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het5Phe
ullmann_X	8021	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnccc2Br)c1)C(F)(F)F>>Cc1cccc(c2ccncc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het6
ullmann_X	8022	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2Br)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3nc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het6Het5
ullmann_X	8023	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)ncc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het6Het6
ullmann_X	8024	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Br)ncc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_Het6Phe
ullmann_X	8025	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2Br)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3cc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_PheHet5
ullmann_X	8026	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2c(Br)ccc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccncc3c2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Bromide_PheHet6
ullmann_X	8027	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cocc2Cl)c1)C(F)(F)F>>Cc1cccc(c2cocc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het5
ullmann_X	8028	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3cocc23)c1)C(F)(F)F>>Cc1cccc(c2oc3cocc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het5Het5
ullmann_X	8029	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het5Het6
ullmann_X	8030	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het5Phe
ullmann_X	8031	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnccc2Cl)c1)C(F)(F)F>>Cc1cccc(c2ccncc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het6
ullmann_X	8032	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2Cl)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3nc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het6Het5
ullmann_X	8033	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Cl)ncc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het6Het6
ullmann_X	8034	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(Cl)ncc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Chloride_Het6Phe
ullmann_X	8035	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cocc2I)c1)C(F)(F)F>>Cc1cccc(c2cocc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het5
ullmann_X	8036	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)oc3cocc23)c1)C(F)(F)F>>Cc1cccc(c2oc3cocc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het5Het5
ullmann_X	8037	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)oc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het5Het6
ullmann_X	8038	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)oc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het5Phe
ullmann_X	8039	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnccc2I)c1)C(F)(F)F>>Cc1cccc(c2ccncc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het6
ullmann_X	8040	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2I)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3nc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het6Het5
ullmann_X	8041	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)ncc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het6Het6
ullmann_X	8042	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(I)ncc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_Het6Phe
ullmann_X	8043	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2I)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3cc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_PheHet5
ullmann_X	8044	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(CCc2c(I)ccc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccncc3c2CCc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Iodide_PheHet6
ullmann_X	8045	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cocc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cccc(c2cocc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het5
ullmann_X	8046	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1)C(F)(F)F>>Cc1cccc(c2oc3cocc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het5Het5
ullmann_X	8047	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het5Het6
ullmann_X	8048	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2oc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het5Phe
ullmann_X	8049	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cnccc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cccc(c2ccncc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het6
ullmann_X	8050	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3nc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het6Het5
ullmann_X	8051	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het6Het6
ullmann_X	8052	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1)C(F)(F)F>>Cc1cccc(c2ncc3ccccc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_Het6Phe
ullmann_X	8053	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cccc(c2cc3cocc3cc2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_PheHet5
ullmann_X	8054	Cc1cccc(OS(=O)(=O)C(F)(F)F)c1.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1)C(F)(F)F>>Cc1cccc(c2ccc3ccncc3c2Cc2cccc(OS(=O)(=O)C(F)(F)F)c2)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Phe.X-Triflate_PheHet6
ullmann_X	8055	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Phe
ullmann_X	8056	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_PhePhe
ullmann_X	8057	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Phe
ullmann_X	8058	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_PhePhe
ullmann_X	8059	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2ccc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccccc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Phe
ullmann_X	8060	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_PhePhe
ullmann_X	8061	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het5
ullmann_X	8062	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het5Het5
ullmann_X	8063	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het5Het6
ullmann_X	8064	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het5Phe
ullmann_X	8065	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het6
ullmann_X	8066	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het6Het5
ullmann_X	8067	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het6Het6
ullmann_X	8068	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_Het6Phe
ullmann_X	8069	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_PheHet5
ullmann_X	8070	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Bromide_PheHet6
ullmann_X	8071	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het5
ullmann_X	8072	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het5Het5
ullmann_X	8073	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het5Het6
ullmann_X	8074	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het5Phe
ullmann_X	8075	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het6
ullmann_X	8076	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het6Het5
ullmann_X	8077	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het6Het6
ullmann_X	8078	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Chloride_Het6Phe
ullmann_X	8079	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het5
ullmann_X	8080	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het5Het5
ullmann_X	8081	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het5Het6
ullmann_X	8082	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het5Phe
ullmann_X	8083	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het6
ullmann_X	8084	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het6Het5
ullmann_X	8085	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het6Het6
ullmann_X	8086	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_Het6Phe
ullmann_X	8087	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_PheHet5
ullmann_X	8088	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Iodide_PheHet6
ullmann_X	8089	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het5
ullmann_X	8090	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het5Het5
ullmann_X	8091	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het5Het6
ullmann_X	8092	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het5Phe
ullmann_X	8093	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het6
ullmann_X	8094	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het6Het5
ullmann_X	8095	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het6Het6
ullmann_X	8096	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_Het6Phe
ullmann_X	8097	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_PheHet5
ullmann_X	8098	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2ccc1c1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PhePhe.X-Triflate_PheHet6
ullmann_X	8099	Cc1cocc1Br.Brc1ccccc1Cc1cocc1Br>>Cc1cocc1c1ccccc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Phe
ullmann_X	8100	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PhePhe
ullmann_X	8101	Cc1cocc1Br.Brc1cocc1Cc1ccccc1I>>Cc1cocc1c1ccccc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Phe
ullmann_X	8102	Cc1cocc1Br.Brc1cocc1Cc1c(I)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_PhePhe
ullmann_X	8103	Cc1cocc1Br.O=S(=O)(Oc1cccc(Cc2cocc2Br)c1)C(F)(F)F>>Cc1cocc1c1cccc(Cc2cocc2Br)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Phe
ullmann_X	8104	Cc1cocc1Br.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_PhePhe
ullmann_X	8105	Cc1cocc1Br.Brc1cocc1Cc1cocc1Br>>Cc1cocc1c1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5
ullmann_X	8106	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Het5
ullmann_X	8107	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Het6
ullmann_X	8108	Cc1cocc1Br.Brc1cocc1Cc1c(Br)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het5Phe
ullmann_X	8109	Cc1cocc1Br.Brc1ccncc1Cc1cocc1Br>>Cc1cocc1c1ccncc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6
ullmann_X	8110	Cc1cocc1Br.Brc1cocc1Cc1nc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Het5
ullmann_X	8111	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Het6
ullmann_X	8112	Cc1cocc1Br.Brc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_Het6Phe
ullmann_X	8113	Cc1cocc1Br.Brc1cocc1Cc1cc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PheHet5
ullmann_X	8114	Cc1cocc1Br.Brc1cocc1CCc1c(Br)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Bromide_PheHet6
ullmann_X	8115	Cc1cocc1Br.Clc1cocc1Cc1cocc1Br>>Cc1cocc1c1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het5
ullmann_X	8116	Cc1cocc1Br.Clc1oc2cocc2c1Cc1cocc1Br>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het5Het5
ullmann_X	8117	Cc1cocc1Br.Clc1oc2ccncc2c1Cc1cocc1Br>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het5Het6
ullmann_X	8118	Cc1cocc1Br.Clc1oc2ccccc2c1Cc1cocc1Br>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het5Phe
ullmann_X	8119	Cc1cocc1Br.Clc1ccncc1Cc1cocc1Br>>Cc1cocc1c1ccncc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het6
ullmann_X	8120	Cc1cocc1Br.Clc1cc2cocc2nc1Cc1cocc1Br>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het6Het5
ullmann_X	8121	Cc1cocc1Br.Clc1ncc2ccncc2c1Cc1cocc1Br>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het6Het6
ullmann_X	8122	Cc1cocc1Br.Clc1ncc2ccccc2c1Cc1cocc1Br>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Chloride_Het6Phe
ullmann_X	8123	Cc1cocc1Br.Brc1cocc1Cc1cocc1I>>Cc1cocc1c1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het5
ullmann_X	8124	Cc1cocc1Br.Brc1cocc1Cc1c(I)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het5Het5
ullmann_X	8125	Cc1cocc1Br.Brc1cocc1Cc1c(I)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het5Het6
ullmann_X	8126	Cc1cocc1Br.Brc1cocc1Cc1c(I)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het5Phe
ullmann_X	8127	Cc1cocc1Br.Brc1cocc1Cc1cnccc1I>>Cc1cocc1c1ccncc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het6
ullmann_X	8128	Cc1cocc1Br.Brc1cocc1Cc1nc2cocc2cc1I>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het6Het5
ullmann_X	8129	Cc1cocc1Br.Brc1cocc1Cc1c(I)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het6Het6
ullmann_X	8130	Cc1cocc1Br.Brc1cocc1Cc1c(I)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_Het6Phe
ullmann_X	8131	Cc1cocc1Br.Brc1cocc1Cc1cc2cocc2cc1I>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_PheHet5
ullmann_X	8132	Cc1cocc1Br.Brc1cocc1CCc1c(I)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Iodide_PheHet6
ullmann_X	8133	Cc1cocc1Br.O=S(=O)(Oc1cocc1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het5
ullmann_X	8134	Cc1cocc1Br.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het5Het5
ullmann_X	8135	Cc1cocc1Br.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het5Het6
ullmann_X	8136	Cc1cocc1Br.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het5Phe
ullmann_X	8137	Cc1cocc1Br.O=S(=O)(Oc1ccncc1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het6
ullmann_X	8138	Cc1cocc1Br.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het6Het5
ullmann_X	8139	Cc1cocc1Br.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het6Het6
ullmann_X	8140	Cc1cocc1Br.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_Het6Phe
ullmann_X	8141	Cc1cocc1Br.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_PheHet5
ullmann_X	8142	Cc1cocc1Br.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5.X-Triflate_PheHet6
ullmann_X	8143	Cc1c(Br)oc2cocc12.Brc1ccccc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Phe
ullmann_X	8144	Cc1c(Br)oc2cocc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PhePhe
ullmann_X	8145	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1ccccc1I>>Cc1c2cocc2oc1c1ccccc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Phe
ullmann_X	8146	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_PhePhe
ullmann_X	8147	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1cccc(Cc2c(Br)oc3cocc23)c1)C(F)(F)F>>Cc1c2cocc2oc1c1cccc(Cc2c(Br)oc3cocc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Phe
ullmann_X	8148	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_PhePhe
ullmann_X	8149	Cc1c(Br)oc2cocc12.Brc1cocc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5
ullmann_X	8150	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Het5
ullmann_X	8151	Cc1c(Br)oc2cocc12.Brc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Het6
ullmann_X	8152	Cc1c(Br)oc2cocc12.Brc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het5Phe
ullmann_X	8153	Cc1c(Br)oc2cocc12.Brc1ccncc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6
ullmann_X	8154	Cc1c(Br)oc2cocc12.Brc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Het5
ullmann_X	8155	Cc1c(Br)oc2cocc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Het6
ullmann_X	8156	Cc1c(Br)oc2cocc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_Het6Phe
ullmann_X	8157	Cc1c(Br)oc2cocc12.Brc1cc2cocc2cc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PheHet5
ullmann_X	8158	Cc1c(Br)oc2cocc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Bromide_PheHet6
ullmann_X	8159	Cc1c(Br)oc2cocc12.Clc1cocc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het5
ullmann_X	8160	Cc1c(Br)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het5Het5
ullmann_X	8161	Cc1c(Br)oc2cocc12.Clc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het5Het6
ullmann_X	8162	Cc1c(Br)oc2cocc12.Clc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het5Phe
ullmann_X	8163	Cc1c(Br)oc2cocc12.Clc1ccncc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het6
ullmann_X	8164	Cc1c(Br)oc2cocc12.Clc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het6Het5
ullmann_X	8165	Cc1c(Br)oc2cocc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het6Het6
ullmann_X	8166	Cc1c(Br)oc2cocc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Chloride_Het6Phe
ullmann_X	8167	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1cocc1I>>Cc1c2cocc2oc1c1cocc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het5
ullmann_X	8168	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het5Het5
ullmann_X	8169	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)oc2ccncc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het5Het6
ullmann_X	8170	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)oc2ccccc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het5Phe
ullmann_X	8171	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1cnccc1I>>Cc1c2cocc2oc1c1ccncc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het6
ullmann_X	8172	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1nc2cocc2cc1I>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het6Het5
ullmann_X	8173	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het6Het6
ullmann_X	8174	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_Het6Phe
ullmann_X	8175	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1Cc1cc2cocc2cc1I>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_PheHet5
ullmann_X	8176	Cc1c(Br)oc2cocc12.Brc1oc2cocc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Iodide_PheHet6
ullmann_X	8177	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1cocc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het5
ullmann_X	8178	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het5Het5
ullmann_X	8179	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het5Het6
ullmann_X	8180	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het5Phe
ullmann_X	8181	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het6
ullmann_X	8182	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het6Het5
ullmann_X	8183	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het6Het6
ullmann_X	8184	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_Het6Phe
ullmann_X	8185	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Br)oc2cocc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_PheHet5
ullmann_X	8186	Cc1c(Br)oc2cocc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het5.X-Triflate_PheHet6
ullmann_X	8187	Cc1c(Br)oc2ccncc12.Brc1ccccc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Phe
ullmann_X	8188	Cc1c(Br)oc2ccncc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PhePhe
ullmann_X	8189	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1ccccc1I>>Cc1c2cnccc2oc1c1ccccc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Phe
ullmann_X	8190	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_PhePhe
ullmann_X	8191	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(Br)oc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2oc1c1cccc(Cc2c(Br)oc3ccncc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Phe
ullmann_X	8192	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_PhePhe
ullmann_X	8193	Cc1c(Br)oc2ccncc12.Brc1cocc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5
ullmann_X	8194	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Het5
ullmann_X	8195	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Het6
ullmann_X	8196	Cc1c(Br)oc2ccncc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het5Phe
ullmann_X	8197	Cc1c(Br)oc2ccncc12.Brc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6
ullmann_X	8198	Cc1c(Br)oc2ccncc12.Brc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Het5
ullmann_X	8199	Cc1c(Br)oc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Het6
ullmann_X	8200	Cc1c(Br)oc2ccncc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_Het6Phe
ullmann_X	8201	Cc1c(Br)oc2ccncc12.Brc1cc2cocc2cc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PheHet5
ullmann_X	8202	Cc1c(Br)oc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Bromide_PheHet6
ullmann_X	8203	Cc1c(Br)oc2ccncc12.Clc1cocc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het5
ullmann_X	8204	Cc1c(Br)oc2ccncc12.Clc1oc2cocc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het5Het5
ullmann_X	8205	Cc1c(Br)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het5Het6
ullmann_X	8206	Cc1c(Br)oc2ccncc12.Clc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het5Phe
ullmann_X	8207	Cc1c(Br)oc2ccncc12.Clc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het6
ullmann_X	8208	Cc1c(Br)oc2ccncc12.Clc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het6Het5
ullmann_X	8209	Cc1c(Br)oc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het6Het6
ullmann_X	8210	Cc1c(Br)oc2ccncc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Chloride_Het6Phe
ullmann_X	8211	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1cocc1I>>Cc1c2cnccc2oc1c1cocc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het5
ullmann_X	8212	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het5Het5
ullmann_X	8213	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het5Het6
ullmann_X	8214	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het5Phe
ullmann_X	8215	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1cnccc1I>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het6
ullmann_X	8216	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het6Het5
ullmann_X	8217	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het6Het6
ullmann_X	8218	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_Het6Phe
ullmann_X	8219	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_PheHet5
ullmann_X	8220	Cc1c(Br)oc2ccncc12.Brc1oc2ccncc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Iodide_PheHet6
ullmann_X	8221	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het5
ullmann_X	8222	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het5Het5
ullmann_X	8223	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het5Het6
ullmann_X	8224	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het5Phe
ullmann_X	8225	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het6
ullmann_X	8226	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het6Het5
ullmann_X	8227	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het6Het6
ullmann_X	8228	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_Het6Phe
ullmann_X	8229	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_PheHet5
ullmann_X	8230	Cc1c(Br)oc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Het6.X-Triflate_PheHet6
ullmann_X	8231	Cc1c(Br)oc2ccccc12.Brc1ccccc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Phe
ullmann_X	8232	Cc1c(Br)oc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PhePhe
ullmann_X	8233	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1ccccc1I>>Cc1c2ccccc2oc1c1ccccc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Phe
ullmann_X	8234	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_PhePhe
