Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_486450342170_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784385503736
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.01678011805781215
Energy: 0.421844384926124
Energy: 0.712479897001357
Energy: 0.4218315593152263
Energy: 0.016780118057555853
Energy: 0.42184438492538356
Energy: 0.23286816355728646
Energy: 0.4267203046271911
Energy: 0.01703287288430072
Energy: 0.2407398076753714
Energy: 0.017050482872352644
Energy: 0.42672030462796
Energy: 0.01703287288353182
Energy: 0.24073980767511508
Energy: 0.01678011805806845
Energy: 0.42184438492638027
Energy: 0.7124798970018695
Energy: 0.4218315593154826
Energy: 0.016780118057555853
Energy: 0.42184438492538356
Energy: 0.23286816355779905
Energy: 0.4267203046271911
Energy: 0.01703287288404442
Energy: 0.2407398076753714
Energy: 0.017050482872352644
Energy: 0.4267203046277037
Energy: 0.01703287288404442
Energy: 0.24073980767511508
Energy: 0.01678011805781215
Energy: 0.421844384926124
Energy: 0.23286816355628975
Energy: 0.4218315593154826
Energy: 0.016780118057555853
Energy: 0.42184438492461473
Energy: 0.23286816355754278
Energy: 0.4267203046271911
Energy: 0.01703287288430072
Energy: 0.2407398076753714
Energy: 0.017050482872352644
Energy: 0.4267203046277037
Energy: 0.01703287288404442
Energy: 0.24073980767511508

minimum gb energy = 0.016780118057555853 eV
minimum distance =  2.53365452948367 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.198088102986472
Energy: 1.1938809137413384
Energy: 1.203621255874291
Energy: 1.1996841843773294
Energy: 1.1980881029834105
Energy: 1.1938809137413384
Energy: 1.203621255874291
Energy: 1.0961807331635125
Energy: 1.136561014293272
Energy: 1.148863780393081
Energy: 1.1263891230528988
Energy: 1.0961807331635125
Energy: 1.136561014293272
Energy: 1.1488637803961426
Energy: 1.0726327650689265
Energy: 1.1235364881277292
Energy: 1.2251833167144195
Energy: 1.0947779981356853
Energy: 1.0726327650689265
Energy: 1.1235364881246679
Energy: 1.2251833167144195
Energy: 1.1585059040345127
Energy: 1.1386982223950808
Energy: 1.1936421983122165
Energy: 1.134138040884532
Energy: 1.1585059040314512
Energy: 1.1386982223950808
Energy: 1.1936421983122165
Energy: 1.0737687431697647
Energy: 1.0734761306474605
Energy: 1.2641731955322961
Energy: 1.1162151209919708
Energy: 1.0737687431728262
Energy: 1.0734761306474605
Energy: 1.2641731955322961
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Energy: 1.1336187223414227
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Energy: 1.297874036030369
Energy: 1.174821012106084
Energy: 1.082713352715191
Energy: 1.111212183331586
Energy: 1.2500172377737329
Energy: 1.076190374817862
Energy: 1.0785705316696512
Energy: 1.2825737637796115
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Energy: 1.0968183626169972
Energy: 1.33013401519295
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Energy: 1.1918122782619816
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Energy: 1.2294903842236002
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Energy: 1.1072730173573697
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Energy: 1.0811212282451585
Energy: 1.1961436393583318
Energy: 1.1333813479277488
Energy: 1.0830619608616103
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Energy: 1.1651343791320616
Energy: 1.3259416331165814
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Energy: 1.18256177714126
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Energy: 1.0784431280278133
Energy: 1.0937148164178188
Energy: 1.1252081661974618
Energy: 1.1340128644720877
Energy: 1.0784431280308748
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Energy: 1.1252081661974618
Energy: 1.0771924648614442
Energy: 1.09731467484595
Energy: 1.271159027349169
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Energy: 1.115265483620315
Energy: 1.3220683707964036
Energy: 1.0974159611707262
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Energy: 1.1476803608741784
Energy: 1.1430889756009355
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Energy: 1.1430889756009355
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Energy: 1.234963954695641
