MA-Pb-I (Github)                        
   1.00000000000000     
     6.2901201247999996    0.0000000000000000    0.0000000000000000
     0.0000776940000000    6.2738900180000003    0.0000000000000000
    -0.0396675710000000   -0.0001537931000000    6.2969150416000002
   C    N    H    Pb   I 
     1     1     6     1     3
Direct
  0.9027799959999996  0.9999629859999999  0.9963350299999973
  0.1365830000000017  0.9998270270000020  0.0248780009999976
  0.8645079730000020  0.9997130040000002  0.8257349730000030
  0.8377940060000029  0.1437570009999973  0.0719280019999999
  0.8375890249999998  0.8565160039999995  0.0723830009999986
  0.2075880020000014  0.1342740059999983  0.9581339960000008
  0.2073930050000001  0.8650630120000002  0.9584969880000003
  0.1820130050000017  0.0000029999999995  0.1853529959999989
  0.4761709870000033  0.5000309939999994  0.4756470020000023
  0.4268029930000026  0.4998829959999966  0.9726089839999972
  0.4358600079999988  0.0000450000000001  0.5065420270000018
  0.9628980159999969  0.5002269740000003  0.4477469919999990
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