ullmann_X	8235	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(Br)oc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2oc1c1cccc(Cc2c(Br)oc3ccccc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Phe
ullmann_X	8236	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_PhePhe
ullmann_X	8237	Cc1c(Br)oc2ccccc12.Brc1cocc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5
ullmann_X	8238	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Het5
ullmann_X	8239	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Het6
ullmann_X	8240	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het5Phe
ullmann_X	8241	Cc1c(Br)oc2ccccc12.Brc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6
ullmann_X	8242	Cc1c(Br)oc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Het5
ullmann_X	8243	Cc1c(Br)oc2ccccc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Het6
ullmann_X	8244	Cc1c(Br)oc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_Het6Phe
ullmann_X	8245	Cc1c(Br)oc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PheHet5
ullmann_X	8246	Cc1c(Br)oc2ccccc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Bromide_PheHet6
ullmann_X	8247	Cc1c(Br)oc2ccccc12.Clc1cocc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het5
ullmann_X	8248	Cc1c(Br)oc2ccccc12.Clc1oc2cocc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het5Het5
ullmann_X	8249	Cc1c(Br)oc2ccccc12.Clc1oc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het5Het6
ullmann_X	8250	Cc1c(Br)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het5Phe
ullmann_X	8251	Cc1c(Br)oc2ccccc12.Clc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het6
ullmann_X	8252	Cc1c(Br)oc2ccccc12.Clc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het6Het5
ullmann_X	8253	Cc1c(Br)oc2ccccc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het6Het6
ullmann_X	8254	Cc1c(Br)oc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Chloride_Het6Phe
ullmann_X	8255	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1cocc1I>>Cc1c2ccccc2oc1c1cocc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het5
ullmann_X	8256	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het5Het5
ullmann_X	8257	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het5Het6
ullmann_X	8258	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het5Phe
ullmann_X	8259	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1cnccc1I>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het6
ullmann_X	8260	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het6Het5
ullmann_X	8261	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het6Het6
ullmann_X	8262	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_Het6Phe
ullmann_X	8263	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_PheHet5
ullmann_X	8264	Cc1c(Br)oc2ccccc12.Brc1oc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Iodide_PheHet6
ullmann_X	8265	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het5
ullmann_X	8266	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het5Het5
ullmann_X	8267	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het5Het6
ullmann_X	8268	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het5Phe
ullmann_X	8269	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het6
ullmann_X	8270	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het6Het5
ullmann_X	8271	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het6Het6
ullmann_X	8272	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_Het6Phe
ullmann_X	8273	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Br)oc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_PheHet5
ullmann_X	8274	Cc1c(Br)oc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het5Phe.X-Triflate_PheHet6
ullmann_X	8275	Cc1cnccc1Br.Brc1ccccc1Cc1cnccc1Br>>Cc1cnccc1c1ccccc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Phe
ullmann_X	8276	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PhePhe
ullmann_X	8277	Cc1cnccc1Br.Brc1ccncc1Cc1ccccc1I>>Cc1cnccc1c1ccccc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Phe
ullmann_X	8278	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_PhePhe
ullmann_X	8279	Cc1cnccc1Br.O=S(=O)(Oc1cccc(Cc2cnccc2Br)c1)C(F)(F)F>>Cc1cnccc1c1cccc(Cc2cnccc2Br)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Phe
ullmann_X	8280	Cc1cnccc1Br.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_PhePhe
ullmann_X	8281	Cc1cnccc1Br.Brc1ccncc1Cc1cocc1Br>>Cc1cnccc1c1cocc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5
ullmann_X	8282	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Het5
ullmann_X	8283	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Het6
ullmann_X	8284	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het5Phe
ullmann_X	8285	Cc1cnccc1Br.Brc1ccncc1Cc1cnccc1Br>>Cc1cnccc1c1ccncc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6
ullmann_X	8286	Cc1cnccc1Br.Brc1ccncc1Cc1nc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Het5
ullmann_X	8287	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Het6
ullmann_X	8288	Cc1cnccc1Br.Brc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_Het6Phe
ullmann_X	8289	Cc1cnccc1Br.Brc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PheHet5
ullmann_X	8290	Cc1cnccc1Br.Brc1ccncc1CCc1c(Br)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Bromide_PheHet6
ullmann_X	8291	Cc1cnccc1Br.Clc1cocc1Cc1cnccc1Br>>Cc1cnccc1c1cocc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het5
ullmann_X	8292	Cc1cnccc1Br.Clc1oc2cocc2c1Cc1cnccc1Br>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het5Het5
ullmann_X	8293	Cc1cnccc1Br.Clc1oc2ccncc2c1Cc1cnccc1Br>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het5Het6
ullmann_X	8294	Cc1cnccc1Br.Clc1oc2ccccc2c1Cc1cnccc1Br>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het5Phe
ullmann_X	8295	Cc1cnccc1Br.Clc1ccncc1Cc1cnccc1Br>>Cc1cnccc1c1ccncc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het6
ullmann_X	8296	Cc1cnccc1Br.Clc1cc2cocc2nc1Cc1cnccc1Br>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het6Het5
ullmann_X	8297	Cc1cnccc1Br.Clc1ncc2ccncc2c1Cc1cnccc1Br>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het6Het6
ullmann_X	8298	Cc1cnccc1Br.Clc1ncc2ccccc2c1Cc1cnccc1Br>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Chloride_Het6Phe
ullmann_X	8299	Cc1cnccc1Br.Brc1ccncc1Cc1cocc1I>>Cc1cnccc1c1cocc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het5
ullmann_X	8300	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het5Het5
ullmann_X	8301	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het5Het6
ullmann_X	8302	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het5Phe
ullmann_X	8303	Cc1cnccc1Br.Brc1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het6
ullmann_X	8304	Cc1cnccc1Br.Brc1ccncc1Cc1nc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het6Het5
ullmann_X	8305	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het6Het6
ullmann_X	8306	Cc1cnccc1Br.Brc1ccncc1Cc1c(I)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_Het6Phe
ullmann_X	8307	Cc1cnccc1Br.Brc1ccncc1Cc1cc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_PheHet5
ullmann_X	8308	Cc1cnccc1Br.Brc1ccncc1CCc1c(I)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Iodide_PheHet6
ullmann_X	8309	Cc1cnccc1Br.O=S(=O)(Oc1cocc1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het5
ullmann_X	8310	Cc1cnccc1Br.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het5Het5
ullmann_X	8311	Cc1cnccc1Br.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het5Het6
ullmann_X	8312	Cc1cnccc1Br.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het5Phe
ullmann_X	8313	Cc1cnccc1Br.O=S(=O)(Oc1ccncc1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het6
ullmann_X	8314	Cc1cnccc1Br.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het6Het5
ullmann_X	8315	Cc1cnccc1Br.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het6Het6
ullmann_X	8316	Cc1cnccc1Br.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_Het6Phe
ullmann_X	8317	Cc1cnccc1Br.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_PheHet5
ullmann_X	8318	Cc1cnccc1Br.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6.X-Triflate_PheHet6
ullmann_X	8319	Cc1nc2cocc2cc1Br.Brc1ccccc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Phe
ullmann_X	8320	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PhePhe
ullmann_X	8321	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1ccccc1I>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Phe
ullmann_X	8322	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_PhePhe
ullmann_X	8323	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2Br)c1)C(F)(F)F>>Cc1nc2cocc2cc1c1cccc(Cc2nc3cocc3cc2Br)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Phe
ullmann_X	8324	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_PhePhe
ullmann_X	8325	Cc1nc2cocc2cc1Br.Brc1cocc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5
ullmann_X	8326	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Het5
ullmann_X	8327	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Het6
ullmann_X	8328	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het5Phe
ullmann_X	8329	Cc1nc2cocc2cc1Br.Brc1ccncc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6
ullmann_X	8330	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Het5
ullmann_X	8331	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Het6
ullmann_X	8332	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_Het6Phe
ullmann_X	8333	Cc1nc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PheHet5
ullmann_X	8334	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Bromide_PheHet6
ullmann_X	8335	Cc1nc2cocc2cc1Br.Clc1cocc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het5
ullmann_X	8336	Cc1nc2cocc2cc1Br.Clc1oc2cocc2c1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het5Het5
ullmann_X	8337	Cc1nc2cocc2cc1Br.Clc1oc2ccncc2c1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het5Het6
ullmann_X	8338	Cc1nc2cocc2cc1Br.Clc1oc2ccccc2c1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het5Phe
ullmann_X	8339	Cc1nc2cocc2cc1Br.Clc1ccncc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het6
ullmann_X	8340	Cc1nc2cocc2cc1Br.Clc1cc2cocc2nc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het6Het5
ullmann_X	8341	Cc1nc2cocc2cc1Br.Clc1ncc2ccncc2c1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het6Het6
ullmann_X	8342	Cc1nc2cocc2cc1Br.Clc1ncc2ccccc2c1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Chloride_Het6Phe
ullmann_X	8343	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1cocc1I>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het5
ullmann_X	8344	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het5Het5
ullmann_X	8345	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het5Het6
ullmann_X	8346	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het5Phe
ullmann_X	8347	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1cnccc1I>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het6
ullmann_X	8348	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het6Het5
ullmann_X	8349	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het6Het6
ullmann_X	8350	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_Het6Phe
ullmann_X	8351	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1Cc1cc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_PheHet5
ullmann_X	8352	Cc1nc2cocc2cc1Br.Brc1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Iodide_PheHet6
ullmann_X	8353	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het5
ullmann_X	8354	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het5Het5
ullmann_X	8355	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het5Het6
ullmann_X	8356	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het5Phe
ullmann_X	8357	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het6
ullmann_X	8358	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het6Het5
ullmann_X	8359	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het6Het6
ullmann_X	8360	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_Het6Phe
ullmann_X	8361	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_PheHet5
ullmann_X	8362	Cc1nc2cocc2cc1Br.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het5.X-Triflate_PheHet6
ullmann_X	8363	Cc1c(Br)ncc2ccncc12.Brc1ccccc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Phe
ullmann_X	8364	Cc1c(Br)ncc2ccncc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PhePhe
ullmann_X	8365	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1ccccc1I>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Phe
ullmann_X	8366	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_PhePhe
ullmann_X	8367	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(Br)ncc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2cnc1c1cccc(Cc2c(Br)ncc3ccncc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Phe
ullmann_X	8368	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_PhePhe
ullmann_X	8369	Cc1c(Br)ncc2ccncc12.Brc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5
ullmann_X	8370	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Het5
ullmann_X	8371	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Het6
ullmann_X	8372	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het5Phe
ullmann_X	8373	Cc1c(Br)ncc2ccncc12.Brc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6
ullmann_X	8374	Cc1c(Br)ncc2ccncc12.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Het5
ullmann_X	8375	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Het6
ullmann_X	8376	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_Het6Phe
ullmann_X	8377	Cc1c(Br)ncc2ccncc12.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PheHet5
ullmann_X	8378	Cc1c(Br)ncc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Bromide_PheHet6
ullmann_X	8379	Cc1c(Br)ncc2ccncc12.Clc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het5
ullmann_X	8380	Cc1c(Br)ncc2ccncc12.Clc1oc2cocc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het5Het5
ullmann_X	8381	Cc1c(Br)ncc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het5Het6
ullmann_X	8382	Cc1c(Br)ncc2ccncc12.Clc1oc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het5Phe
ullmann_X	8383	Cc1c(Br)ncc2ccncc12.Clc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het6
ullmann_X	8384	Cc1c(Br)ncc2ccncc12.Clc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het6Het5
ullmann_X	8385	Cc1c(Br)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het6Het6
ullmann_X	8386	Cc1c(Br)ncc2ccncc12.Clc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Chloride_Het6Phe
ullmann_X	8387	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1cocc1I>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het5
ullmann_X	8388	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het5Het5
ullmann_X	8389	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het5Het6
ullmann_X	8390	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het5Phe
ullmann_X	8391	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1cnccc1I>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het6
ullmann_X	8392	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het6Het5
ullmann_X	8393	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het6Het6
ullmann_X	8394	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_Het6Phe
ullmann_X	8395	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_PheHet5
ullmann_X	8396	Cc1c(Br)ncc2ccncc12.Brc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Iodide_PheHet6
ullmann_X	8397	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het5
ullmann_X	8398	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het5Het5
ullmann_X	8399	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het5Het6
ullmann_X	8400	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het5Phe
ullmann_X	8401	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het6
ullmann_X	8402	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het6Het5
ullmann_X	8403	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het6Het6
ullmann_X	8404	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_Het6Phe
ullmann_X	8405	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_PheHet5
ullmann_X	8406	Cc1c(Br)ncc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Het6.X-Triflate_PheHet6
ullmann_X	8407	Cc1c(Br)ncc2ccccc12.Brc1ccccc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Phe
ullmann_X	8408	Cc1c(Br)ncc2ccccc12.Brc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PhePhe
ullmann_X	8409	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1ccccc1I>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Phe
ullmann_X	8410	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_PhePhe
ullmann_X	8411	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(Br)ncc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2cnc1c1cccc(Cc2c(Br)ncc3ccccc23)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Phe
ullmann_X	8412	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_PhePhe
ullmann_X	8413	Cc1c(Br)ncc2ccccc12.Brc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5
ullmann_X	8414	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Het5
ullmann_X	8415	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Het6
ullmann_X	8416	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het5Phe
ullmann_X	8417	Cc1c(Br)ncc2ccccc12.Brc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6
ullmann_X	8418	Cc1c(Br)ncc2ccccc12.Brc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Het5
ullmann_X	8419	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Het6
ullmann_X	8420	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_Het6Phe
ullmann_X	8421	Cc1c(Br)ncc2ccccc12.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PheHet5
ullmann_X	8422	Cc1c(Br)ncc2ccccc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Bromide_PheHet6
ullmann_X	8423	Cc1c(Br)ncc2ccccc12.Clc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het5
ullmann_X	8424	Cc1c(Br)ncc2ccccc12.Clc1oc2cocc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het5Het5
ullmann_X	8425	Cc1c(Br)ncc2ccccc12.Clc1oc2ccncc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het5Het6
ullmann_X	8426	Cc1c(Br)ncc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het5Phe
ullmann_X	8427	Cc1c(Br)ncc2ccccc12.Clc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het6
ullmann_X	8428	Cc1c(Br)ncc2ccccc12.Clc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het6Het5
ullmann_X	8429	Cc1c(Br)ncc2ccccc12.Clc1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het6Het6
ullmann_X	8430	Cc1c(Br)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Chloride_Het6Phe
ullmann_X	8431	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1cocc1I>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het5
ullmann_X	8432	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het5Het5
ullmann_X	8433	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het5Het6
ullmann_X	8434	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het5Phe
ullmann_X	8435	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1cnccc1I>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het6
ullmann_X	8436	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het6Het5
ullmann_X	8437	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het6Het6
ullmann_X	8438	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_Het6Phe
ullmann_X	8439	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_PheHet5
ullmann_X	8440	Cc1c(Br)ncc2ccccc12.Brc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Iodide_PheHet6
ullmann_X	8441	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het5
ullmann_X	8442	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het5Het5
ullmann_X	8443	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het5Het6
ullmann_X	8444	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het5Phe
ullmann_X	8445	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het6
ullmann_X	8446	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het6Het5
ullmann_X	8447	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het6Het6
ullmann_X	8448	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_Het6Phe
ullmann_X	8449	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Br)ncc2ccccc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_PheHet5
ullmann_X	8450	Cc1c(Br)ncc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_Het6Phe.X-Triflate_PheHet6
ullmann_X	8451	Cc1cc2cocc2cc1Br.Brc1ccccc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Phe
ullmann_X	8452	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PhePhe
ullmann_X	8453	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1ccccc1I>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Phe
ullmann_X	8454	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)ccc2ccccc12>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_PhePhe
ullmann_X	8455	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2Br)c1)C(F)(F)F>>Cc1cc2cocc2cc1c1cccc(Cc2cc3cocc3cc2Br)c1	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Phe
ullmann_X	8456	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1ccc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_PhePhe
ullmann_X	8457	Cc1cc2cocc2cc1Br.Brc1cocc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5
ullmann_X	8458	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2cocc12>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Het5
ullmann_X	8459	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2ccncc12>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Het6
ullmann_X	8460	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)oc2ccccc12>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het5Phe
ullmann_X	8461	Cc1cc2cocc2cc1Br.Brc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6
ullmann_X	8462	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1nc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Het5
ullmann_X	8463	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Het6
ullmann_X	8464	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_Het6Phe
ullmann_X	8465	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PheHet5
ullmann_X	8466	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Bromide_PheHet6
ullmann_X	8467	Cc1cc2cocc2cc1Br.Clc1cocc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het5
ullmann_X	8468	Cc1cc2cocc2cc1Br.Clc1oc2cocc2c1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het5Het5
ullmann_X	8469	Cc1cc2cocc2cc1Br.Clc1oc2ccncc2c1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het5Het6
ullmann_X	8470	Cc1cc2cocc2cc1Br.Clc1oc2ccccc2c1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het5Phe
ullmann_X	8471	Cc1cc2cocc2cc1Br.Clc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het6