Energy: 1.1981209818657952
Energy: 1.1715094993392787
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Energy: 1.0953808552985191
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Energy: 1.2039048490529485
Energy: 1.0908038286536357
Energy: 1.1226641700694326
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Energy: 1.090803828650574
Energy: 1.1226641700724944
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Energy: 1.0676797095219892
Energy: 1.0774664876150062
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Energy: 1.0754333207764029
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Energy: 1.0672090307758852
Energy: 1.1140177039975965
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Energy: 1.0900383248540488
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Energy: 1.1140177039975965
Energy: 1.269314721243091
Energy: 1.0924647091529802
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Energy: 1.090892222699534
Energy: 1.0924647091499187
Energy: 1.086725647732156
Energy: 1.2020581641434729
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Energy: 1.1888281421281317
Energy: 1.2147293849361323
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Energy: 1.105549970377687
Energy: 1.1888281421250702
Energy: 1.2147293849330705
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Energy: 1.1981018718748142
Energy: 1.1897741951503398
Energy: 1.1374083180133505
Energy: 1.1114033307846907
Energy: 1.1981018718748142
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Energy: 1.1264730676235808
Energy: 1.1688901233508782
Energy: 1.138464691376312
Energy: 1.1008771049277035
Energy: 1.1264730676235808
Energy: 1.1688901233478166
Energy: 1.109278110611415
Energy: 1.1190477218173762
Energy: 1.1690029440832714
Energy: 1.1197174352984103
Energy: 1.1092781106084089
Energy: 1.1190477218143147
Energy: 1.169002944086333
Energy: 1.1635497109830253
Energy: 1.1212316225589762
Energy: 1.2406765015673438
Energy: 1.1984221735977318
Energy: 1.1635497109830253
Energy: 1.1212316225589762
Energy: 1.2406765015673438
Energy: 1.1131280237779857
Energy: 1.08544053012147
Energy: 1.1967108392468335
Energy: 1.1157625190712557
Energy: 1.113128023781047
Energy: 1.0854405301245318
Energy: 1.1967108392468335
Energy: 1.058581029795388
Energy: 1.0765494489446732
Energy: 1.241278523083725
Energy: 1.1138889313115277
Energy: 1.0585810297984495
Energy: 1.0765494489446732
Energy: 1.241278523083725
Energy: 1.07445871537427
Energy: 1.114678909136611
Energy: 1.292373226392908
Energy: 1.172930912243533
Energy: 1.07445871537427
Energy: 1.114678909136611
Energy: 1.292373226392908
Energy: 1.0542921676574777
Energy: 1.1239601203256597
Energy: 1.170624418667755
Energy: 1.0811296427645876
Energy: 1.054292167654416
Energy: 1.1239601203256597
Energy: 1.1706244186708163

minimum gb energy = 1.054292167654416 eV
minimum distance =  2.27713956341261 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.125053319863891
Energy: 1.2436874736279557
Energy: 1.2006273017406697
Energy: 1.19350418397687
Energy: 1.125053319864207
Energy: 1.2436874736275767
Energy: 1.2006273017392797
Energy: 1.0692251000185349
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Energy: 1.055369858276648
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Energy: 1.3208906616761575
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Energy: 1.0632679497581294
Energy: 1.1221382515370188
Energy: 1.183264158982857
Energy: 1.1047354791288602
Energy: 1.0632679497571185
Energy: 1.1221382515360079
Energy: 1.1832641589810877
Energy: 1.0967104365698017
Energy: 1.153368915923234
Energy: 1.1592576449423644
Energy: 1.13327654289567
Energy: 1.0967104365684117
Energy: 1.153368915921528
Energy: 1.1592576449433754
Energy: 1.1094273285621372
Energy: 1.1028569566544721
Energy: 1.173312664686798
Energy: 1.1674849992003369
Energy: 1.1094273285625162
Energy: 1.1028569566551671
Energy: 1.1733126646885041
Energy: 1.0649215133642551
Energy: 1.076519197121834
Energy: 1.1706992167898025
Energy: 1.171536469141634
Energy: 1.0649215133659613
Energy: 1.076519197122845
Energy: 1.1706992167918875
Energy: 1.0759655532922592
