spin3_oc_oracle_v1
model_sha256 57e66e9491b41e8bcce3712046c83408db4f19fd65dd6d8c510aa5a156107e57
descriptor_dim 121
spin_descriptor_dim 91
case zero 5
types Fe Ge Fe Ge Fe
cell 9 1.40000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.30000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.50000000000000000e+01
positions 15 1.00000000000000000e+00 1.00000000000000000e+00 1.00000000000000000e+00 2.39999999999999991e+00 1.30000000000000004e+00 8.00000000000000044e-01 6.99999999999999956e-01 2.60000000000000009e+00 1.39999999999999991e+00 1.30000000000000004e+00 5.00000000000000000e-01 2.70000000000000018e+00 3.10000000000000009e+00 2.79999999999999982e+00 2.20000000000000018e+00
spins 15 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00
potential 5 -2.52950417458253085e-01 1.90815041979876143e-01 -2.54141281242850903e-01 1.99907373114162568e-01 -2.53346366808555046e-01
forces 15 -5.80654546786871402e-03 5.24512572215743347e-03 -1.58117203301252527e-03 7.13166325730548584e-03 1.11158436996078771e-02 -7.01892610514386235e-03 -3.36787857298294921e-03 -2.15004451935478895e-02 6.61307498132944374e-04 -1.55630467286375137e-03 1.59988057999278580e-02 4.30383056902149553e-03 3.59906545640993093e-03 -1.08593300281452712e-02 3.63496007100194739e-03
virial 45 1.14596450552493512e-02 1.72724690549200927e-03 -2.01629110558683563e-03 5.31351130414067568e-04 -1.05513152451633071e-03 -3.04793533758187423e-03 -7.02355972822654240e-04 -1.60704854960862340e-03 2.42257763727005051e-03 2.75110382885893241e-03 -5.78007879837330986e-04 -4.18743846069741243e-03 1.17523626888569634e-03 6.37081903846917208e-03 -1.99489406889532227e-04 -4.21333793383448386e-03 9.63507270923353795e-05 1.34484111587190834e-02 -4.38134906223314885e-04 1.76594473021381669e-02 5.80046038476074617e-03 1.47850843288538179e-02 -3.12628038153725321e-02 6.98191525227907523e-03 4.38152042055272271e-03 9.72369170918079527e-03 -8.09169364356333333e-03 -3.74651916540500200e-03 -4.80411309068382291e-03 -4.26679589553831569e-03 -4.00346806190364415e-03 -1.62735147164174317e-02 2.66284710413518385e-03 -3.14422524445832300e-03 7.13675272866217780e-04 1.09964149203871445e-02 8.05974337624431637e-03 -9.99720981872034668e-03 3.56974160023106838e-03 -8.48084024786125920e-03 -1.63915251325825739e-02 -3.05391060318054063e-03 2.57807525373199981e-03 -5.58324215076842160e-03 -5.42893779999211335e-03
mforces 15 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00
tau 15 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00
descriptor 605 -2.95852875471916514e-02 6.62278785116065388e-02 -1.77860247854570941e-01 8.56686905962296824e-02 9.49387120620008018e-02 6.89802122490604935e-03 1.68308463394451998e-03 1.74696243553959137e-02 4.52728466232553417e-03 2.29009323905209842e-03 1.28168880344458943e-02 4.44880698551725507e-03 1.40316780373737279e-02 8.76813338115921791e-03 5.20333635639927622e-04 1.09918770242889083e-02 5.27944896542663009e-03 3.76073196261466972e-02 1.14284211413125426e-02 3.76297635364469156e-03 1.08886291401447139e-02 6.73700652926739144e-03 6.82462353954013529e-02 1.47463123481096983e-02 8.35673979775350233e-03 -3.31519548167820714e-04 -5.47652627604176806e-05 3.81299456203965646e-04 2.47419447134496391e-04 -9.27255616380097709e-07 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 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end
case collinear 5
types Fe Ge Fe Ge Fe
cell 9 1.40000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.30000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.50000000000000000e+01