ullmann_X	8472	Cc1cc2cocc2cc1Br.Clc1cc2cocc2nc1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het6Het5
ullmann_X	8473	Cc1cc2cocc2cc1Br.Clc1ncc2ccncc2c1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het6Het6
ullmann_X	8474	Cc1cc2cocc2cc1Br.Clc1ncc2ccccc2c1Cc1cc2cocc2cc1Br>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Chloride_Het6Phe
ullmann_X	8475	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cocc1I>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het5
ullmann_X	8476	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)oc2cocc12>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het5Het5
ullmann_X	8477	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)oc2ccncc12>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het5Het6
ullmann_X	8478	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)oc2ccccc12>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het5Phe
ullmann_X	8479	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cnccc1I>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het6
ullmann_X	8480	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1nc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het6Het5
ullmann_X	8481	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)ncc2ccncc12>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het6Het6
ullmann_X	8482	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1c(I)ncc2ccccc12>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_Het6Phe
ullmann_X	8483	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_PheHet5
ullmann_X	8484	Cc1cc2cocc2cc1Br.Brc1cc2cocc2cc1CCc1c(I)ccc2ccncc12>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Iodide_PheHet6
ullmann_X	8485	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het5
ullmann_X	8486	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1oc2cocc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het5Het5
ullmann_X	8487	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1oc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het5Het6
ullmann_X	8488	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1oc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het5Phe
ullmann_X	8489	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het6
ullmann_X	8490	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1cc2cocc2nc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het6Het5
ullmann_X	8491	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1ncc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het6Het6
ullmann_X	8492	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1ncc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_Het6Phe
ullmann_X	8493	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1cc2cocc2cc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1Br	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_PheHet5
ullmann_X	8494	Cc1cc2cocc2cc1Br.O=S(=O)(Oc1ccc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet5.X-Triflate_PheHet6
ullmann_X	8495	CCc1c(Br)ccc2ccncc12.Brc1ccccc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Phe
ullmann_X	8496	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PhePhe
ullmann_X	8497	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1ccccc1I>>CCc1c2cnccc2ccc1c1ccccc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Phe
ullmann_X	8498	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)ccc2ccccc12>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_PhePhe
ullmann_X	8499	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1cccc(CCc2c(Br)ccc3ccncc23)c1)C(F)(F)F>>CCc1c(c2cccc(CCc3c(Br)ccc4ccncc34)c2)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Phe
ullmann_X	8500	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_PhePhe
ullmann_X	8501	CCc1c(Br)ccc2ccncc12.Brc1cocc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5
ullmann_X	8502	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2cocc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Het5
ullmann_X	8503	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Het6
ullmann_X	8504	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)oc2ccccc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het5Phe
ullmann_X	8505	CCc1c(Br)ccc2ccncc12.Brc1ccncc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6
ullmann_X	8506	CCc1c(Br)ccc2ccncc12.Brc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Het5
ullmann_X	8507	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Het6
ullmann_X	8508	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(Br)ncc2ccccc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_Het6Phe
ullmann_X	8509	CCc1c(Br)ccc2ccncc12.Brc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PheHet5
ullmann_X	8510	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccncc2c1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Bromide_PheHet6
ullmann_X	8511	CCc1c(Br)ccc2ccncc12.Clc1cocc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het5
ullmann_X	8512	CCc1c(Br)ccc2ccncc12.Clc1oc2cocc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het5Het5
ullmann_X	8513	CCc1c(Br)ccc2ccncc12.Clc1oc2ccncc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het5Het6
ullmann_X	8514	CCc1c(Br)ccc2ccncc12.Clc1oc2ccccc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het5Phe
ullmann_X	8515	CCc1c(Br)ccc2ccncc12.Clc1ccncc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het6
ullmann_X	8516	CCc1c(Br)ccc2ccncc12.Clc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het6Het5
ullmann_X	8517	CCc1c(Br)ccc2ccncc12.Clc1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het6Het6
ullmann_X	8518	CCc1c(Br)ccc2ccncc12.Clc1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Chloride_Het6Phe
ullmann_X	8519	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1cocc1I>>CCc1c2cnccc2ccc1c1cocc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het5
ullmann_X	8520	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)oc2cocc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het5Het5
ullmann_X	8521	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)oc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het5Het6
ullmann_X	8522	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)oc2ccccc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het5Phe
ullmann_X	8523	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1cnccc1I>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het6
ullmann_X	8524	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1nc2cocc2cc1I>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het6Het5
ullmann_X	8525	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)ncc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het6Het6
ullmann_X	8526	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)ncc2ccccc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_Het6Phe
ullmann_X	8527	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCc1cc2cocc2cc1I>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_PheHet5
ullmann_X	8528	CCc1c(Br)ccc2ccncc12.Brc1ccc2ccncc2c1CCCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccncc2c1CCCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Iodide_PheHet6
ullmann_X	8529	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1cocc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cocc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het5
ullmann_X	8530	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1oc2cocc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het5Het5
ullmann_X	8531	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het5Het6
ullmann_X	8532	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het5Phe
ullmann_X	8533	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1ccncc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het6
ullmann_X	8534	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het6Het5
ullmann_X	8535	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het6Het6
ullmann_X	8536	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_Het6Phe
ullmann_X	8537	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(Br)ccc2ccncc12	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_PheHet5
ullmann_X	8538	CCc1c(Br)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1:S(=O)(=O)C(F)(F)F	[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Bromide_PheHet6.X-Triflate_PheHet6
ullmann_X	8539	Cc1cocc1Cl.Clc1cocc1Cc1ccccc1Br>>Cc1cocc1c1ccccc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Phe
ullmann_X	8540	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_PhePhe
ullmann_X	8541	Cc1cocc1Cl.Clc1cocc1Cc1ccccc1I>>Cc1cocc1c1ccccc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Phe
ullmann_X	8542	Cc1cocc1Cl.Clc1cocc1Cc1c(I)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_PhePhe
ullmann_X	8543	Cc1cocc1Cl.O=S(=O)(Oc1cccc(Cc2cocc2Cl)c1)C(F)(F)F>>Cc1cocc1c1cccc(Cc2cocc2Cl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Phe
ullmann_X	8544	Cc1cocc1Cl.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_PhePhe
ullmann_X	8545	Cc1cocc1Cl.Clc1cocc1Cc1cocc1Br>>Cc1cocc1c1cocc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het5
ullmann_X	8546	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het5Het5
ullmann_X	8547	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het5Het6
ullmann_X	8548	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het5Phe
ullmann_X	8549	Cc1cocc1Cl.Clc1cocc1Cc1cnccc1Br>>Cc1cocc1c1ccncc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het6
ullmann_X	8550	Cc1cocc1Cl.Clc1cocc1Cc1nc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het6Het5
ullmann_X	8551	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het6Het6
ullmann_X	8552	Cc1cocc1Cl.Clc1cocc1Cc1c(Br)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_Het6Phe
ullmann_X	8553	Cc1cocc1Cl.Clc1cocc1Cc1cc2cocc2cc1Br>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_PheHet5
ullmann_X	8554	Cc1cocc1Cl.Clc1cocc1CCc1c(Br)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Bromide_PheHet6
ullmann_X	8555	Cc1cocc1Cl.Clc1cocc1Cc1cocc1Cl>>Cc1cocc1c1cocc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het5
ullmann_X	8556	Cc1cocc1Cl.Clc1cocc1Cc1c(Cl)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het5Het5
ullmann_X	8557	Cc1cocc1Cl.Clc1cocc1Cc1c(Cl)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het5Het6
ullmann_X	8558	Cc1cocc1Cl.Clc1cocc1Cc1c(Cl)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het5Phe
ullmann_X	8559	Cc1cocc1Cl.Clc1ccncc1Cc1cocc1Cl>>Cc1cocc1c1ccncc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het6
ullmann_X	8560	Cc1cocc1Cl.Clc1cocc1Cc1nc2cocc2cc1Cl>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het6Het5
ullmann_X	8561	Cc1cocc1Cl.Clc1cocc1Cc1c(Cl)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het6Het6
ullmann_X	8562	Cc1cocc1Cl.Clc1cocc1Cc1c(Cl)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Chloride_Het6Phe
ullmann_X	8563	Cc1cocc1Cl.Clc1cocc1Cc1cocc1I>>Cc1cocc1c1cocc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het5
ullmann_X	8564	Cc1cocc1Cl.Clc1cocc1Cc1c(I)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het5Het5
ullmann_X	8565	Cc1cocc1Cl.Clc1cocc1Cc1c(I)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het5Het6
ullmann_X	8566	Cc1cocc1Cl.Clc1cocc1Cc1c(I)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het5Phe
ullmann_X	8567	Cc1cocc1Cl.Clc1cocc1Cc1cnccc1I>>Cc1cocc1c1ccncc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het6
ullmann_X	8568	Cc1cocc1Cl.Clc1cocc1Cc1nc2cocc2cc1I>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het6Het5
ullmann_X	8569	Cc1cocc1Cl.Clc1cocc1Cc1c(I)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het6Het6
ullmann_X	8570	Cc1cocc1Cl.Clc1cocc1Cc1c(I)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_Het6Phe
ullmann_X	8571	Cc1cocc1Cl.Clc1cocc1Cc1cc2cocc2cc1I>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_PheHet5
ullmann_X	8572	Cc1cocc1Cl.Clc1cocc1CCc1c(I)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Iodide_PheHet6
ullmann_X	8573	Cc1cocc1Cl.O=S(=O)(Oc1cocc1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het5
ullmann_X	8574	Cc1cocc1Cl.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het5Het5
ullmann_X	8575	Cc1cocc1Cl.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het5Het6
ullmann_X	8576	Cc1cocc1Cl.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het5Phe
ullmann_X	8577	Cc1cocc1Cl.O=S(=O)(Oc1ccncc1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het6
ullmann_X	8578	Cc1cocc1Cl.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het6Het5
ullmann_X	8579	Cc1cocc1Cl.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het6Het6
ullmann_X	8580	Cc1cocc1Cl.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_Het6Phe
ullmann_X	8581	Cc1cocc1Cl.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_PheHet5
ullmann_X	8582	Cc1cocc1Cl.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5.X-Triflate_PheHet6
ullmann_X	8583	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccccc1Br>>Cc1c2cocc2oc1c1ccccc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Phe
ullmann_X	8584	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_PhePhe
ullmann_X	8585	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1ccccc1I>>Cc1c2cocc2oc1c1ccccc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Phe
ullmann_X	8586	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_PhePhe
ullmann_X	8587	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3cocc23)c1)C(F)(F)F>>Cc1c2cocc2oc1c1cccc(Cc2c(Cl)oc3cocc23)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Phe
ullmann_X	8588	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_PhePhe
ullmann_X	8589	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cocc1Br>>Cc1c2cocc2oc1c1cocc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het5
ullmann_X	8590	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het5Het5
ullmann_X	8591	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het5Het6
ullmann_X	8592	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)oc2ccccc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het5Phe
ullmann_X	8593	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnccc1Br>>Cc1c2cocc2oc1c1ccncc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het6
ullmann_X	8594	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1nc2cocc2cc1Br>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het6Het5
ullmann_X	8595	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het6Het6
ullmann_X	8596	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_Het6Phe
ullmann_X	8597	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cc2cocc2cc1Br>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_PheHet5
ullmann_X	8598	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Bromide_PheHet6
ullmann_X	8599	Cc1c(Cl)oc2cocc12.Clc1cocc1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het5
ullmann_X	8600	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het5Het5
ullmann_X	8601	Cc1c(Cl)oc2cocc12.Clc1oc2ccncc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het5Het6
ullmann_X	8602	Cc1c(Cl)oc2cocc12.Clc1oc2ccccc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het5Phe
ullmann_X	8603	Cc1c(Cl)oc2cocc12.Clc1ccncc1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het6
ullmann_X	8604	Cc1c(Cl)oc2cocc12.Clc1cc2cocc2nc1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het6Het5
ullmann_X	8605	Cc1c(Cl)oc2cocc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het6Het6
ullmann_X	8606	Cc1c(Cl)oc2cocc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Chloride_Het6Phe
ullmann_X	8607	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cocc1I>>Cc1c2cocc2oc1c1cocc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het5
ullmann_X	8608	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het5Het5
ullmann_X	8609	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)oc2ccncc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het5Het6
ullmann_X	8610	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)oc2ccccc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het5Phe
ullmann_X	8611	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cnccc1I>>Cc1c2cocc2oc1c1ccncc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het6
ullmann_X	8612	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1nc2cocc2cc1I>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het6Het5
ullmann_X	8613	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het6Het6
ullmann_X	8614	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_Het6Phe
ullmann_X	8615	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1Cc1cc2cocc2cc1I>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_PheHet5
ullmann_X	8616	Cc1c(Cl)oc2cocc12.Clc1oc2cocc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Iodide_PheHet6
ullmann_X	8617	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het5
ullmann_X	8618	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het5Het5
ullmann_X	8619	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het5Het6
ullmann_X	8620	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het5Phe
ullmann_X	8621	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het6
ullmann_X	8622	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het6Het5
ullmann_X	8623	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het6Het6
ullmann_X	8624	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_Het6Phe
ullmann_X	8625	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2cocc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_PheHet5
ullmann_X	8626	Cc1c(Cl)oc2cocc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het5.X-Triflate_PheHet6
ullmann_X	8627	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccccc1Br>>Cc1c2cnccc2oc1c1ccccc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Phe
ullmann_X	8628	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_PhePhe
ullmann_X	8629	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1ccccc1I>>Cc1c2cnccc2oc1c1ccccc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Phe
ullmann_X	8630	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_PhePhe
ullmann_X	8631	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2oc1c1cccc(Cc2c(Cl)oc3ccncc23)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Phe
ullmann_X	8632	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_PhePhe
ullmann_X	8633	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cocc1Br>>Cc1c2cnccc2oc1c1cocc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het5
ullmann_X	8634	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het5Het5
ullmann_X	8635	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het5Het6
ullmann_X	8636	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het5Phe
ullmann_X	8637	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnccc1Br>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het6
ullmann_X	8638	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1nc2cocc2cc1Br>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het6Het5
ullmann_X	8639	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het6Het6
ullmann_X	8640	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_Het6Phe
ullmann_X	8641	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cc2cocc2cc1Br>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_PheHet5
ullmann_X	8642	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Bromide_PheHet6
ullmann_X	8643	Cc1c(Cl)oc2ccncc12.Clc1cocc1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het5
ullmann_X	8644	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het5Het5
ullmann_X	8645	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het5Het6
ullmann_X	8646	Cc1c(Cl)oc2ccncc12.Clc1oc2ccccc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het5Phe
ullmann_X	8647	Cc1c(Cl)oc2ccncc12.Clc1ccncc1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het6
ullmann_X	8648	Cc1c(Cl)oc2ccncc12.Clc1cc2cocc2nc1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het6Het5
ullmann_X	8649	Cc1c(Cl)oc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het6Het6
ullmann_X	8650	Cc1c(Cl)oc2ccncc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Chloride_Het6Phe
ullmann_X	8651	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cocc1I>>Cc1c2cnccc2oc1c1cocc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het5
ullmann_X	8652	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het5Het5
ullmann_X	8653	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het5Het6
ullmann_X	8654	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het5Phe
ullmann_X	8655	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cnccc1I>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het6
ullmann_X	8656	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het6Het5
ullmann_X	8657	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het6Het6
ullmann_X	8658	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_Het6Phe
ullmann_X	8659	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_PheHet5
ullmann_X	8660	Cc1c(Cl)oc2ccncc12.Clc1oc2ccncc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Iodide_PheHet6
ullmann_X	8661	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het5
ullmann_X	8662	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het5Het5
ullmann_X	8663	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het5Het6
ullmann_X	8664	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het5Phe
ullmann_X	8665	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het6
ullmann_X	8666	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het6Het5
ullmann_X	8667	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het6Het6
ullmann_X	8668	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_Het6Phe
ullmann_X	8669	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_PheHet5
ullmann_X	8670	Cc1c(Cl)oc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Het6.X-Triflate_PheHet6
ullmann_X	8671	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccccc1Br>>Cc1c2ccccc2oc1c1ccccc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Phe
ullmann_X	8672	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_PhePhe
ullmann_X	8673	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1ccccc1I>>Cc1c2ccccc2oc1c1ccccc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Phe
ullmann_X	8674	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_PhePhe
ullmann_X	8675	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(Cl)oc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2oc1c1cccc(Cc2c(Cl)oc3ccccc23)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Phe
ullmann_X	8676	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_PhePhe
ullmann_X	8677	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cocc1Br>>Cc1c2ccccc2oc1c1cocc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het5