Energy: 1.1109528869878853
Energy: 1.2136796986087603
Energy: 1.2059399083505595
Energy: 1.07596555329327
Energy: 1.1109528869923717
Energy: 1.2136796986062959
Energy: 1.0859233429123054
Energy: 1.2436874736289667
Energy: 1.2006273017399747
Energy: 1.1935041839782603
Energy: 1.0859233429140749
Energy: 1.243687473628651
Energy: 1.2006273017395956
Energy: 1.0692251000185349
Energy: 1.1839578740325745
Energy: 1.2249998211977904
Energy: 1.1223707685199809
Energy: 1.069225100018156
Energy: 1.1839578740329535
Energy: 1.2249998211991806

minimum gb energy = 1.0552923040405793 eV
minimum distance =  2.28340417290383 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.2247909983202379
Energy: 1.1071705459299266
Energy: 1.2368580310114876
Energy: 1.1074291411846675
Energy: 1.2247909983210405
Energy: 1.1071705459295254
Energy: 1.2578365087695855
Energy: 1.1615819025005327
Energy: 1.1513476363864696
Energy: 1.1639813755884736
Energy: 1.0962813650708287
Energy: 1.1615819025001315
Energy: 1.1513476363860686
Energy: 1.1639813755876711
Energy: 1.1537832955877387
Energy: 1.1166592152048447
Energy: 1.2410254954076183
Energy: 1.112753357090326
Energy: 1.1537832955889424
Energy: 1.116659215204042
Energy: 1.2410254954076183
Energy: 1.0945867541553744
Energy: 1.0575226183587474
Energy: 1.2392067715374118
Energy: 1.1221391412551476
Energy: 1.0945867541553744
Energy: 1.057522618357945
Energy: 1.2392067715370103
Energy: 1.1326962614569822
Energy: 1.1184674158824832
Energy: 1.2983749724450662
Energy: 1.0933576684909458
Energy: 1.132696261456581
Energy: 1.1184674158812793
Energy: 1.3116559615671763
Energy: 1.120240629992266
Energy: 1.0726752853487374
Energy: 1.2126066118795988
Energy: 1.1241667578155603
Energy: 1.1202406299930685
Energy: 1.0726752853491384
Energy: 1.2126066118775922
Energy: 1.1236682004902747
Energy: 1.1782992133549555
Energy: 1.1124604811314138
Energy: 1.1433914865570538
Energy: 1.1236682004906762
Energy: 1.1782992133549555
Energy: 1.1124604811322163
Energy: 1.111553483920485
Energy: 1.09484827528653
Energy: 1.3595333272727184
Energy: 1.0865203683300138
Energy: 1.1115534839208865
Energy: 1.0948482752857274
Energy: 1.3595333272727184
Energy: 1.099030799910655
Energy: 1.061411319436294
Energy: 1.199074172761858
Energy: 1.0959275130060147
Energy: 1.0990307999110562
Energy: 1.0614113194366952
Energy: 1.1990741727630616
Energy: 1.10923193463503
Energy: 1.100232631892554
Energy: 1.3041894451568474
Energy: 1.223690400508262
Energy: 1.1092319346358326
Energy: 1.100232631892554
Energy: 1.3041894451564462
Energy: 1.1333244704922607
Energy: 1.0895931440734983
Energy: 1.2310932485265453
Energy: 1.0473241075729793
Energy: 1.1333244704914582
Energy: 1.089593144074301
Energy: 1.2310932485265453
Energy: 1.1526146179743173
Energy: 1.1537855851808674
Energy: 1.2653059561410658
Energy: 1.134902088051304
Energy: 1.1526146179747188
Energy: 1.1537855851820713
Energy: 1.2653059561418685
Energy: 1.1163445138224277
Energy: 1.1241635438054438
Energy: 1.1984784191993096
Energy: 1.0577932019805418
Energy: 1.1163445138220265
Energy: 1.1241635438054438
Energy: 1.1984784191989084
Energy: 1.0618193070917208
Energy: 1.1091318774876138
Energy: 1.247200350060821
Energy: 1.0982763721468352
Energy: 1.0618193070917208
Energy: 1.109131877486811
Energy: 1.2472003500612223
Energy: 1.097958250873914
Energy: 1.0581159449007456
Energy: 1.1984575357537062
Energy: 1.1028303070933323
Energy: 1.097958250873914
Energy: 1.058115944900344
Energy: 1.1984575357533047
Energy: 1.152517749632584
Energy: 1.1349178899525403
Energy: 1.265291736513954
Energy: 1.1431223107548651
Energy: 1.1525177496321828
Energy: 1.1349178899517378
Energy: 1.2652917365151577
Energy: 1.1338587503063497
Energy: 1.0714424350484424
Energy: 1.2311090988888413
Energy: 1.1220112988147366
Energy: 1.1338587503063497
Energy: 1.0714424350496463
Energy: 1.23110909888844
Energy: 1.1175511088877
Energy: 1.226563010043879
Energy: 1.3156128119612662
Energy: 1.1001885989688371
Energy: 1.1175511088877
Energy: 1.2265630100446816
Energy: 1.3156128119604638
Energy: 1.089159912481825
Energy: 1.0958677159855237
Energy: 1.2482358807030403
Energy: 1.0613179743823415