positions 15 1.00000000000000000e+00 1.00000000000000000e+00 1.00000000000000000e+00 2.39999999999999991e+00 1.30000000000000004e+00 8.00000000000000044e-01 6.99999999999999956e-01 2.60000000000000009e+00 1.39999999999999991e+00 1.30000000000000004e+00 5.00000000000000000e-01 2.70000000000000018e+00 3.10000000000000009e+00 2.79999999999999982e+00 2.20000000000000018e+00
spins 15 0.00000000000000000e+00 0.00000000000000000e+00 8.00000000000000044e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.10000000000000009e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 5.00000000000000000e-01
potential 5 -2.50016359972314695e-01 1.90815041979876143e-01 -2.39523496844293526e-01 1.99907373114162568e-01 -2.53702137506917558e-01
forces 15 6.42549979210535645e-03 -1.55299141637136300e-02 6.67107927661825077e-03 6.68477303228423147e-03 1.06912370289870082e-02 -1.12659402941804217e-02 1.08070318570926867e-02 4.47436452450900024e-03 4.65515163443095282e-03 -2.71828398570582528e-03 1.77182729684429233e-02 8.92962901620469179e-03 -2.11990206957764493e-02 -1.73539603582252983e-02 -8.98991963307347111e-03
virial 45 2.73961912274427177e-03 -1.03050964496531790e-02 -7.25937355541049142e-03 -1.15671165988929341e-02 1.71469630892426769e-02 -1.21025721682253146e-02 -7.10804633030329668e-03 2.91336453041779768e-04 -1.97672060287367064e-03 1.74772498900301835e-03 -2.87702442731222526e-03 -9.50221189611396080e-03 -1.18965325302251216e-03 6.24473548054503384e-03 4.44325295865325570e-03 -4.92659219013115261e-03 -3.42810635812277210e-04 1.63125503200612816e-02 -2.01635223982483160e-02 1.26350750189792287e-02 -2.37048058059417636e-04 9.32605691314992297e-03 -1.74177351274801134e-02 1.93768443988656842e-03 -3.36753032028694072e-03 1.24377521414064766e-02 -1.15014595682441552e-02 -3.83629328871567003e-03 -3.70171434106985687e-03 -2.41071483976984524e-03 -2.87426951797220293e-03 -1.78002344710233747e-02 -4.08698097414333245e-03 -4.87127359688912208e-03 3.61202251432984163e-03 1.76391684858067666e-02 -1.97043843935554644e-02 -1.32536521794551013e-02 -1.39594560774210352e-02 -1.11974299217734094e-02 -1.79036397524007171e-02 -6.76959357697038203e-03 -6.80060703664090750e-03 -7.05049045247700679e-03 -1.19658241542819448e-02
mforces 15 5.00103173674246865e-04 -1.70577641366694011e-02 -2.08598212690198556e-02 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -4.67560319382196322e-03 -1.15082093874253628e-02 -2.09229522167505948e-02 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -3.10334795651710923e-03 1.55844458843078693e-03 -3.19286453694216793e-03
tau 15 1.36462113093355208e-02 4.00082538939397513e-04 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.26590303261678999e-02 -5.14316351320415980e-03 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -7.79222294215393464e-04 -1.55167397825855462e-03 0.00000000000000000e+00
descriptor 605 -2.95852875471916514e-02 6.62278785116065388e-02 -1.77860247854570941e-01 8.56686905962296824e-02 9.49387120620008018e-02 6.89802122490604935e-03 1.68308463394451998e-03 1.74696243553959137e-02 4.52728466232553417e-03 2.29009323905209842e-03 1.28168880344458943e-02 4.44880698551725507e-03 1.40316780373737279e-02 8.76813338115921791e-03 5.20333635639927622e-04 1.09918770242889083e-02 5.27944896542663009e-03 3.76073196261466972e-02 1.14284211413125426e-02 3.76297635364469156e-03 1.08886291401447139e-02 6.73700652926739144e-03 6.82462353954013529e-02 1.47463123481096983e-02 8.35673979775350233e-03 -3.31519548167820714e-04 -5.47652627604176806e-05 3.81299456203965646e-04 2.47419447134496391e-04 -9.27255616380097709e-07 4.80000000000000093e-01 2.36189035940995579e-01 1.13028630444285502e-01 -5.68096557918386785e-02 3.28644374300925579e-01 1.41896095982543380e-01 -5.98404728029255442e-02 -6.80799543991850997e-02 -3.04367088084712724e-02 1.37011186090853689e-02 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end