ullmann_X	8678	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het5Het5
ullmann_X	8679	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het5Het6
ullmann_X	8680	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het5Phe
ullmann_X	8681	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnccc1Br>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het6
ullmann_X	8682	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1nc2cocc2cc1Br>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het6Het5
ullmann_X	8683	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het6Het6
ullmann_X	8684	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_Het6Phe
ullmann_X	8685	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cc2cocc2cc1Br>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_PheHet5
ullmann_X	8686	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Bromide_PheHet6
ullmann_X	8687	Cc1c(Cl)oc2ccccc12.Clc1cocc1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het5
ullmann_X	8688	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Cl)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het5Het5
ullmann_X	8689	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het5Het6
ullmann_X	8690	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het5Phe
ullmann_X	8691	Cc1c(Cl)oc2ccccc12.Clc1ccncc1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het6
ullmann_X	8692	Cc1c(Cl)oc2ccccc12.Clc1cc2cocc2nc1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het6Het5
ullmann_X	8693	Cc1c(Cl)oc2ccccc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het6Het6
ullmann_X	8694	Cc1c(Cl)oc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Chloride_Het6Phe
ullmann_X	8695	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cocc1I>>Cc1c2ccccc2oc1c1cocc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het5
ullmann_X	8696	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het5Het5
ullmann_X	8697	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het5Het6
ullmann_X	8698	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het5Phe
ullmann_X	8699	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cnccc1I>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het6
ullmann_X	8700	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het6Het5
ullmann_X	8701	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het6Het6
ullmann_X	8702	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_Het6Phe
ullmann_X	8703	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_PheHet5
ullmann_X	8704	Cc1c(Cl)oc2ccccc12.Clc1oc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Iodide_PheHet6
ullmann_X	8705	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het5
ullmann_X	8706	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het5Het5
ullmann_X	8707	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het5Het6
ullmann_X	8708	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het5Phe
ullmann_X	8709	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het6
ullmann_X	8710	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het6Het5
ullmann_X	8711	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het6Het6
ullmann_X	8712	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_Het6Phe
ullmann_X	8713	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(Cl)oc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_PheHet5
ullmann_X	8714	Cc1c(Cl)oc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het5Phe.X-Triflate_PheHet6
ullmann_X	8715	Cc1cnccc1Cl.Clc1ccncc1Cc1ccccc1Br>>Cc1cnccc1c1ccccc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Phe
ullmann_X	8716	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_PhePhe
ullmann_X	8717	Cc1cnccc1Cl.Clc1ccncc1Cc1ccccc1I>>Cc1cnccc1c1ccccc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Phe
ullmann_X	8718	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_PhePhe
ullmann_X	8719	Cc1cnccc1Cl.O=S(=O)(Oc1cccc(Cc2cnccc2Cl)c1)C(F)(F)F>>Cc1cnccc1c1cccc(Cc2cnccc2Cl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Phe
ullmann_X	8720	Cc1cnccc1Cl.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_PhePhe
ullmann_X	8721	Cc1cnccc1Cl.Clc1ccncc1Cc1cocc1Br>>Cc1cnccc1c1cocc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het5
ullmann_X	8722	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het5Het5
ullmann_X	8723	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het5Het6
ullmann_X	8724	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het5Phe
ullmann_X	8725	Cc1cnccc1Cl.Clc1ccncc1Cc1cnccc1Br>>Cc1cnccc1c1ccncc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het6
ullmann_X	8726	Cc1cnccc1Cl.Clc1ccncc1Cc1nc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het6Het5
ullmann_X	8727	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het6Het6
ullmann_X	8728	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Br)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_Het6Phe
ullmann_X	8729	Cc1cnccc1Cl.Clc1ccncc1Cc1cc2cocc2cc1Br>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_PheHet5
ullmann_X	8730	Cc1cnccc1Cl.Clc1ccncc1CCc1c(Br)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Bromide_PheHet6
ullmann_X	8731	Cc1cnccc1Cl.Clc1ccncc1Cc1cocc1Cl>>Cc1cnccc1c1cocc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het5
ullmann_X	8732	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Cl)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het5Het5
ullmann_X	8733	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Cl)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het5Het6
ullmann_X	8734	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Cl)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het5Phe
ullmann_X	8735	Cc1cnccc1Cl.Clc1ccncc1Cc1cnccc1Cl>>Cc1cnccc1c1ccncc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het6
ullmann_X	8736	Cc1cnccc1Cl.Clc1ccncc1Cc1nc2cocc2cc1Cl>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het6Het5
ullmann_X	8737	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Cl)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het6Het6
ullmann_X	8738	Cc1cnccc1Cl.Clc1ccncc1Cc1c(Cl)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Chloride_Het6Phe
ullmann_X	8739	Cc1cnccc1Cl.Clc1ccncc1Cc1cocc1I>>Cc1cnccc1c1cocc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het5
ullmann_X	8740	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het5Het5
ullmann_X	8741	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het5Het6
ullmann_X	8742	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het5Phe
ullmann_X	8743	Cc1cnccc1Cl.Clc1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het6
ullmann_X	8744	Cc1cnccc1Cl.Clc1ccncc1Cc1nc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het6Het5
ullmann_X	8745	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het6Het6
ullmann_X	8746	Cc1cnccc1Cl.Clc1ccncc1Cc1c(I)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_Het6Phe
ullmann_X	8747	Cc1cnccc1Cl.Clc1ccncc1Cc1cc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_PheHet5
ullmann_X	8748	Cc1cnccc1Cl.Clc1ccncc1CCc1c(I)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Iodide_PheHet6
ullmann_X	8749	Cc1cnccc1Cl.O=S(=O)(Oc1cocc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het5
ullmann_X	8750	Cc1cnccc1Cl.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het5Het5
ullmann_X	8751	Cc1cnccc1Cl.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het5Het6
ullmann_X	8752	Cc1cnccc1Cl.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het5Phe
ullmann_X	8753	Cc1cnccc1Cl.O=S(=O)(Oc1ccncc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het6
ullmann_X	8754	Cc1cnccc1Cl.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het6Het5
ullmann_X	8755	Cc1cnccc1Cl.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het6Het6
ullmann_X	8756	Cc1cnccc1Cl.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_Het6Phe
ullmann_X	8757	Cc1cnccc1Cl.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_PheHet5
ullmann_X	8758	Cc1cnccc1Cl.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6.X-Triflate_PheHet6
ullmann_X	8759	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccccc1Br>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Phe
ullmann_X	8760	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_PhePhe
ullmann_X	8761	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1ccccc1I>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Phe
ullmann_X	8762	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_PhePhe
ullmann_X	8763	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2Cl)c1)C(F)(F)F>>Cc1nc2cocc2cc1c1cccc(Cc2nc3cocc3cc2Cl)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Phe
ullmann_X	8764	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_PhePhe
ullmann_X	8765	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cocc1Br>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het5
ullmann_X	8766	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het5Het5
ullmann_X	8767	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het5Het6
ullmann_X	8768	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het5Phe
ullmann_X	8769	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnccc1Br>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het6
ullmann_X	8770	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1nc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het6Het5
ullmann_X	8771	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het6Het6
ullmann_X	8772	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_Het6Phe
ullmann_X	8773	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cc2cocc2cc1Br>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_PheHet5
ullmann_X	8774	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Bromide_PheHet6
ullmann_X	8775	Cc1nc2cocc2cc1Cl.Clc1cocc1Cc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het5
ullmann_X	8776	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Cl)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het5Het5
ullmann_X	8777	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Cl)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het5Het6
ullmann_X	8778	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Cl)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het5Phe
ullmann_X	8779	Cc1nc2cocc2cc1Cl.Clc1ccncc1Cc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het6
ullmann_X	8780	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1nc2cocc2cc1Cl>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het6Het5
ullmann_X	8781	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het6Het6
ullmann_X	8782	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Chloride_Het6Phe
ullmann_X	8783	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cocc1I>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het5
ullmann_X	8784	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het5Het5
ullmann_X	8785	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het5Het6
ullmann_X	8786	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het5Phe
ullmann_X	8787	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cnccc1I>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het6
ullmann_X	8788	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het6Het5
ullmann_X	8789	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het6Het6
ullmann_X	8790	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_Het6Phe
ullmann_X	8791	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1Cc1cc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_PheHet5
ullmann_X	8792	Cc1nc2cocc2cc1Cl.Clc1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Iodide_PheHet6
ullmann_X	8793	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het5
ullmann_X	8794	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het5Het5
ullmann_X	8795	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het5Het6
ullmann_X	8796	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het5Phe
ullmann_X	8797	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het6
ullmann_X	8798	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het6Het5
ullmann_X	8799	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het6Het6
ullmann_X	8800	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_Het6Phe
ullmann_X	8801	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1Cl	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_PheHet5
ullmann_X	8802	Cc1nc2cocc2cc1Cl.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het5.X-Triflate_PheHet6
ullmann_X	8803	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccccc1Br>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Phe
ullmann_X	8804	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_PhePhe
ullmann_X	8805	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1ccccc1I>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Phe
ullmann_X	8806	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_PhePhe
ullmann_X	8807	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(Cl)ncc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2cnc1c1cccc(Cc2c(Cl)ncc3ccncc23)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Phe
ullmann_X	8808	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_PhePhe
ullmann_X	8809	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cocc1Br>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het5
ullmann_X	8810	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het5Het5
ullmann_X	8811	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het5Het6
ullmann_X	8812	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het5Phe
ullmann_X	8813	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnccc1Br>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het6
ullmann_X	8814	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1nc2cocc2cc1Br>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het6Het5
ullmann_X	8815	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het6Het6
ullmann_X	8816	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_Het6Phe
ullmann_X	8817	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cc2cocc2cc1Br>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_PheHet5
ullmann_X	8818	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Bromide_PheHet6
ullmann_X	8819	Cc1c(Cl)ncc2ccncc12.Clc1cocc1Cc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het5
ullmann_X	8820	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het5Het5
ullmann_X	8821	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het5Het6
ullmann_X	8822	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het5Phe
ullmann_X	8823	Cc1c(Cl)ncc2ccncc12.Clc1ccncc1Cc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het6
ullmann_X	8824	Cc1c(Cl)ncc2ccncc12.Clc1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het6Het5
ullmann_X	8825	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het6Het6
ullmann_X	8826	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Chloride_Het6Phe
ullmann_X	8827	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cocc1I>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het5
ullmann_X	8828	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het5Het5
ullmann_X	8829	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het5Het6
ullmann_X	8830	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het5Phe
ullmann_X	8831	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cnccc1I>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het6
ullmann_X	8832	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het6Het5
ullmann_X	8833	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het6Het6
ullmann_X	8834	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_Het6Phe
ullmann_X	8835	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_PheHet5
ullmann_X	8836	Cc1c(Cl)ncc2ccncc12.Clc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Iodide_PheHet6
ullmann_X	8837	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het5
ullmann_X	8838	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het5Het5
ullmann_X	8839	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het5Het6
ullmann_X	8840	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het5Phe
ullmann_X	8841	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het6
ullmann_X	8842	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het6Het5
ullmann_X	8843	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het6Het6
ullmann_X	8844	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_Het6Phe
ullmann_X	8845	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccncc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_PheHet5
ullmann_X	8846	Cc1c(Cl)ncc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Het6.X-Triflate_PheHet6
ullmann_X	8847	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccccc1Br>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Phe
ullmann_X	8848	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_PhePhe
ullmann_X	8849	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1ccccc1I>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Phe
ullmann_X	8850	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_PhePhe
ullmann_X	8851	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(Cl)ncc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2cnc1c1cccc(Cc2c(Cl)ncc3ccccc23)c1	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Phe
ullmann_X	8852	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_PhePhe
ullmann_X	8853	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cocc1Br>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het5
ullmann_X	8854	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het5Het5
ullmann_X	8855	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het5Het6
ullmann_X	8856	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het5Phe
ullmann_X	8857	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnccc1Br>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het6
ullmann_X	8858	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1nc2cocc2cc1Br>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het6Het5
ullmann_X	8859	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het6Het6
ullmann_X	8860	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_Het6Phe
ullmann_X	8861	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cc2cocc2cc1Br>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_PheHet5
ullmann_X	8862	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Bromide_PheHet6
ullmann_X	8863	Cc1c(Cl)ncc2ccccc12.Clc1cocc1Cc1c(Cl)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het5
ullmann_X	8864	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het5Het5
ullmann_X	8865	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het5Het6
ullmann_X	8866	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het5Phe
ullmann_X	8867	Cc1c(Cl)ncc2ccccc12.Clc1ccncc1Cc1c(Cl)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het6
ullmann_X	8868	Cc1c(Cl)ncc2ccccc12.Clc1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het6Het5
ullmann_X	8869	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het6Het6
ullmann_X	8870	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Chloride_Het6Phe
ullmann_X	8871	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cocc1I>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het5
ullmann_X	8872	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het5Het5
ullmann_X	8873	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het5Het6
ullmann_X	8874	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het5Phe
ullmann_X	8875	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cnccc1I>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het6
ullmann_X	8876	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het6Het5
ullmann_X	8877	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het6Het6
ullmann_X	8878	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_Het6Phe
ullmann_X	8879	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_PheHet5
ullmann_X	8880	Cc1c(Cl)ncc2ccccc12.Clc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Iodide_PheHet6
ullmann_X	8881	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het5
ullmann_X	8882	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het5Het5
ullmann_X	8883	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het5Het6
ullmann_X	8884	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het5Phe
ullmann_X	8885	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het6
ullmann_X	8886	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het6Het5
ullmann_X	8887	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het6Het6
ullmann_X	8888	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_Het6Phe
ullmann_X	8889	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(Cl)ncc2ccccc12	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_PheHet5
ullmann_X	8890	Cc1c(Cl)ncc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Chloride_Het6Phe.X-Triflate_PheHet6
ullmann_X	8891	Cc1cocc1I.Brc1ccccc1Cc1cocc1I>>Cc1cocc1c1ccccc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Phe
ullmann_X	8892	Cc1cocc1I.Brc1ccc2ccccc2c1Cc1cocc1I>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_PhePhe
ullmann_X	8893	Cc1cocc1I.Ic1ccccc1Cc1cocc1I>>Cc1cocc1c1ccccc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Phe
ullmann_X	8894	Cc1cocc1I.Ic1cocc1Cc1c(I)ccc2ccccc12>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_PhePhe
ullmann_X	8895	Cc1cocc1I.O=S(=O)(Oc1cccc(Cc2cocc2I)c1)C(F)(F)F>>Cc1cocc1c1cccc(Cc2cocc2I)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Phe
ullmann_X	8896	Cc1cocc1I.O=S(=O)(Oc1ccc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_PhePhe
ullmann_X	8897	Cc1cocc1I.Brc1cocc1Cc1cocc1I>>Cc1cocc1c1cocc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het5
ullmann_X	8898	Cc1cocc1I.Brc1oc2cocc2c1Cc1cocc1I>>Cc1cocc1c1oc2cocc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het5Het5
ullmann_X	8899	Cc1cocc1I.Brc1oc2ccncc2c1Cc1cocc1I>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het5Het6
ullmann_X	8900	Cc1cocc1I.Brc1oc2ccccc2c1Cc1cocc1I>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het5Phe
ullmann_X	8901	Cc1cocc1I.Brc1ccncc1Cc1cocc1I>>Cc1cocc1c1ccncc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het6
ullmann_X	8902	Cc1cocc1I.Brc1cc2cocc2nc1Cc1cocc1I>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het6Het5
ullmann_X	8903	Cc1cocc1I.Brc1ncc2ccncc2c1Cc1cocc1I>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het6Het6
ullmann_X	8904	Cc1cocc1I.Brc1ncc2ccccc2c1Cc1cocc1I>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_Het6Phe