case noncollinear 5
types Fe Ge Fe Ge Fe
cell 9 1.40000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.30000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.50000000000000000e+01
positions 15 1.00000000000000000e+00 1.00000000000000000e+00 1.00000000000000000e+00 2.39999999999999991e+00 1.30000000000000004e+00 8.00000000000000044e-01 6.99999999999999956e-01 2.60000000000000009e+00 1.39999999999999991e+00 1.30000000000000004e+00 5.00000000000000000e-01 2.70000000000000018e+00 3.10000000000000009e+00 2.79999999999999982e+00 2.20000000000000018e+00
spins 15 8.00000000000000044e-01 1.00000000000000006e-01 2.00000000000000011e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -2.99999999999999989e-01 4.00000000000000022e-01 6.99999999999999956e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -4.00000000000000022e-01 -2.99999999999999989e-01 8.00000000000000044e-01
potential 5 -2.44656760461910927e-01 1.90815041979876143e-01 -2.44892595568725446e-01 1.99907373114162568e-01 -2.47959433417947128e-01
forces 15 8.66824307513298746e-03 -1.02369596107513127e-02 2.88417031736192854e-03 9.04327674040283566e-03 1.17159213442436863e-02 -9.50762451007263615e-03 -2.18195648053437323e-05 2.23412928497356347e-03 5.02760610926761362e-03 1.53421936267775531e-03 1.55296757738216263e-02 5.41199281053814270e-03 -1.92239196134082364e-02 -1.92427667922875634e-02 -3.81614472709504611e-03
virial 45 3.13872704295752904e-03 -9.52643002847777288e-03 -6.33552633389193424e-03 -1.40620698510004784e-02 7.06455268462422275e-03 -1.14968186937834758e-02 -7.75292181703999932e-03 -2.57135400340223301e-03 -1.50607423488585907e-03 4.38916269811356549e-03 1.32972751165994028e-03 -4.08881569646984012e-03 4.54191258442728472e-03 6.13784417727418485e-03 6.43946430801909872e-03 -4.05566301090603924e-03 1.77759362602530348e-04 1.73210319989402575e-02 -1.47676872330552537e-02 1.24147142821849667e-02 2.18253792586386129e-03 2.87509306105105528e-03 -1.20518980591135388e-02 1.04595788547017163e-02 -3.69218530087334247e-03 1.40209756280441130e-02 -8.13485021478617745e-03 -2.81833651208623134e-03 -6.38158862400592386e-03 -5.89660997904272247e-03 -6.68910732396126376e-03 -1.41219996913446409e-02 -1.17467737682418237e-03 1.75909583084514660e-03 6.39122243408399120e-05 1.12662273106083847e-02 -1.71846980692780052e-02 -1.78552795765695091e-02 -7.07084814707948598e-03 -1.93579217375580044e-02 -2.23409339652378518e-02 -8.61072158434692328e-03 -8.53623949556617592e-03 -9.83169710169286629e-03 -1.04127534087542495e-02
mforces 15 -1.63248104616982893e-02 -1.11049829381530858e-02 -1.93983211867464461e-03 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 1.88608346714167763e-02 -1.11706497671612386e-02 -1.43394234636467759e-02 0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -1.99121105306655517e-03 1.57807318285540068e-03 -1.13151010703105796e-02
tau 15 2.02701337576315262e-03 -1.71309639739994227e-03 -7.25150530435264042e-03 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 2.08368545155415610e-03 8.90075723089770940e-03 -4.19313893841833946e-03 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 2.13207177480885307e-03 -6.11900927057747613e-03 -1.22859258906212691e-03
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end
case chiral_soc 5
types Fe Ge Fe Ge Fe
cell 9 1.40000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.30000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.50000000000000000e+01
positions 15 1.00000000000000000e+00 1.00000000000000000e+00 1.00000000000000000e+00 2.50000000000000000e+00 1.10000000000000009e+00 1.10000000000000009e+00 4.99999999999999944e-01 2.70000000000000018e+00 1.59999999999999987e+00 1.60000000000000009e+00 6.99999999999999956e-01 2.60000000000000009e+00 3.00000000000000000e+00 3.09999999999999964e+00 2.30000000000000027e+00
spins 15 1.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -4.00000000000000022e-01 8.00000000000000044e-01 2.99999999999999989e-01
potential 5 -2.48142379988138151e-01 2.04243155506178692e-01 -2.42436650849286700e-01 2.05724475837031240e-01 -2.52640618641669368e-01
forces 15 6.69266419537876099e-03 -2.97120671135159622e-03 -1.21406846963361282e-03 2.49832979687924644e-02 2.54975486145176782e-02 -2.09272432134881073e-02 8.92473092419705620e-03 8.77120294104024451e-04 1.01744146724853206e-02 -1.03026124467934660e-02 1.47244481448720495e-02 2.69748496534273387e-02 -3.02980806415748156e-02 -3.81279103421421489e-02 -1.50079526427909383e-02
virial 45 1.65108367046150686e-03 -2.44758314105223695e-02 -8.86886645434080412e-03 -2.39531125584987944e-02 -1.67661520527544617e-03 -9.27269248342019008e-03 -9.90293034587686263e-03 -6.85502480285895416e-03 -1.50138075721680756e-03 8.50134653785090087e-03 4.61564396511872019e-03 -1.40154929420365365e-02 6.92893135808343719e-04 -3.64805546097174849e-03 -7.06481389330979731e-03 -1.57799957819491250e-02 -9.01779436483004723e-03 2.15272677597983762e-02 -2.97437394715093749e-02 2.09656661880388284e-02 -3.95263427192259036e-03 1.62743141430706506e-02 -1.15006075021209728e-02 1.49521695564533534e-02 -6.13610536234199429e-03 1.38164114565824496e-02 -2.71114338886888680e-03 4.49064562299856911e-03 -1.66187735751520209e-03 -1.16719703241470810e-02 -4.11794852356012035e-03 -1.28804771179056622e-02 -6.05866200315335283e-03 -4.87444598048710192e-03 -2.82525076165933290e-03 2.26607657988316911e-02 -1.86644836199371632e-02 -2.90569904077565694e-02 -1.18001036575532837e-02 -3.17609594420749028e-02 -5.07393315142576767e-02 -1.69613760005829506e-02 -1.13250389268642459e-02 -1.80494809023094560e-02 -1.23141639205464736e-02
mforces 15 -7.24574841278319975e-03 -1.48882477225021279e-02 1.06336365417163629e-02 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 1.16244508050162634e-02 -6.80934885558637237e-03 -1.89730690447569260e-02 0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -3.94758086745731519e-04 -3.30254257621830430e-03 -7.90734522439283730e-03
tau 15 0.00000000000000000e+00 -1.06336365417163629e-02 -1.48882477225021279e-02 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 6.80934885558637237e-03 1.16244508050162634e-02 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 -5.33511340664877872e-03 -3.28136551578085429e-03 1.63682349988390698e-03
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end
case strained 5
types Fe Ge Fe Ge Fe
cell 9 1.42099999999999991e+01 0.00000000000000000e+00 5.60000000000000012e-02 1.56000000000000000e-01 1.28309999999999995e+01 0.00000000000000000e+00 -8.99999999999999967e-02 1.34999999999999981e-01 1.51200000000000010e+01