ullmann_X	8905	Cc1cocc1I.Brc1cc2cocc2cc1Cc1cocc1I>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_PheHet5
ullmann_X	8906	Cc1cocc1I.Brc1ccc2ccncc2c1CCc1cocc1I>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Bromide_PheHet6
ullmann_X	8907	Cc1cocc1I.Clc1cocc1Cc1cocc1I>>Cc1cocc1c1cocc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het5
ullmann_X	8908	Cc1cocc1I.Clc1oc2cocc2c1Cc1cocc1I>>Cc1cocc1c1oc2cocc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het5Het5
ullmann_X	8909	Cc1cocc1I.Clc1oc2ccncc2c1Cc1cocc1I>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het5Het6
ullmann_X	8910	Cc1cocc1I.Clc1oc2ccccc2c1Cc1cocc1I>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het5Phe
ullmann_X	8911	Cc1cocc1I.Clc1ccncc1Cc1cocc1I>>Cc1cocc1c1ccncc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het6
ullmann_X	8912	Cc1cocc1I.Clc1cc2cocc2nc1Cc1cocc1I>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het6Het5
ullmann_X	8913	Cc1cocc1I.Clc1ncc2ccncc2c1Cc1cocc1I>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het6Het6
ullmann_X	8914	Cc1cocc1I.Clc1ncc2ccccc2c1Cc1cocc1I>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Chloride_Het6Phe
ullmann_X	8915	Cc1cocc1I.Ic1cocc1Cc1cocc1I>>Cc1cocc1c1cocc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het5
ullmann_X	8916	Cc1cocc1I.Ic1cocc1Cc1c(I)oc2cocc12>>Cc1cocc1c1oc2cocc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het5Het5
ullmann_X	8917	Cc1cocc1I.Ic1cocc1Cc1c(I)oc2ccncc12>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het5Het6
ullmann_X	8918	Cc1cocc1I.Ic1cocc1Cc1c(I)oc2ccccc12>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het5Phe
ullmann_X	8919	Cc1cocc1I.Ic1ccncc1Cc1cocc1I>>Cc1cocc1c1ccncc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het6
ullmann_X	8920	Cc1cocc1I.Ic1cocc1Cc1nc2cocc2cc1I>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het6Het5
ullmann_X	8921	Cc1cocc1I.Ic1cocc1Cc1c(I)ncc2ccncc12>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het6Het6
ullmann_X	8922	Cc1cocc1I.Ic1cocc1Cc1c(I)ncc2ccccc12>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_Het6Phe
ullmann_X	8923	Cc1cocc1I.Ic1cocc1Cc1cc2cocc2cc1I>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_PheHet5
ullmann_X	8924	Cc1cocc1I.Ic1cocc1CCc1c(I)ccc2ccncc12>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Iodide_PheHet6
ullmann_X	8925	Cc1cocc1I.O=S(=O)(Oc1cocc1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het5
ullmann_X	8926	Cc1cocc1I.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het5Het5
ullmann_X	8927	Cc1cocc1I.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het5Het6
ullmann_X	8928	Cc1cocc1I.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het5Phe
ullmann_X	8929	Cc1cocc1I.O=S(=O)(Oc1ccncc1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het6
ullmann_X	8930	Cc1cocc1I.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het6Het5
ullmann_X	8931	Cc1cocc1I.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het6Het6
ullmann_X	8932	Cc1cocc1I.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_Het6Phe
ullmann_X	8933	Cc1cocc1I.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_PheHet5
ullmann_X	8934	Cc1cocc1I.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1cocc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5.X-Triflate_PheHet6
ullmann_X	8935	Cc1c(I)oc2cocc12.Brc1ccccc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Phe
ullmann_X	8936	Cc1c(I)oc2cocc12.Brc1ccc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_PhePhe
ullmann_X	8937	Cc1c(I)oc2cocc12.Ic1ccccc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccccc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Phe
ullmann_X	8938	Cc1c(I)oc2cocc12.Ic1ccc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_PhePhe
ullmann_X	8939	Cc1c(I)oc2cocc12.O=S(=O)(Oc1cccc(Cc2c(I)oc3cocc23)c1)C(F)(F)F>>Cc1c2cocc2oc1c1cccc(Cc2c(I)oc3cocc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Phe
ullmann_X	8940	Cc1c(I)oc2cocc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_PhePhe
ullmann_X	8941	Cc1c(I)oc2cocc12.Brc1cocc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het5
ullmann_X	8942	Cc1c(I)oc2cocc12.Brc1oc2cocc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het5Het5
ullmann_X	8943	Cc1c(I)oc2cocc12.Brc1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het5Het6
ullmann_X	8944	Cc1c(I)oc2cocc12.Brc1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het5Phe
ullmann_X	8945	Cc1c(I)oc2cocc12.Brc1ccncc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het6
ullmann_X	8946	Cc1c(I)oc2cocc12.Brc1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het6Het5
ullmann_X	8947	Cc1c(I)oc2cocc12.Brc1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het6Het6
ullmann_X	8948	Cc1c(I)oc2cocc12.Brc1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_Het6Phe
ullmann_X	8949	Cc1c(I)oc2cocc12.Brc1cc2cocc2cc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_PheHet5
ullmann_X	8950	Cc1c(I)oc2cocc12.Brc1ccc2ccncc2c1CCc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Bromide_PheHet6
ullmann_X	8951	Cc1c(I)oc2cocc12.Clc1cocc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het5
ullmann_X	8952	Cc1c(I)oc2cocc12.Clc1oc2cocc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het5Het5
ullmann_X	8953	Cc1c(I)oc2cocc12.Clc1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het5Het6
ullmann_X	8954	Cc1c(I)oc2cocc12.Clc1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het5Phe
ullmann_X	8955	Cc1c(I)oc2cocc12.Clc1ccncc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het6
ullmann_X	8956	Cc1c(I)oc2cocc12.Clc1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het6Het5
ullmann_X	8957	Cc1c(I)oc2cocc12.Clc1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het6Het6
ullmann_X	8958	Cc1c(I)oc2cocc12.Clc1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Chloride_Het6Phe
ullmann_X	8959	Cc1c(I)oc2cocc12.Ic1cocc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cocc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het5
ullmann_X	8960	Cc1c(I)oc2cocc12.Ic1oc2cocc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het5Het5
ullmann_X	8961	Cc1c(I)oc2cocc12.Ic1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het5Het6
ullmann_X	8962	Cc1c(I)oc2cocc12.Ic1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het5Phe
ullmann_X	8963	Cc1c(I)oc2cocc12.Ic1ccncc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccncc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het6
ullmann_X	8964	Cc1c(I)oc2cocc12.Ic1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het6Het5
ullmann_X	8965	Cc1c(I)oc2cocc12.Ic1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het6Het6
ullmann_X	8966	Cc1c(I)oc2cocc12.Ic1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_Het6Phe
ullmann_X	8967	Cc1c(I)oc2cocc12.Ic1cc2cocc2cc1Cc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_PheHet5
ullmann_X	8968	Cc1c(I)oc2cocc12.Ic1ccc2ccncc2c1CCc1c(I)oc2cocc12>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Iodide_PheHet6
ullmann_X	8969	Cc1c(I)oc2cocc12.O=S(=O)(Oc1cocc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het5
ullmann_X	8970	Cc1c(I)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het5Het5
ullmann_X	8971	Cc1c(I)oc2cocc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het5Het6
ullmann_X	8972	Cc1c(I)oc2cocc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het5Phe
ullmann_X	8973	Cc1c(I)oc2cocc12.O=S(=O)(Oc1ccncc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het6
ullmann_X	8974	Cc1c(I)oc2cocc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het6Het5
ullmann_X	8975	Cc1c(I)oc2cocc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het6Het6
ullmann_X	8976	Cc1c(I)oc2cocc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_Het6Phe
ullmann_X	8977	Cc1c(I)oc2cocc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(I)oc2cocc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_PheHet5
ullmann_X	8978	Cc1c(I)oc2cocc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het5.X-Triflate_PheHet6
ullmann_X	8979	Cc1c(I)oc2ccncc12.Brc1ccccc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Phe
ullmann_X	8980	Cc1c(I)oc2ccncc12.Brc1ccc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_PhePhe
ullmann_X	8981	Cc1c(I)oc2ccncc12.Ic1ccccc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccccc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Phe
ullmann_X	8982	Cc1c(I)oc2ccncc12.Ic1ccc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_PhePhe
ullmann_X	8983	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(I)oc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2oc1c1cccc(Cc2c(I)oc3ccncc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Phe
ullmann_X	8984	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_PhePhe
ullmann_X	8985	Cc1c(I)oc2ccncc12.Brc1cocc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het5
ullmann_X	8986	Cc1c(I)oc2ccncc12.Brc1oc2cocc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het5Het5
ullmann_X	8987	Cc1c(I)oc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het5Het6
ullmann_X	8988	Cc1c(I)oc2ccncc12.Brc1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het5Phe
ullmann_X	8989	Cc1c(I)oc2ccncc12.Brc1ccncc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het6
ullmann_X	8990	Cc1c(I)oc2ccncc12.Brc1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het6Het5
ullmann_X	8991	Cc1c(I)oc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het6Het6
ullmann_X	8992	Cc1c(I)oc2ccncc12.Brc1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_Het6Phe
ullmann_X	8993	Cc1c(I)oc2ccncc12.Brc1cc2cocc2cc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_PheHet5
ullmann_X	8994	Cc1c(I)oc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Bromide_PheHet6
ullmann_X	8995	Cc1c(I)oc2ccncc12.Clc1cocc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het5
ullmann_X	8996	Cc1c(I)oc2ccncc12.Clc1oc2cocc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het5Het5
ullmann_X	8997	Cc1c(I)oc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het5Het6
ullmann_X	8998	Cc1c(I)oc2ccncc12.Clc1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het5Phe
ullmann_X	8999	Cc1c(I)oc2ccncc12.Clc1ccncc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het6
ullmann_X	9000	Cc1c(I)oc2ccncc12.Clc1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het6Het5
ullmann_X	9001	Cc1c(I)oc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het6Het6
ullmann_X	9002	Cc1c(I)oc2ccncc12.Clc1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Chloride_Het6Phe
ullmann_X	9003	Cc1c(I)oc2ccncc12.Ic1cocc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cocc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het5
ullmann_X	9004	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het5Het5
ullmann_X	9005	Cc1c(I)oc2ccncc12.Ic1oc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het5Het6
ullmann_X	9006	Cc1c(I)oc2ccncc12.Ic1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het5Phe
ullmann_X	9007	Cc1c(I)oc2ccncc12.Ic1ccncc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccncc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het6
ullmann_X	9008	Cc1c(I)oc2ccncc12.Ic1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het6Het5
ullmann_X	9009	Cc1c(I)oc2ccncc12.Ic1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het6Het6
ullmann_X	9010	Cc1c(I)oc2ccncc12.Ic1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_Het6Phe
ullmann_X	9011	Cc1c(I)oc2ccncc12.Ic1cc2cocc2cc1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_PheHet5
ullmann_X	9012	Cc1c(I)oc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)oc2ccncc12>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Iodide_PheHet6
ullmann_X	9013	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het5
ullmann_X	9014	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het5Het5
ullmann_X	9015	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het5Het6
ullmann_X	9016	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het5Phe
ullmann_X	9017	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het6
ullmann_X	9018	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het6Het5
ullmann_X	9019	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het6Het6
ullmann_X	9020	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_Het6Phe
ullmann_X	9021	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_PheHet5
ullmann_X	9022	Cc1c(I)oc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Het6.X-Triflate_PheHet6
ullmann_X	9023	Cc1c(I)oc2ccccc12.Brc1ccccc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Phe
ullmann_X	9024	Cc1c(I)oc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_PhePhe
ullmann_X	9025	Cc1c(I)oc2ccccc12.Ic1ccccc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccccc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Phe
ullmann_X	9026	Cc1c(I)oc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_PhePhe
ullmann_X	9027	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(I)oc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2oc1c1cccc(Cc2c(I)oc3ccccc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Phe
ullmann_X	9028	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_PhePhe
ullmann_X	9029	Cc1c(I)oc2ccccc12.Brc1cocc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het5
ullmann_X	9030	Cc1c(I)oc2ccccc12.Brc1oc2cocc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het5Het5
ullmann_X	9031	Cc1c(I)oc2ccccc12.Brc1oc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het5Het6
ullmann_X	9032	Cc1c(I)oc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het5Phe
ullmann_X	9033	Cc1c(I)oc2ccccc12.Brc1ccncc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het6
ullmann_X	9034	Cc1c(I)oc2ccccc12.Brc1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het6Het5
ullmann_X	9035	Cc1c(I)oc2ccccc12.Brc1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het6Het6
ullmann_X	9036	Cc1c(I)oc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_Het6Phe
ullmann_X	9037	Cc1c(I)oc2ccccc12.Brc1cc2cocc2cc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_PheHet5
ullmann_X	9038	Cc1c(I)oc2ccccc12.Brc1ccc2ccncc2c1CCc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Bromide_PheHet6
ullmann_X	9039	Cc1c(I)oc2ccccc12.Clc1cocc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het5
ullmann_X	9040	Cc1c(I)oc2ccccc12.Clc1oc2cocc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het5Het5
ullmann_X	9041	Cc1c(I)oc2ccccc12.Clc1oc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het5Het6
ullmann_X	9042	Cc1c(I)oc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het5Phe
ullmann_X	9043	Cc1c(I)oc2ccccc12.Clc1ccncc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het6
ullmann_X	9044	Cc1c(I)oc2ccccc12.Clc1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het6Het5
ullmann_X	9045	Cc1c(I)oc2ccccc12.Clc1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het6Het6
ullmann_X	9046	Cc1c(I)oc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Chloride_Het6Phe
ullmann_X	9047	Cc1c(I)oc2ccccc12.Ic1cocc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cocc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het5
ullmann_X	9048	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het5Het5
ullmann_X	9049	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het5Het6
ullmann_X	9050	Cc1c(I)oc2ccccc12.Ic1oc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het5Phe
ullmann_X	9051	Cc1c(I)oc2ccccc12.Ic1ccncc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccncc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het6
ullmann_X	9052	Cc1c(I)oc2ccccc12.Ic1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het6Het5
ullmann_X	9053	Cc1c(I)oc2ccccc12.Ic1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het6Het6
ullmann_X	9054	Cc1c(I)oc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_Het6Phe
ullmann_X	9055	Cc1c(I)oc2ccccc12.Ic1cc2cocc2cc1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_PheHet5
ullmann_X	9056	Cc1c(I)oc2ccccc12.Ic1ccc2ccncc2c1CCc1c(I)oc2ccccc12>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Iodide_PheHet6
ullmann_X	9057	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het5
ullmann_X	9058	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het5Het5
ullmann_X	9059	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het5Het6
ullmann_X	9060	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het5Phe
ullmann_X	9061	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het6
ullmann_X	9062	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het6Het5
ullmann_X	9063	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het6Het6
ullmann_X	9064	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_Het6Phe
ullmann_X	9065	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(I)oc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_PheHet5
ullmann_X	9066	Cc1c(I)oc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het5Phe.X-Triflate_PheHet6
ullmann_X	9067	Cc1cnccc1I.Brc1ccccc1Cc1cnccc1I>>Cc1cnccc1c1ccccc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Phe
ullmann_X	9068	Cc1cnccc1I.Brc1ccc2ccccc2c1Cc1cnccc1I>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_PhePhe
ullmann_X	9069	Cc1cnccc1I.Ic1ccccc1Cc1cnccc1I>>Cc1cnccc1c1ccccc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Phe
ullmann_X	9070	Cc1cnccc1I.Ic1ccncc1Cc1c(I)ccc2ccccc12>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_PhePhe
ullmann_X	9071	Cc1cnccc1I.O=S(=O)(Oc1cccc(Cc2cnccc2I)c1)C(F)(F)F>>Cc1cnccc1c1cccc(Cc2cnccc2I)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Phe
ullmann_X	9072	Cc1cnccc1I.O=S(=O)(Oc1ccc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_PhePhe
ullmann_X	9073	Cc1cnccc1I.Brc1cocc1Cc1cnccc1I>>Cc1cnccc1c1cocc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het5
ullmann_X	9074	Cc1cnccc1I.Brc1oc2cocc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het5Het5
ullmann_X	9075	Cc1cnccc1I.Brc1oc2ccncc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het5Het6
ullmann_X	9076	Cc1cnccc1I.Brc1oc2ccccc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het5Phe
ullmann_X	9077	Cc1cnccc1I.Brc1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het6
ullmann_X	9078	Cc1cnccc1I.Brc1cc2cocc2nc1Cc1cnccc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het6Het5
ullmann_X	9079	Cc1cnccc1I.Brc1ncc2ccncc2c1Cc1cnccc1I>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het6Het6
ullmann_X	9080	Cc1cnccc1I.Brc1ncc2ccccc2c1Cc1cnccc1I>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_Het6Phe
ullmann_X	9081	Cc1cnccc1I.Brc1cc2cocc2cc1Cc1cnccc1I>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_PheHet5
ullmann_X	9082	Cc1cnccc1I.Brc1ccc2ccncc2c1CCc1cnccc1I>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Bromide_PheHet6
ullmann_X	9083	Cc1cnccc1I.Clc1cocc1Cc1cnccc1I>>Cc1cnccc1c1cocc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het5
ullmann_X	9084	Cc1cnccc1I.Clc1oc2cocc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het5Het5
ullmann_X	9085	Cc1cnccc1I.Clc1oc2ccncc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het5Het6
ullmann_X	9086	Cc1cnccc1I.Clc1oc2ccccc2c1Cc1cnccc1I>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het5Phe
ullmann_X	9087	Cc1cnccc1I.Clc1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het6
ullmann_X	9088	Cc1cnccc1I.Clc1cc2cocc2nc1Cc1cnccc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het6Het5
ullmann_X	9089	Cc1cnccc1I.Clc1ncc2ccncc2c1Cc1cnccc1I>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het6Het6
ullmann_X	9090	Cc1cnccc1I.Clc1ncc2ccccc2c1Cc1cnccc1I>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Chloride_Het6Phe
ullmann_X	9091	Cc1cnccc1I.Ic1ccncc1Cc1cocc1I>>Cc1cnccc1c1cocc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het5
ullmann_X	9092	Cc1cnccc1I.Ic1ccncc1Cc1c(I)oc2cocc12>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het5Het5
ullmann_X	9093	Cc1cnccc1I.Ic1ccncc1Cc1c(I)oc2ccncc12>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het5Het6
ullmann_X	9094	Cc1cnccc1I.Ic1ccncc1Cc1c(I)oc2ccccc12>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het5Phe
ullmann_X	9095	Cc1cnccc1I.Ic1ccncc1Cc1cnccc1I>>Cc1cnccc1c1ccncc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het6
ullmann_X	9096	Cc1cnccc1I.Ic1ccncc1Cc1nc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het6Het5
ullmann_X	9097	Cc1cnccc1I.Ic1ccncc1Cc1c(I)ncc2ccncc12>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het6Het6
ullmann_X	9098	Cc1cnccc1I.Ic1ccncc1Cc1c(I)ncc2ccccc12>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_Het6Phe
ullmann_X	9099	Cc1cnccc1I.Ic1ccncc1Cc1cc2cocc2cc1I>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_PheHet5
ullmann_X	9100	Cc1cnccc1I.Ic1ccncc1CCc1c(I)ccc2ccncc12>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Iodide_PheHet6
ullmann_X	9101	Cc1cnccc1I.O=S(=O)(Oc1cocc1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het5
ullmann_X	9102	Cc1cnccc1I.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het5Het5
ullmann_X	9103	Cc1cnccc1I.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het5Het6
ullmann_X	9104	Cc1cnccc1I.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het5Phe
ullmann_X	9105	Cc1cnccc1I.O=S(=O)(Oc1ccncc1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het6
ullmann_X	9106	Cc1cnccc1I.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het6Het5
ullmann_X	9107	Cc1cnccc1I.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het6Het6
ullmann_X	9108	Cc1cnccc1I.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_Het6Phe
ullmann_X	9109	Cc1cnccc1I.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_PheHet5
ullmann_X	9110	Cc1cnccc1I.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6.X-Triflate_PheHet6
ullmann_X	9111	Cc1nc2cocc2cc1I.Brc1ccccc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Phe
ullmann_X	9112	Cc1nc2cocc2cc1I.Brc1ccc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_PhePhe
ullmann_X	9113	Cc1nc2cocc2cc1I.Ic1ccccc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Phe
ullmann_X	9114	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)ccc2ccccc12>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_PhePhe
ullmann_X	9115	Cc1nc2cocc2cc1I.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2I)c1)C(F)(F)F>>Cc1nc2cocc2cc1c1cccc(Cc2nc3cocc3cc2I)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Phe
ullmann_X	9116	Cc1nc2cocc2cc1I.O=S(=O)(Oc1ccc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_PhePhe
ullmann_X	9117	Cc1nc2cocc2cc1I.Brc1cocc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het5
ullmann_X	9118	Cc1nc2cocc2cc1I.Brc1oc2cocc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het5Het5
ullmann_X	9119	Cc1nc2cocc2cc1I.Brc1oc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het5Het6