positions 15 1.02099999999999991e+00 9.95999999999999996e-01 1.01200000000000001e+00 2.44679999999999964e+00 1.29030000000000022e+00 8.16000000000000059e-01 7.33299999999999952e-01 2.57880000000000020e+00 1.41399999999999992e+00 1.30929999999999991e+00 5.17800000000000038e-01 2.72680000000000033e+00 3.16689999999999960e+00 2.78339999999999987e+00 2.22999999999999998e+00
spins 15 8.00000000000000044e-01 1.00000000000000006e-01 2.00000000000000011e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -2.99999999999999989e-01 4.00000000000000022e-01 6.99999999999999956e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -4.00000000000000022e-01 -2.99999999999999989e-01 8.00000000000000044e-01
potential 5 -2.44223041841380939e-01 1.90662696596788583e-01 -2.44667350750834678e-01 1.99451221902896630e-01 -2.47733805225394454e-01
forces 15 8.55725960013109868e-03 -9.50218496511703176e-03 3.40251000256961778e-03 9.14068050420809367e-03 1.14151902045485747e-02 -8.41048186646621565e-03 2.27919954334469864e-03 2.09552181138383462e-03 5.54230085333108895e-03 2.11190339626980954e-03 1.53410215377901768e-02 4.68688319021040231e-03 -2.20890430439536975e-02 -1.93495485886055543e-02 -5.22121217964489209e-03
virial 45 2.76853142464491067e-03 -9.74904753246303400e-03 -6.84556299980627891e-03 -1.40604400060444813e-02 6.42343760716831969e-03 -1.15630486286258591e-02 -7.95375303489994669e-03 -2.70234157842419703e-03 -1.97270664605616241e-03 4.89601454161170055e-03 1.23101183106923227e-03 -3.77401534773629584e-03 4.55557317989237903e-03 5.74906388383264293e-03 6.67019642003519216e-03 -3.84141831668563614e-03 5.23357711533783618e-04 1.65824799074624982e-02 -1.77450276025154230e-02 1.24548180547792188e-02 1.31705790129143206e-03 2.58273793015016163e-03 -1.25251131808891414e-02 1.03908384950911342e-02 -4.56064979018210460e-03 1.40810701156961569e-02 -8.84455906093154116e-03 -3.19116887835375288e-03 -6.91854184829601270e-03 -5.40894211617354292e-03 -7.26450796071690611e-03 -1.28414833487820838e-02 -1.42674374682180607e-03 2.35989077057420591e-03 -1.41128214766890708e-04 1.10851678189789141e-02 -2.11433086499834486e-02 -1.84447237435229269e-02 -8.72769323084851556e-03 -2.00076115745457840e-02 -2.20510822077175789e-02 -9.34775575378311505e-03 -1.01623672748188728e-02 -1.04169019938730317e-02 -1.12962917708219132e-02
mforces 15 -1.70984840010617832e-02 -1.12885428562786196e-02 -1.77184880735816851e-03 -0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 1.97476550002015361e-02 -1.18779523252965438e-02 -1.58061027566700797e-02 0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -1.58704283448672743e-03 1.58747538769179238e-03 -1.27263344962142162e-02
tau 15 2.08052369051990723e-03 -2.00221775432582200e-03 -7.32098588491671750e-03 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.99212552503954697e-03 9.08152767314004961e-03 -4.33567630249165163e-03 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 2.54792003871083094e-03 -6.36016806607506840e-03 -1.11110300542273518e-03
descriptor 605 -2.81584845555954630e-02 6.31993988525440670e-02 -1.74240127725626831e-01 7.68335611073342195e-02 9.09737177966246924e-02 6.69032463535330999e-03 1.56025200462312028e-03 1.74311044778442600e-02 4.60722092472272936e-03 2.09736164022152494e-03 1.27217918645159533e-02 4.08607211671482059e-03 1.38942133003410496e-02 8.81450197602351784e-03 4.44651302639619700e-04 1.11456586230062448e-02 4.79493966976240853e-03 3.69278724809870909e-02 1.16498140583489364e-02 3.44612178418956562e-03 1.08763171282771440e-02 6.12602672388378594e-03 6.72493743073657724e-02 1.49034796892757743e-02 7.79331209581890765e-03 -3.37320034963586716e-04 -4.87936099979496997e-05 3.71027074353255063e-04 2.54628575216144968e-04 -7.42677775029611166e-07 5.17500000000000071e-01 -1.95047963792929074e-02 -1.63420064843394219e-02 1.45655460840128214e-02 2.18739218197811058e-01 1.25972187359951415e-01 -8.67841075300875980e-02 5.78587044844587617e-03 5.37058657995253532e-04 1.43767732079507827e-03 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end