ullmann_X	9120	Cc1nc2cocc2cc1I.Brc1oc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het5Phe
ullmann_X	9121	Cc1nc2cocc2cc1I.Brc1ccncc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het6
ullmann_X	9122	Cc1nc2cocc2cc1I.Brc1cc2cocc2nc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het6Het5
ullmann_X	9123	Cc1nc2cocc2cc1I.Brc1ncc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het6Het6
ullmann_X	9124	Cc1nc2cocc2cc1I.Brc1ncc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_Het6Phe
ullmann_X	9125	Cc1nc2cocc2cc1I.Brc1cc2cocc2cc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_PheHet5
ullmann_X	9126	Cc1nc2cocc2cc1I.Brc1ccc2ccncc2c1CCc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Bromide_PheHet6
ullmann_X	9127	Cc1nc2cocc2cc1I.Clc1cocc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het5
ullmann_X	9128	Cc1nc2cocc2cc1I.Clc1oc2cocc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het5Het5
ullmann_X	9129	Cc1nc2cocc2cc1I.Clc1oc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het5Het6
ullmann_X	9130	Cc1nc2cocc2cc1I.Clc1oc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het5Phe
ullmann_X	9131	Cc1nc2cocc2cc1I.Clc1ccncc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het6
ullmann_X	9132	Cc1nc2cocc2cc1I.Clc1cc2cocc2nc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het6Het5
ullmann_X	9133	Cc1nc2cocc2cc1I.Clc1ncc2ccncc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het6Het6
ullmann_X	9134	Cc1nc2cocc2cc1I.Clc1ncc2ccccc2c1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Chloride_Het6Phe
ullmann_X	9135	Cc1nc2cocc2cc1I.Ic1cocc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het5
ullmann_X	9136	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)oc2cocc12>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het5Het5
ullmann_X	9137	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)oc2ccncc12>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het5Het6
ullmann_X	9138	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)oc2ccccc12>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het5Phe
ullmann_X	9139	Cc1nc2cocc2cc1I.Ic1ccncc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het6
ullmann_X	9140	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het6Het5
ullmann_X	9141	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het6Het6
ullmann_X	9142	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_Het6Phe
ullmann_X	9143	Cc1nc2cocc2cc1I.Ic1cc2cocc2cc1Cc1nc2cocc2cc1I>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_PheHet5
ullmann_X	9144	Cc1nc2cocc2cc1I.Ic1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Iodide_PheHet6
ullmann_X	9145	Cc1nc2cocc2cc1I.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het5
ullmann_X	9146	Cc1nc2cocc2cc1I.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het5Het5
ullmann_X	9147	Cc1nc2cocc2cc1I.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het5Het6
ullmann_X	9148	Cc1nc2cocc2cc1I.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het5Phe
ullmann_X	9149	Cc1nc2cocc2cc1I.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het6
ullmann_X	9150	Cc1nc2cocc2cc1I.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het6Het5
ullmann_X	9151	Cc1nc2cocc2cc1I.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het6Het6
ullmann_X	9152	Cc1nc2cocc2cc1I.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_Het6Phe
ullmann_X	9153	Cc1nc2cocc2cc1I.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_PheHet5
ullmann_X	9154	Cc1nc2cocc2cc1I.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het5.X-Triflate_PheHet6
ullmann_X	9155	Cc1c(I)ncc2ccncc12.Brc1ccccc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Phe
ullmann_X	9156	Cc1c(I)ncc2ccncc12.Brc1ccc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_PhePhe
ullmann_X	9157	Cc1c(I)ncc2ccncc12.Ic1ccccc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Phe
ullmann_X	9158	Cc1c(I)ncc2ccncc12.Ic1ccc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_PhePhe
ullmann_X	9159	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(I)ncc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2cnc1c1cccc(Cc2c(I)ncc3ccncc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Phe
ullmann_X	9160	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_PhePhe
ullmann_X	9161	Cc1c(I)ncc2ccncc12.Brc1cocc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het5
ullmann_X	9162	Cc1c(I)ncc2ccncc12.Brc1oc2cocc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het5Het5
ullmann_X	9163	Cc1c(I)ncc2ccncc12.Brc1oc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het5Het6
ullmann_X	9164	Cc1c(I)ncc2ccncc12.Brc1oc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het5Phe
ullmann_X	9165	Cc1c(I)ncc2ccncc12.Brc1ccncc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het6
ullmann_X	9166	Cc1c(I)ncc2ccncc12.Brc1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het6Het5
ullmann_X	9167	Cc1c(I)ncc2ccncc12.Brc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het6Het6
ullmann_X	9168	Cc1c(I)ncc2ccncc12.Brc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_Het6Phe
ullmann_X	9169	Cc1c(I)ncc2ccncc12.Brc1cc2cocc2cc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_PheHet5
ullmann_X	9170	Cc1c(I)ncc2ccncc12.Brc1ccc2ccncc2c1CCc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Bromide_PheHet6
ullmann_X	9171	Cc1c(I)ncc2ccncc12.Clc1cocc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het5
ullmann_X	9172	Cc1c(I)ncc2ccncc12.Clc1oc2cocc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het5Het5
ullmann_X	9173	Cc1c(I)ncc2ccncc12.Clc1oc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het5Het6
ullmann_X	9174	Cc1c(I)ncc2ccncc12.Clc1oc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het5Phe
ullmann_X	9175	Cc1c(I)ncc2ccncc12.Clc1ccncc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het6
ullmann_X	9176	Cc1c(I)ncc2ccncc12.Clc1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het6Het5
ullmann_X	9177	Cc1c(I)ncc2ccncc12.Clc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het6Het6
ullmann_X	9178	Cc1c(I)ncc2ccncc12.Clc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Chloride_Het6Phe
ullmann_X	9179	Cc1c(I)ncc2ccncc12.Ic1cocc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cocc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het5
ullmann_X	9180	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1c(I)oc2cocc12>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het5Het5
ullmann_X	9181	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1c(I)oc2ccncc12>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het5Het6
ullmann_X	9182	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1c(I)oc2ccccc12>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het5Phe
ullmann_X	9183	Cc1c(I)ncc2ccncc12.Ic1ccncc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het6
ullmann_X	9184	Cc1c(I)ncc2ccncc12.Ic1cc2cocc2nc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het6Het5
ullmann_X	9185	Cc1c(I)ncc2ccncc12.Ic1ncc2ccncc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het6Het6
ullmann_X	9186	Cc1c(I)ncc2ccncc12.Ic1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_Het6Phe
ullmann_X	9187	Cc1c(I)ncc2ccncc12.Ic1cc2cocc2cc1Cc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_PheHet5
ullmann_X	9188	Cc1c(I)ncc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)ncc2ccncc12>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Iodide_PheHet6
ullmann_X	9189	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het5
ullmann_X	9190	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het5Het5
ullmann_X	9191	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het5Het6
ullmann_X	9192	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het5Phe
ullmann_X	9193	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het6
ullmann_X	9194	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het6Het5
ullmann_X	9195	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het6Het6
ullmann_X	9196	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_Het6Phe
ullmann_X	9197	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_PheHet5
ullmann_X	9198	Cc1c(I)ncc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Het6.X-Triflate_PheHet6
ullmann_X	9199	Cc1c(I)ncc2ccccc12.Brc1ccccc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Phe
ullmann_X	9200	Cc1c(I)ncc2ccccc12.Brc1ccc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_PhePhe
ullmann_X	9201	Cc1c(I)ncc2ccccc12.Ic1ccccc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Phe
ullmann_X	9202	Cc1c(I)ncc2ccccc12.Ic1ccc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_PhePhe
ullmann_X	9203	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(I)ncc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2cnc1c1cccc(Cc2c(I)ncc3ccccc23)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Phe
ullmann_X	9204	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_PhePhe
ullmann_X	9205	Cc1c(I)ncc2ccccc12.Brc1cocc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het5
ullmann_X	9206	Cc1c(I)ncc2ccccc12.Brc1oc2cocc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het5Het5
ullmann_X	9207	Cc1c(I)ncc2ccccc12.Brc1oc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het5Het6
ullmann_X	9208	Cc1c(I)ncc2ccccc12.Brc1oc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het5Phe
ullmann_X	9209	Cc1c(I)ncc2ccccc12.Brc1ccncc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het6
ullmann_X	9210	Cc1c(I)ncc2ccccc12.Brc1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het6Het5
ullmann_X	9211	Cc1c(I)ncc2ccccc12.Brc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het6Het6
ullmann_X	9212	Cc1c(I)ncc2ccccc12.Brc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_Het6Phe
ullmann_X	9213	Cc1c(I)ncc2ccccc12.Brc1cc2cocc2cc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_PheHet5
ullmann_X	9214	Cc1c(I)ncc2ccccc12.Brc1ccc2ccncc2c1CCc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Bromide_PheHet6
ullmann_X	9215	Cc1c(I)ncc2ccccc12.Clc1cocc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het5
ullmann_X	9216	Cc1c(I)ncc2ccccc12.Clc1oc2cocc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het5Het5
ullmann_X	9217	Cc1c(I)ncc2ccccc12.Clc1oc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het5Het6
ullmann_X	9218	Cc1c(I)ncc2ccccc12.Clc1oc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het5Phe
ullmann_X	9219	Cc1c(I)ncc2ccccc12.Clc1ccncc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het6
ullmann_X	9220	Cc1c(I)ncc2ccccc12.Clc1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het6Het5
ullmann_X	9221	Cc1c(I)ncc2ccccc12.Clc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het6Het6
ullmann_X	9222	Cc1c(I)ncc2ccccc12.Clc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Chloride_Het6Phe
ullmann_X	9223	Cc1c(I)ncc2ccccc12.Ic1cocc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cocc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het5
ullmann_X	9224	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)oc2cocc12>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het5Het5
ullmann_X	9225	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)oc2ccncc12>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het5Het6
ullmann_X	9226	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)oc2ccccc12>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het5Phe
ullmann_X	9227	Cc1c(I)ncc2ccccc12.Ic1ccncc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het6
ullmann_X	9228	Cc1c(I)ncc2ccccc12.Ic1cc2cocc2nc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het6Het5
ullmann_X	9229	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)ncc2ccncc12>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het6Het6
ullmann_X	9230	Cc1c(I)ncc2ccccc12.Ic1ncc2ccccc2c1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_Het6Phe
ullmann_X	9231	Cc1c(I)ncc2ccccc12.Ic1cc2cocc2cc1Cc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_PheHet5
ullmann_X	9232	Cc1c(I)ncc2ccccc12.Ic1ccc2ccncc2c1CCc1c(I)ncc2ccccc12>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Iodide_PheHet6
ullmann_X	9233	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het5
ullmann_X	9234	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het5Het5
ullmann_X	9235	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het5Het6
ullmann_X	9236	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het5Phe
ullmann_X	9237	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het6
ullmann_X	9238	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het6Het5
ullmann_X	9239	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het6Het6
ullmann_X	9240	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_Het6Phe
ullmann_X	9241	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(I)ncc2ccccc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_PheHet5
ullmann_X	9242	Cc1c(I)ncc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_Het6Phe.X-Triflate_PheHet6
ullmann_X	9243	Cc1cc2cocc2cc1I.Brc1ccccc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Phe
ullmann_X	9244	Cc1cc2cocc2cc1I.Brc1ccc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_PhePhe
ullmann_X	9245	Cc1cc2cocc2cc1I.Ic1ccccc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Phe
ullmann_X	9246	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)ccc2ccccc12>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_PhePhe
ullmann_X	9247	Cc1cc2cocc2cc1I.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2I)c1)C(F)(F)F>>Cc1cc2cocc2cc1c1cccc(Cc2cc3cocc3cc2I)c1	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Phe
ullmann_X	9248	Cc1cc2cocc2cc1I.O=S(=O)(Oc1ccc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_PhePhe
ullmann_X	9249	Cc1cc2cocc2cc1I.Brc1cocc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het5
ullmann_X	9250	Cc1cc2cocc2cc1I.Brc1oc2cocc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het5Het5
ullmann_X	9251	Cc1cc2cocc2cc1I.Brc1oc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het5Het6
ullmann_X	9252	Cc1cc2cocc2cc1I.Brc1oc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het5Phe
ullmann_X	9253	Cc1cc2cocc2cc1I.Brc1ccncc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het6
ullmann_X	9254	Cc1cc2cocc2cc1I.Brc1cc2cocc2nc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het6Het5
ullmann_X	9255	Cc1cc2cocc2cc1I.Brc1ncc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het6Het6
ullmann_X	9256	Cc1cc2cocc2cc1I.Brc1ncc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_Het6Phe
ullmann_X	9257	Cc1cc2cocc2cc1I.Brc1cc2cocc2cc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_PheHet5
ullmann_X	9258	Cc1cc2cocc2cc1I.Brc1ccc2ccncc2c1CCc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Bromide_PheHet6
ullmann_X	9259	Cc1cc2cocc2cc1I.Clc1cocc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het5
ullmann_X	9260	Cc1cc2cocc2cc1I.Clc1oc2cocc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het5Het5
ullmann_X	9261	Cc1cc2cocc2cc1I.Clc1oc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het5Het6
ullmann_X	9262	Cc1cc2cocc2cc1I.Clc1oc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het5Phe
ullmann_X	9263	Cc1cc2cocc2cc1I.Clc1ccncc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het6
ullmann_X	9264	Cc1cc2cocc2cc1I.Clc1cc2cocc2nc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het6Het5
ullmann_X	9265	Cc1cc2cocc2cc1I.Clc1ncc2ccncc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het6Het6
ullmann_X	9266	Cc1cc2cocc2cc1I.Clc1ncc2ccccc2c1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Chloride_Het6Phe
ullmann_X	9267	Cc1cc2cocc2cc1I.Ic1cocc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het5
ullmann_X	9268	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)oc2cocc12>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het5Het5
ullmann_X	9269	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)oc2ccncc12>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het5Het6
ullmann_X	9270	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)oc2ccccc12>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het5Phe
ullmann_X	9271	Cc1cc2cocc2cc1I.Ic1ccncc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het6
ullmann_X	9272	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1nc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het6Het5
ullmann_X	9273	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)ncc2ccncc12>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het6Het6
ullmann_X	9274	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1c(I)ncc2ccccc12>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_Het6Phe
ullmann_X	9275	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1Cc1cc2cocc2cc1I>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_PheHet5
ullmann_X	9276	Cc1cc2cocc2cc1I.Ic1cc2cocc2cc1CCc1c(I)ccc2ccncc12>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Iodide_PheHet6
ullmann_X	9277	Cc1cc2cocc2cc1I.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het5
ullmann_X	9278	Cc1cc2cocc2cc1I.O=S(=O)(Oc1oc2cocc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het5Het5
ullmann_X	9279	Cc1cc2cocc2cc1I.O=S(=O)(Oc1oc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het5Het6
ullmann_X	9280	Cc1cc2cocc2cc1I.O=S(=O)(Oc1oc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het5Phe
ullmann_X	9281	Cc1cc2cocc2cc1I.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het6
ullmann_X	9282	Cc1cc2cocc2cc1I.O=S(=O)(Oc1cc2cocc2nc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het6Het5
ullmann_X	9283	Cc1cc2cocc2cc1I.O=S(=O)(Oc1ncc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het6Het6
ullmann_X	9284	Cc1cc2cocc2cc1I.O=S(=O)(Oc1ncc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_Het6Phe
ullmann_X	9285	Cc1cc2cocc2cc1I.O=S(=O)(Oc1cc2cocc2cc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1I	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_PheHet5
ullmann_X	9286	Cc1cc2cocc2cc1I.O=S(=O)(Oc1ccc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet5.X-Triflate_PheHet6
ullmann_X	9287	CCc1c(I)ccc2ccncc12.Brc1ccccc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Phe
ullmann_X	9288	CCc1c(I)ccc2ccncc12.Brc1ccc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_PhePhe
ullmann_X	9289	CCc1c(I)ccc2ccncc12.Ic1ccccc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccccc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Phe
ullmann_X	9290	CCc1c(I)ccc2ccncc12.Ic1ccc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_PhePhe
ullmann_X	9291	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1cccc(CCc2c(I)ccc3ccncc23)c1)C(F)(F)F>>CCc1c(c2cccc(CCc3c(I)ccc4ccncc34)c2)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Phe
ullmann_X	9292	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ccc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_PhePhe
ullmann_X	9293	CCc1c(I)ccc2ccncc12.Brc1cocc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het5
ullmann_X	9294	CCc1c(I)ccc2ccncc12.Brc1oc2cocc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het5Het5
ullmann_X	9295	CCc1c(I)ccc2ccncc12.Brc1oc2ccncc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het5Het6
ullmann_X	9296	CCc1c(I)ccc2ccncc12.Brc1oc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het5Phe
ullmann_X	9297	CCc1c(I)ccc2ccncc12.Brc1ccncc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het6
ullmann_X	9298	CCc1c(I)ccc2ccncc12.Brc1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het6Het5
ullmann_X	9299	CCc1c(I)ccc2ccncc12.Brc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het6Het6
ullmann_X	9300	CCc1c(I)ccc2ccncc12.Brc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_Het6Phe
ullmann_X	9301	CCc1c(I)ccc2ccncc12.Brc1cc2cocc2cc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_PheHet5
ullmann_X	9302	CCc1c(I)ccc2ccncc12.Brc1ccc2ccncc2c1CCCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccncc2c1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Bromide_PheHet6
ullmann_X	9303	CCc1c(I)ccc2ccncc12.Clc1cocc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het5
ullmann_X	9304	CCc1c(I)ccc2ccncc12.Clc1oc2cocc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het5Het5
ullmann_X	9305	CCc1c(I)ccc2ccncc12.Clc1oc2ccncc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het5Het6
ullmann_X	9306	CCc1c(I)ccc2ccncc12.Clc1oc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het5Phe
ullmann_X	9307	CCc1c(I)ccc2ccncc12.Clc1ccncc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het6
ullmann_X	9308	CCc1c(I)ccc2ccncc12.Clc1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het6Het5
ullmann_X	9309	CCc1c(I)ccc2ccncc12.Clc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het6Het6
ullmann_X	9310	CCc1c(I)ccc2ccncc12.Clc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Chloride_Het6Phe
ullmann_X	9311	CCc1c(I)ccc2ccncc12.Ic1cocc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cocc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het5
ullmann_X	9312	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)oc2cocc12>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het5Het5
ullmann_X	9313	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)oc2ccncc12>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het5Het6
ullmann_X	9314	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)oc2ccccc12>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het5Phe
ullmann_X	9315	CCc1c(I)ccc2ccncc12.Ic1ccncc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het6
ullmann_X	9316	CCc1c(I)ccc2ccncc12.Ic1cc2cocc2nc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het6Het5
ullmann_X	9317	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)ncc2ccncc12>>CCc1c2cnccc2ccc1c1ncc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het6Het6
ullmann_X	9318	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCc1c(I)ncc2ccccc12>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_Het6Phe
ullmann_X	9319	CCc1c(I)ccc2ccncc12.Ic1cc2cocc2cc1CCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_PheHet5
ullmann_X	9320	CCc1c(I)ccc2ccncc12.Ic1ccc2ccncc2c1CCCc1c(I)ccc2ccncc12>>CCc1c2cnccc2ccc1c1ccc2ccncc2c1CCCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Iodide_PheHet6
ullmann_X	9321	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1cocc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cocc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het5
ullmann_X	9322	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1oc2cocc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2cocc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het5Het5
ullmann_X	9323	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2ccncc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het5Het6