case random_multitype 8
types Ge Fe Ge Ge Fe Fe Ge Fe
cell 9 1.30000000000000000e+01 4.00000000000000022e-01 -2.00000000000000011e-01 0.00000000000000000e+00 1.40000000000000000e+01 2.99999999999999989e-01 0.00000000000000000e+00 0.00000000000000000e+00 1.35000000000000000e+01
positions 24 1.05195795123286806e+00 7.54513157485344976e+00 1.92678016605364433e+00 6.46852031811661554e+00 3.67791605244682529e+00 1.05287067051035566e+00 4.81735914385441433e+00 2.66519633158947888e+00 4.46326047297769435e+00 1.31815556951734236e+00 7.47518901279024117e+00 5.42123896216220835e+00 6.89722237837808461e+00 4.40524688937426134e+00 2.81634767538512243e+00 7.91697690449841840e+00 5.61941046163939095e+00 7.59164543829853056e+00 7.22363391762259788e+00 1.69287733412652353e+00 7.21909484608720842e+00 1.96643034124545912e+00 3.58552152099393107e+00 3.24131466612851726e+00
spins 24 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -7.93035969575581312e-01 -8.50622373758950362e-03 -1.58959621466146922e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -3.21782166655971369e-01 7.04734259188120715e-01 7.16111647147331332e-01 7.38660791723244614e-02 -3.32854884286343966e-01 4.08657239828918162e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -4.33378437932692290e-02 2.65331202826330936e-01 -1.14193824659042251e-01
potential 8 2.15707550850646079e-01 -2.43726337456634912e-01 2.13930079194878303e-01 2.16123856077828747e-01 -2.31481307468735409e-01 -2.47062276603585512e-01 2.15142543361219962e-01 -2.51236947078048445e-01
forces 24 6.34615637330380956e-05 -5.02459743042297743e-04 -5.99384892996981163e-04 -2.68099613265016835e-03 -1.00706560701106090e-05 -1.26684633950794982e-02 -1.90118740428299503e-03 3.55643941764862206e-03 8.80980979686956300e-04 5.17426865838154513e-04 -2.79077059376882635e-03 -8.56559374664988605e-04 5.77871896491252007e-03 -2.76651648124069845e-03 9.00584571290569125e-03 2.35759416989938798e-05 2.99171047055798219e-03 1.11361382719614953e-03 5.20245162867049075e-04 -2.85711767079652873e-03 -4.74332758691155308e-04 -2.32124496211659091e-03 2.37878525671185838e-03 3.59829990164382786e-03
virial 72 1.05321720098395643e-04 -4.30695206564730309e-04 2.57366018644380285e-04 -4.25407734719684657e-04 1.85870633180334772e-03 -7.06929528456331233e-04 2.39430697925433026e-04 -6.36871303867859702e-04 1.54104085507608657e-03 7.76136587333572416e-03 -2.70107150222537542e-04 -4.21906457159872562e-03 5.22002724898388941e-03 -1.47578721134889812e-03 -1.29243490571634488e-03 6.23335178687399374e-03 -6.42399751107122254e-03 6.50356665865778859e-03 -8.43054956368932858e-03 -3.50150430694847869e-03 -3.54253496177084739e-03 -1.79646713935201923e-03 -4.78670148463977881e-03 -1.05773291044887127e-03 -4.38192383820128813e-03 3.57096818226970225e-05 4.90110784502679336e-03 -7.13163004259696574e-05 4.82415903910226977e-04 4.08535676563553355e-04 4.72304599464483312e-04 -2.90850673133604028e-03 -1.87500842023573017e-03 3.67439136449899126e-04 -1.66242881064802752e-03 2.82386733828847815e-04 2.03208251509246797e-03 1.61973894940072244e-03 