ullmann_X	9324	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1oc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het5Phe
ullmann_X	9325	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1ccncc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ccncc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het6
ullmann_X	9326	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cc2cocc2nc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het6Het5
ullmann_X	9327	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het6Het6
ullmann_X	9328	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1ncc2ccccc2c1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_Het6Phe
ullmann_X	9329	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1c1cc2cocc2cc1CCc1c(I)ccc2ccncc12	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_PheHet5
ullmann_X	9330	CCc1c(I)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>CCc1c2cnccc2ccc1:S(=O)(=O)C(F)(F)F	[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Iodide_PheHet6.X-Triflate_PheHet6
ullmann_X	9331	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccccc1Br)C(F)(F)F>>Cc1cocc1c1ccccc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Phe
ullmann_X	9332	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_PhePhe
ullmann_X	9333	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1ccccc1I)C(F)(F)F>>Cc1cocc1c1ccccc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Phe
ullmann_X	9334	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_PhePhe
ullmann_X	9335	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cccc(Cc2cocc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cocc1c1cccc(Cc2cocc2OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Phe
ullmann_X	9336	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1cocc1c1ccc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_PhePhe
ullmann_X	9337	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cocc1Br)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het5
ullmann_X	9338	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het5Het5
ullmann_X	9339	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het5Het6
ullmann_X	9340	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het5Phe
ullmann_X	9341	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cnccc1Br)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het6
ullmann_X	9342	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het6Het5
ullmann_X	9343	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het6Het6
ullmann_X	9344	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_Het6Phe
ullmann_X	9345	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_PheHet5
ullmann_X	9346	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Bromide_PheHet6
ullmann_X	9347	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cocc1Cl)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het5
ullmann_X	9348	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het5Het5
ullmann_X	9349	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het5Het6
ullmann_X	9350	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het5Phe
ullmann_X	9351	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het6
ullmann_X	9352	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het6Het5
ullmann_X	9353	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het6Het6
ullmann_X	9354	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Chloride_Het6Phe
ullmann_X	9355	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cocc1I)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het5
ullmann_X	9356	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het5Het5
ullmann_X	9357	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het5Het6
ullmann_X	9358	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het5Phe
ullmann_X	9359	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cnccc1I)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het6
ullmann_X	9360	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het6Het5
ullmann_X	9361	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het6Het6
ullmann_X	9362	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_Het6Phe
ullmann_X	9363	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_PheHet5
ullmann_X	9364	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1cocc1c1ccc2ccncc2c1CCc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Iodide_PheHet6
ullmann_X	9365	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cocc1c1cocc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het5
ullmann_X	9366	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1cocc1c1oc2cocc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het5Het5
ullmann_X	9367	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1cocc1c1oc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het5Het6
ullmann_X	9368	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1cocc1c1oc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het5Phe
ullmann_X	9369	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cocc1c1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het6
ullmann_X	9370	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cocc1c1cc2cocc2nc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het6Het5
ullmann_X	9371	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1cocc1c1ncc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het6Het6
ullmann_X	9372	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1cocc1c1ncc2ccccc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_Het6Phe
ullmann_X	9373	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cocc1c1cc2cocc2cc1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_PheHet5
ullmann_X	9374	Cc1cocc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1cocc1c1ccc2ccncc2c1Cc1cocc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5.X-Triflate_PheHet6
ullmann_X	9375	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2cocc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Phe
ullmann_X	9376	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_PhePhe
ullmann_X	9377	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2cocc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Phe
ullmann_X	9378	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_PhePhe
ullmann_X	9379	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1)C(F)(F)F>>Cc1c2cocc2oc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3cocc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Phe
ullmann_X	9380	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_PhePhe
ullmann_X	9381	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het5
ullmann_X	9382	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het5Het5
ullmann_X	9383	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het5Het6
ullmann_X	9384	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het5Phe
ullmann_X	9385	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het6
ullmann_X	9386	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het6Het5
ullmann_X	9387	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het6Het6
ullmann_X	9388	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_Het6Phe
ullmann_X	9389	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_PheHet5
ullmann_X	9390	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Bromide_PheHet6
ullmann_X	9391	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het5
ullmann_X	9392	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het5Het5
ullmann_X	9393	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het5Het6
ullmann_X	9394	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het5Phe
ullmann_X	9395	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het6
ullmann_X	9396	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het6Het5
ullmann_X	9397	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het6Het6
ullmann_X	9398	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Chloride_Het6Phe
ullmann_X	9399	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het5
ullmann_X	9400	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het5Het5
ullmann_X	9401	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het5Het6
ullmann_X	9402	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het5Phe
ullmann_X	9403	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het6
ullmann_X	9404	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het6Het5
ullmann_X	9405	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het6Het6
ullmann_X	9406	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_Het6Phe
ullmann_X	9407	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_PheHet5
ullmann_X	9408	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Iodide_PheHet6
ullmann_X	9409	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het5
ullmann_X	9410	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het5Het5
ullmann_X	9411	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het5Het6
ullmann_X	9412	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het5Phe
ullmann_X	9413	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het6
ullmann_X	9414	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het6Het5
ullmann_X	9415	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het6Het6
ullmann_X	9416	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_Het6Phe
ullmann_X	9417	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_PheHet5
ullmann_X	9418	Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cocc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het5.X-Triflate_PheHet6
ullmann_X	9419	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2cnccc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Phe
ullmann_X	9420	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_PhePhe
ullmann_X	9421	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2cnccc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Phe
ullmann_X	9422	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_PhePhe
ullmann_X	9423	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2oc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccncc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Phe
ullmann_X	9424	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_PhePhe
ullmann_X	9425	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het5
ullmann_X	9426	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het5Het5
ullmann_X	9427	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het5Het6
ullmann_X	9428	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het5Phe
ullmann_X	9429	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het6
ullmann_X	9430	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het6Het5
ullmann_X	9431	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het6Het6
ullmann_X	9432	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_Het6Phe
ullmann_X	9433	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_PheHet5
ullmann_X	9434	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Bromide_PheHet6
ullmann_X	9435	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het5
ullmann_X	9436	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het5Het5
ullmann_X	9437	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het5Het6
ullmann_X	9438	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het5Phe
ullmann_X	9439	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het6
ullmann_X	9440	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het6Het5
ullmann_X	9441	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het6Het6
ullmann_X	9442	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Chloride_Het6Phe
ullmann_X	9443	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het5
ullmann_X	9444	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het5Het5
ullmann_X	9445	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het5Het6
ullmann_X	9446	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het5Phe
ullmann_X	9447	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het6
ullmann_X	9448	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het6Het5
ullmann_X	9449	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het6Het6
ullmann_X	9450	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_Het6Phe
ullmann_X	9451	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_PheHet5
ullmann_X	9452	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Iodide_PheHet6
ullmann_X	9453	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het5
ullmann_X	9454	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het5Het5
ullmann_X	9455	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het5Het6
ullmann_X	9456	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het5Phe
ullmann_X	9457	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het6
ullmann_X	9458	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het6Het5
ullmann_X	9459	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het6Het6
ullmann_X	9460	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_Het6Phe
ullmann_X	9461	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_PheHet5
ullmann_X	9462	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Het6.X-Triflate_PheHet6
ullmann_X	9463	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2ccccc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Phe
ullmann_X	9464	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_PhePhe
ullmann_X	9465	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2ccccc2oc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Phe
ullmann_X	9466	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_PhePhe
ullmann_X	9467	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2oc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)oc3ccccc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Phe
ullmann_X	9468	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_PhePhe
ullmann_X	9469	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het5
ullmann_X	9470	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het5Het5
ullmann_X	9471	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het5Het6
ullmann_X	9472	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het5Phe
ullmann_X	9473	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het6
ullmann_X	9474	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het6Het5
ullmann_X	9475	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het6Het6
ullmann_X	9476	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_Het6Phe
ullmann_X	9477	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_PheHet5
ullmann_X	9478	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Bromide_PheHet6
ullmann_X	9479	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het5
ullmann_X	9480	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het5Het5
ullmann_X	9481	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het5Het6
ullmann_X	9482	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het5Phe
ullmann_X	9483	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het6
ullmann_X	9484	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het6Het5
ullmann_X	9485	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het6Het6
ullmann_X	9486	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Chloride_Het6Phe
ullmann_X	9487	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het5
ullmann_X	9488	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het5Het5
ullmann_X	9489	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het5Het6
ullmann_X	9490	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het5Phe
ullmann_X	9491	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het6
ullmann_X	9492	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het6Het5
ullmann_X	9493	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het6Het6
ullmann_X	9494	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_Het6Phe
ullmann_X	9495	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_PheHet5
ullmann_X	9496	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Iodide_PheHet6
ullmann_X	9497	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het5
ullmann_X	9498	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het5Het5
ullmann_X	9499	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het5Het6
ullmann_X	9500	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het5Phe
ullmann_X	9501	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het6
ullmann_X	9502	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het6Het5
ullmann_X	9503	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het6Het6
ullmann_X	9504	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_Het6Phe
ullmann_X	9505	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_PheHet5
ullmann_X	9506	Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2oc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het5Phe.X-Triflate_PheHet6
ullmann_X	9507	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccccc1Br)C(F)(F)F>>Cc1cnccc1c1ccccc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Phe
ullmann_X	9508	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_PhePhe
ullmann_X	9509	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1ccccc1I)C(F)(F)F>>Cc1cnccc1c1ccccc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Phe
ullmann_X	9510	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_PhePhe
ullmann_X	9511	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cccc(Cc2cnccc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cnccc1c1cccc(Cc2cnccc2OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Phe
ullmann_X	9512	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_PhePhe
ullmann_X	9513	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cocc1Br)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het5
ullmann_X	9514	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het5Het5
ullmann_X	9515	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het5Het6
ullmann_X	9516	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het5Phe
ullmann_X	9517	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnccc1Br)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het6
ullmann_X	9518	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het6Het5
ullmann_X	9519	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het6Het6
ullmann_X	9520	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_Het6Phe
ullmann_X	9521	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_PheHet5
ullmann_X	9522	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Bromide_PheHet6
ullmann_X	9523	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cocc1Cl)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het5
ullmann_X	9524	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het5Het5
ullmann_X	9525	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het5Het6
ullmann_X	9526	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het5Phe
ullmann_X	9527	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het6
ullmann_X	9528	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het6Het5
ullmann_X	9529	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het6Het6
ullmann_X	9530	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Chloride_Het6Phe
ullmann_X	9531	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cocc1I)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het5
ullmann_X	9532	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het5Het5
ullmann_X	9533	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het5Het6
ullmann_X	9534	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het5Phe
ullmann_X	9535	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnccc1I)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het6
ullmann_X	9536	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het6Het5
ullmann_X	9537	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het6Het6
ullmann_X	9538	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_Het6Phe
ullmann_X	9539	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_PheHet5
ullmann_X	9540	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccncc2c1CCc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Iodide_PheHet6
ullmann_X	9541	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cocc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cnccc1c1cocc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het5
ullmann_X	9542	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1cnccc1c1oc2cocc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het5Het5
ullmann_X	9543	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1cnccc1c1oc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het5Het6
ullmann_X	9544	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1cnccc1c1oc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het5Phe
ullmann_X	9545	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cnccc1c1ccncc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het6
ullmann_X	9546	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cnccc1c1cc2cocc2nc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het6Het5
ullmann_X	9547	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het6Het6
ullmann_X	9548	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1cnccc1c1ncc2ccccc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_Het6Phe
ullmann_X	9549	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cnccc1c1cc2cocc2cc1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_PheHet5
ullmann_X	9550	Cc1cnccc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1cnccc1c1ccc2ccncc2c1Cc1cnccc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6.X-Triflate_PheHet6
ullmann_X	9551	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccccc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Phe
ullmann_X	9552	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_PhePhe
ullmann_X	9553	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1ccccc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1ccccc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Phe
ullmann_X	9554	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_PhePhe
ullmann_X	9555	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cccc(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1nc2cocc2cc1c1cccc(Cc2nc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Phe
ullmann_X	9556	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_PhePhe
ullmann_X	9557	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het5
ullmann_X	9558	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het5Het5
ullmann_X	9559	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het5Het6
ullmann_X	9560	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het5Phe
ullmann_X	9561	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het6
ullmann_X	9562	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het6Het5
ullmann_X	9563	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het6Het6
ullmann_X	9564	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_Het6Phe
ullmann_X	9565	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_PheHet5
ullmann_X	9566	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Bromide_PheHet6
ullmann_X	9567	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het5
ullmann_X	9568	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het5Het5
ullmann_X	9569	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het5Het6
ullmann_X	9570	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het5Phe
ullmann_X	9571	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het6
ullmann_X	9572	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het6Het5
ullmann_X	9573	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het6Het6
ullmann_X	9574	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Chloride_Het6Phe
ullmann_X	9575	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cocc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het5
ullmann_X	9576	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het5Het5
ullmann_X	9577	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het5Het6
ullmann_X	9578	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het5Phe
ullmann_X	9579	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cnccc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het6
ullmann_X	9580	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het6Het5
ullmann_X	9581	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het6Het6
ullmann_X	9582	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_Het6Phe
ullmann_X	9583	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_PheHet5
ullmann_X	9584	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccncc2c1CCc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Iodide_PheHet6
ullmann_X	9585	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1nc2cocc2cc1c1cocc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het5
ullmann_X	9586	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2cocc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het5Het5
ullmann_X	9587	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het5Het6
ullmann_X	9588	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1oc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het5Phe
ullmann_X	9589	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1nc2cocc2cc1c1ccncc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het6
ullmann_X	9590	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2nc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het6Het5
ullmann_X	9591	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het6Het6
ullmann_X	9592	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ncc2ccccc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_Het6Phe
ullmann_X	9593	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1nc2cocc2cc1c1cc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_PheHet5
ullmann_X	9594	Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1nc2cocc2cc1c1ccc2ccncc2c1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het5.X-Triflate_PheHet6
ullmann_X	9595	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Phe
ullmann_X	9596	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_PhePhe
ullmann_X	9597	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Phe
ullmann_X	9598	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_PhePhe
ullmann_X	9599	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1)C(F)(F)F>>Cc1c2cnccc2cnc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccncc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Phe
ullmann_X	9600	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_PhePhe
ullmann_X	9601	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het5
ullmann_X	9602	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het5Het5
ullmann_X	9603	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het5Het6
ullmann_X	9604	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het5Phe
ullmann_X	9605	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het6
ullmann_X	9606	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het6Het5
ullmann_X	9607	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het6Het6
ullmann_X	9608	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_Het6Phe
ullmann_X	9609	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_PheHet5
ullmann_X	9610	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Bromide_PheHet6
ullmann_X	9611	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het5
ullmann_X	9612	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het5Het5
ullmann_X	9613	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het5Het6
ullmann_X	9614	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het5Phe
ullmann_X	9615	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het6
ullmann_X	9616	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het6Het5
ullmann_X	9617	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het6Het6
ullmann_X	9618	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Chloride_Het6Phe
ullmann_X	9619	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het5
ullmann_X	9620	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het5Het5
ullmann_X	9621	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het5Het6
ullmann_X	9622	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het5Phe
ullmann_X	9623	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het6
ullmann_X	9624	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het6Het5
ullmann_X	9625	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het6Het6
ullmann_X	9626	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_Het6Phe
ullmann_X	9627	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_PheHet5
ullmann_X	9628	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Iodide_PheHet6
ullmann_X	9629	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het5
ullmann_X	9630	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het5Het5
ullmann_X	9631	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het5Het6
ullmann_X	9632	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het5Phe
ullmann_X	9633	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het6
ullmann_X	9634	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het6Het5
ullmann_X	9635	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het6Het6
ullmann_X	9636	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_Het6Phe
ullmann_X	9637	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_PheHet5
ullmann_X	9638	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2cnc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Het6.X-Triflate_PheHet6
ullmann_X	9639	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Phe
ullmann_X	9640	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_PhePhe
ullmann_X	9641	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Phe
ullmann_X	9642	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_PhePhe
ullmann_X	9643	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1)C(F)(F)F>>Cc1c2ccccc2cnc1c1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ncc3ccccc23)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Phe
ullmann_X	9644	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_PhePhe
ullmann_X	9645	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het5
ullmann_X	9646	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het5Het5
ullmann_X	9647	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het5Het6
ullmann_X	9648	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het5Phe
ullmann_X	9649	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het6
ullmann_X	9650	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het6Het5
ullmann_X	9651	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het6Het6
ullmann_X	9652	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_Het6Phe
ullmann_X	9653	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_PheHet5
ullmann_X	9654	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Bromide_PheHet6
ullmann_X	9655	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het5
ullmann_X	9656	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het5Het5
ullmann_X	9657	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het5Het6
ullmann_X	9658	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het5Phe
ullmann_X	9659	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het6
ullmann_X	9660	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het6Het5
ullmann_X	9661	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het6Het6
ullmann_X	9662	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Chloride_Het6Phe
ullmann_X	9663	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het5
ullmann_X	9664	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het5Het5
ullmann_X	9665	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het5Het6
ullmann_X	9666	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het5Phe
ullmann_X	9667	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het6
ullmann_X	9668	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het6Het5
ullmann_X	9669	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het6Het6
ullmann_X	9670	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_Het6Phe
ullmann_X	9671	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_PheHet5
ullmann_X	9672	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Iodide_PheHet6
ullmann_X	9673	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het5
ullmann_X	9674	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het5Het5
ullmann_X	9675	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het5Het6
ullmann_X	9676	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het5Phe
ullmann_X	9677	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het6
ullmann_X	9678	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het6Het5
ullmann_X	9679	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het6Het6
ullmann_X	9680	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_Het6Phe
ullmann_X	9681	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_PheHet5
ullmann_X	9682	Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2ccccc2cnc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_Het6Phe.X-Triflate_PheHet6
ullmann_X	9683	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccccc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Phe
ullmann_X	9684	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_PhePhe
ullmann_X	9685	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1ccccc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1ccccc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Phe
ullmann_X	9686	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_PhePhe
ullmann_X	9687	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cccc(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1)C(F)(F)F>>Cc1cc2cocc2cc1c1cccc(Cc2cc3cocc3cc2OS(=O)(=O)C(F)(F)F)c1	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Phe
ullmann_X	9688	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_PhePhe
ullmann_X	9689	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het5
ullmann_X	9690	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het5Het5
ullmann_X	9691	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het5Het6
ullmann_X	9692	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het5Phe
ullmann_X	9693	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het6
ullmann_X	9694	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het6Het5
ullmann_X	9695	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het6Het6
ullmann_X	9696	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_Het6Phe
ullmann_X	9697	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_PheHet5
ullmann_X	9698	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Bromide_PheHet6
ullmann_X	9699	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1Cl)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het5
ullmann_X	9700	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het5Het5
ullmann_X	9701	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het5Het6
ullmann_X	9702	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het5Phe
ullmann_X	9703	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1Cl)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het6
ullmann_X	9704	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het6Het5
ullmann_X	9705	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het6Het6
ullmann_X	9706	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Chloride_Het6Phe
ullmann_X	9707	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cocc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het5
ullmann_X	9708	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het5Het5
ullmann_X	9709	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het5Het6
ullmann_X	9710	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het5Phe
ullmann_X	9711	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cnccc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het6
ullmann_X	9712	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het6Het5
ullmann_X	9713	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het6Het6
ullmann_X	9714	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_Het6Phe
ullmann_X	9715	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_PheHet5
ullmann_X	9716	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccncc2c1CCc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Iodide_PheHet6
ullmann_X	9717	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cc2cocc2cc1c1cocc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het5
ullmann_X	9718	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2cocc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het5Het5
ullmann_X	9719	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het5Het6
ullmann_X	9720	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1oc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het5Phe
ullmann_X	9721	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cc2cocc2cc1c1ccncc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het6
ullmann_X	9722	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1nc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2nc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het6Het5
ullmann_X	9723	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het6Het6
ullmann_X	9724	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ncc2ccccc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_Het6Phe
ullmann_X	9725	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F)C(F)(F)F>>Cc1cc2cocc2cc1c1cc2cocc2cc1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_PheHet5
ullmann_X	9726	Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1cc2cocc2cc1c1ccc2ccncc2c1Cc1cc2cocc2cc1OS(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):1][a:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet5.X-Triflate_PheHet6
ullmann_X	9727	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccccc1Br)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Phe
ullmann_X	9728	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_PhePhe
ullmann_X	9729	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1ccccc1I)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccccc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Phe
ullmann_X	9730	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ccc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_PhePhe
ullmann_X	9731	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1cccc(Cc2c(OS(=O)(=O)C(F)(F)F)ccc3ccncc23)c1)C(F)(F)F>>Cc1c(c2cccc(Cc3c(OS(=O)(=O)C(F)(F)F)ccc4ccncc34)c2)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1ccccc1)]);$(*[c;$(c1[c][c][c][c][c]1)]);!$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Phe
ullmann_X	9732	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_PhePhe
ullmann_X	9733	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1Br)C(F)(F)F>>Cc1c2cnccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het5
ullmann_X	9734	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het5Het5
ullmann_X	9735	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het5Het6
ullmann_X	9736	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het5Phe
ullmann_X	9737	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1Br)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het6
ullmann_X	9738	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het6Het5
ullmann_X	9739	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het6Het6
ullmann_X	9740	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Br)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_Het6Phe
ullmann_X	9741	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cc2cocc2cc1Br)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_PheHet5
ullmann_X	9742	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1c(Br)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Br;$([Br][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Bromide_PheHet6
ullmann_X	9743	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1Cl)C(F)(F)F>>Cc1c2cnccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het5
ullmann_X	9744	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het5Het5
ullmann_X	9745	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het5Het6
ullmann_X	9746	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het5Phe
ullmann_X	9747	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1Cl)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het6
ullmann_X	9748	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1Cl)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het6Het5
ullmann_X	9749	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het6Het6
ullmann_X	9750	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(Cl)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[Cl;$([Cl][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Chloride_Het6Phe
ullmann_X	9751	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cocc1I)C(F)(F)F>>Cc1c2cnccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het5
ullmann_X	9752	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het5Het5
ullmann_X	9753	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het5Het6
ullmann_X	9754	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het5Phe
ullmann_X	9755	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cnccc1I)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het6
ullmann_X	9756	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1nc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het6Het5
ullmann_X	9757	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het6Het6
ullmann_X	9758	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(I)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_Het6Phe
ullmann_X	9759	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1cc2cocc2cc1I)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_PheHet5
ullmann_X	9760	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1CCc1c(I)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccc2ccncc2c1CCc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[I;$([I][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Iodide_PheHet6
ullmann_X	9761	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1cocc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaa1)]);$(*[a;$(*1[*][*][*][*]1)]);!$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]),$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)]),$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het5
ullmann_X	9762	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2cocc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2cocc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1aa(aaa2)a2a1)]),$(*[$(a1a(aaa2)a2aa1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het5Het5
ullmann_X	9763	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aa2)a1a2aaaa1)]),$(*[$(a2aa1a(a2)aaaa1)]);!$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het5Het6
ullmann_X	9764	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)oc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1oc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(*(aa2)c1c2cccc1)]),$(*[$(*2ac1c(a2)cccc1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het5Phe
ullmann_X	9765	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ccncc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1aaaaa1)]);$(*[a;$(*1[*][*][*][*][*]1)]);!$([$(*[c;$(c1ccccc1)]),$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]),$(*[c;$(c1ccc2c(aaa2)c1)]),$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]),$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het6
ullmann_X	9766	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2nc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[a;$(a1a2a(aaa2)aaa1)]),$(*[a;$(a1aaa2a(aaa2)a1)]);!$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het6Het5
ullmann_X	9767	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a(aaa2)a1a2aaaa1)]),$(*[$(a1aa2a(aaaa2)aa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het6Het6
ullmann_X	9768	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ncc2ccccc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1ncc2ccccc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(a1ac2c(cccc2)aa1)]),$(*[$(a(aaa2)c1c2cccc1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)]),$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)])])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_Het6Phe
ullmann_X	9769	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1c1cc2cocc2cc1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[c;$(c1c2c(aaa2)ccc1)]),$(*[c;$(c1ccc2c(aaa2)c1)])]):3][a:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_PheHet5
ullmann_X	9770	Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12.O=S(=O)(Oc1ccc2ccncc2c1Cc1c(OS(=O)(=O)C(F)(F)F)ccc2ccncc12)C(F)(F)F>>Cc1c2cnccc2ccc1:S(=O)(=O)C(F)(F)F	[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):1][*:2].[O;$(OS(=O)(=O)C(F)(F)F);$([O;$(OS(=O)(=O)C(F)(F)F)][*;$([#6]);!$(*=*)]);$([$(*[$(c1cc2c(aaaa2)cc1)]),$(*[$(c(ccc2)c1c2aaaa1)]);!$([$(*[$(c1cc2c(cccc2)cc1)]),$(*[$(c(ccc2)c1c2cccc1)])])]):3][*:4]>>[a:2][a:4]	X-Triflate_PheHet6.X-Triflate_PheHet6