3.86578775113577628e-03 5.63811533802437365e-04 2.19378269962449204e-04 1.01196230107331985e-02 3.15525343534551290e-03 1.19960766029817388e-02 9.72905925745684921e-03 -1.34578300170182458e-03 -7.50839427102821858e-04 -3.34595268351329253e-04 -5.73589468484652547e-04 2.86742097603143306e-03 3.61273082674233408e-04 9.18377419185891137e-05 3.62723595717531853e-07 5.14463070187334663e-03 1.78852529402909210e-03 1.20490643745165904e-03 1.62610213068074914e-03 9.66168555726771129e-04 8.83396806590881246e-03 6.78280607801630062e-04 1.64516316648014352e-03 1.90939650180071909e-03 -2.24573414615466139e-04 1.16456350118888177e-02 3.14931888804355917e-03 -2.94223864472158538e-03 3.13932958235934798e-03 -1.15026735276418969e-02 -3.36838808558080583e-03 -3.04574200005391753e-03 -3.44797827631919884e-03 -1.02519754092531955e-03
mforces 24 -0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 1.25232242988702544e-02 -9.27350945145366014e-04 -8.63936799150220001e-04 0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 5.46268382192680209e-04 -1.77368399168831188e-02 -2.12377693745320791e-02 -2.70264158706451374e-03 7.05027819400777436e-03 -1.19220951426793620e-02 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 -2.58819641581737800e-04 -4.81584804477609880e-03 2.93910033364933260e-03
tau 24 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -1.40062515497872269e-04 -2.67581995125018785e-03 8.41948003722394920e-04 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 -2.26542601890131678e-03 -6.44274629332025877e-03 5.32242473444231780e-03 1.08718037237809568e-03 -2.23815627507492377e-04 -3.78811045464328756e-04 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 2.29894919544694693e-04 1.56929875921541369e-04 2.77381397112589983e-04
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end
case pbc_wrap 4
types Fe Ge Fe Ge
cell 9 1.40000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.30000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 1.50000000000000000e+01
positions 12 2.50000000000000000e-01 1.10000000000000009e+00 1.19999999999999996e+00 1.34499999999999993e+01 1.39999999999999991e+00 1.00000000000000000e+00 6.79999999999999982e+00 2.00000000000000011e-01 1.44000000000000004e+01 6.50000000000000000e+00 1.25000000000000000e+01 4.50000000000000011e-01
spins 12 6.99999999999999956e-01 -1.00000000000000006e-01 2.99999999999999989e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 5.00000000000000000e-01 2.00000000000000011e-01 -5.99999999999999978e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00
potential 4 -2.48347940835249498e-01 2.09775527219412200e-01 -2.46274235643900496e-01 2.10930603521767290e-01
forces 12 -7.04237531229936087e-03 4.83491598166676129e-03 -7.28821053406019347e-05 7.04237531229936087e-03 -4.83491598166676129e-03 7.28821053406019347e-05 2.81870350271142423e-03 1.76420308614317852e-04 -2.25100945531498623e-03 -2.81870350271142423e-03 -1.76420308614317852e-04 2.25100945531498623e-03
virial 36 -7.70703246270185334e-03 2.89013717351319262e-03 -1.92675811567546984e-03 2.89013717351319262e-03 -1.08380144006744658e-03 7.22534293378300756e-04 -1.92675811567546117e-03 7.22534293378297395e-04 -4.81689528918866918e-04 2.07313221286235892e-03 9.77795611820219540e-04 1.86845243140298803e-03 -7.77424579823384268e-04 -3.66673354432582219e-04 -7.00669661776120133e-04 5.18283053215589187e-04 2.44448902955054668e-04 4.67113107850746574e-04 3.89011038972254331e-04 9.07692424268593222e-04 -1.36153863640289265e-03 9.07692424268593113e-04 2.11794898996005027e-03 -3.17692348494008148e-03 -1.36153863640289287e-03 -3.17692348494008278e-03 4.76538522741013285e-03 4.56600011841172342e-04 -8.54766331684297942e-04 6.86235799808397129e-04 1.06540002762940266e-03 -1.99445477393002998e-03 1.60121686621959402e-03 -1.59810004144410518e-03 2.99168216089504627e-03 -2.40182529932939310e-03
mforces 12 -1.07296741635541527e-02 -9.74646821840268168e-04 -6.52724518179091055e-03 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 -1.27416851303500372e-02 -1.25634133351261446e-03 1.07213504739150263e-02 -0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00
tau 12 9.45118564731171548e-04 1.35016937818739136e-03 -1.75522019164360316e-03 0.00000000000000000e+00 0.00000000000000000e+00 -0.00000000000000000e+00 1.39046529467543663e-03 2.28433584125250881e-03 1.92016635931370038e-03 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00
descriptor 484 1.32323775964721009e-02 5.73079475144103109e-02 -8.33764214485616939e-02 -7.36506994980744723e-03 4.20875873242987641e-02 5.97083177864349722e-08 6.28222256221522301e-04 6.33540057757323461e-03 1.36606606145634564e-03 4.09499648212181561e-03 1.05200369434412074e-07 1.10619173175890918e-03 1.11488892844939375e-02 2.40256554089290008e-03 7.19794463611487557e-03 1.55241626245617427e-07 1.63148491776624114e-03 1.64342886489121688e-02 3.53969603771582151e-03 1.05992531896607345e-02 2.09832088221074935e-07 2.20410181420092888e-03 2.21915986711464924e-02 4.77745755194775631e-03 1.42989221424908927e-02 -1.20711422480023252e-11 1.29266068113577836e-05 -4.10809440839918596e-04 -4.08222268360331281e-05 2.10292244036169526e-04 4.42500000000000004e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 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end
case cutoff_boundary 3
types Fe Ge Fe
cell 9 3.00000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 3.00000000000000000e+01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 3.00000000000000000e+01
positions 9 1.00000000000000000e+01 1.00000000000000000e+01 1.00000000000000000e+01 1.59990000000000006e+01 1.00000000000000000e+01 1.00000000000000000e+01 1.60010000000000012e+01 1.00000000000000000e+01 1.00000000000000000e+01
spins 9 8.00000000000000044e-01 2.00000000000000011e-01 -1.00000000000000006e-01 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -2.00000000000000011e-01 2.99999999999999989e-01 9.00000000000000022e-01
potential 3 -2.41173890633830823e-01 1.96033810073553028e-01 -2.41449207912885100e-01
forces 9 4.02351250217068426e-07 -4.20019688226551291e-11 2.10009844113275645e-11 2.07655769615146424e-01 1.22572519052150364e+00 3.67717557141750362e+00 -2.07656171966396630e-01 -1.22572519047950168e+00 -3.67717557143850460e+00
virial 27 4.68723316390599029e-08 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 3.56767631364136558e-05 -2.45145012899001093e-03 -7.35435126886437116e-03 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -4.53449684551036924e-04 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00
mforces 9 -2.03158436171683617e-02 -5.07896121925435415e-03 2.53948060962717707e-03 -0.00000000000000000e+00 0.00000000000000000e+00 0.00000000000000000e+00 -3.53402727143480033e-04 -1.17271478140838839e-02 -3.51814434422516586e-02
tau 9 6.50985498426212088e-21 -1.25984905468052623e-10 -2.51969811387207572e-10 0.00000000000000000e+00 -0.00000000000000000e+00 0.00000000000000000e+00 -9.97186295290090522e-19 -7.35435114287946463e-03 2.45145038095982096e-03
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