Energy: 1.0891599124802198
Energy: 1.0958677159851224
Energy: 1.2482358807022376
Energy: 1.111551223042244
Energy: 1.0867883376230254
Energy: 1.3436887910468636
Energy: 1.0949181446634788
Energy: 1.1115512230418425
Energy: 1.0867883376230254
Energy: 1.3436887910452586
Energy: 1.1236679149465119
Energy: 1.143318519880854
Energy: 1.2058488875507452
Energy: 1.1731778843627758
Energy: 1.1236679149461104
Energy: 1.143318519882058
Energy: 1.2058488875507452
Energy: 1.1202715468254778
Energy: 1.1255032363230675
Energy: 1.2124908378037058
Energy: 1.0496339889391442
Energy: 1.1202715468254778
Energy: 1.125503236322666
Energy: 1.2124908378037058
Energy: 1.1327277905346012
Energy: 1.094120795869229
Energy: 1.3170510600960756
Energy: 1.1184706401232507
Energy: 1.1327277905346012
Energy: 1.0941207958688277
Energy: 1.3075607691149904
Energy: 1.1043639183610157
Energy: 1.1433256445335067
Energy: 1.2386045404467234
Energy: 1.0575301745215213
Energy: 1.1043639183610157
Energy: 1.1433256445331053
Energy: 1.2386045404471246
Energy: 1.146013989272946
Energy: 1.0962368615419922
Energy: 1.1822897605290863
Energy: 1.1124675571082818
Energy: 1.1460139892725447
Energy: 1.0962368615423934
Energy: 1.2100355674484518
Energy: 1.1436908526553704
Energy: 1.096473367179799
Energy: 1.1636646279476732
Energy: 1.1377762541838599
Energy: 1.1436908526553704
Energy: 1.0964733671785951
Energy: 1.1636646279476732
Energy: 1.2247909983202379
Energy: 1.107170545929124
Energy: 1.3084882052886508
Energy: 1.1074291411846675
Energy: 1.2247909983202379
Energy: 1.1071705459295254
Energy: 1.3232071621749368
Energy: 1.1436679924336488
Energy: 1.1513476363860686
Energy: 1.1639813755876711
Energy: 1.1414760724832957
Energy: 1.1436679924328461
Energy: 1.1513476363864696
Energy: 1.1639813755880724
Energy: 1.1537832955889424
Energy: 1.116659215205647
Energy: 1.2410254954080198
Energy: 1.0962319328631904
Energy: 1.15378329558814
Energy: 1.1166592152048447
Energy: 1.241025495408421
Energy: 1.0945867541553744
Energy: 1.0575226183583462
Energy: 1.239206771536609
Energy: 1.1221391412547466
Energy: 1.0945867541553744
Energy: 1.0575226183575437
Energy: 1.2392067715374118
Energy: 1.132696261456581
Energy: 1.1184674158824832
Energy: 1.3116559615667753
Energy: 1.0933576684901434
Energy: 1.132696261456581
Energy: 1.1184674158816805
Energy: 1.3116559615667753
Energy: 1.1233762441445876
Energy: 1.0490323794984329
Energy: 1.212606611877191
Energy: 1.124166757816363
Energy: 1.1233762441445876
Energy: 1.0490323794996366
Energy: 1.212606611878395
Energy: 1.1236682004902747
Energy: 1.1782992133553565
Energy: 1.1124604811318148
Energy: 1.1433914865570538
Energy: 1.1236682004898735
Energy: 1.1782992133549555
Energy: 1.1124604811314138
Energy: 1.1115534839208865
Energy: 1.0948482752845237
Energy: 1.3595333272731198
Energy: 1.0865203683308162
Energy: 1.111553483920084
Energy: 1.0948482752857274
Energy: 1.3595333272731198
Energy: 1.0990307999114575
Energy: 1.084192593046891
Energy: 1.2481382683757065
Energy: 1.0959275130076198
Energy: 1.099030799910655
Energy: 1.0841925930484961
Energy: 1.199074172763463
Energy: 1.109231934636234
Energy: 1.1002326318917512
Energy: 1.3156847863815169
Energy: 1.2236904005070581
Energy: 1.1092319346346289
Energy: 1.1002326318921527
Energy: 1.3156847863811156

minimum gb energy = 1.0473241075729793 eV
minimum distance =  2.29662578332661 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.060399149484672
Energy: 1.0861955925296736
Energy: 1.1553206458048997
Energy: 1.08610447306757
Energy: 1.060399149480883
Energy: 1.0861955925306208
Energy: 1.155320645805847
Energy: 1.0464747058722874
Energy: 1.1195179848493093
Energy: 1.099772313363123
Energy: 1.1156317967216671
Energy: 1.0464747058713402
Energy: 1.1195179848502568
Energy: 1.099772313363123
Energy: 1.0645581530416788
Energy: 1.0074946421630087
Energy: 1.2771844598035005
Energy: 1.0419359906613466
Energy: 1.0645581530426258
Energy: 1.0074946421630087
Energy: 1.2771844598011326
Energy: 1.072425607636746
Energy: 1.0974485688688693
Energy: 1.1153857716543685
Energy: 1.150457369523767
Energy: 1.072425607636746
Energy: 1.0974485688688693
Energy: 1.1153857716557893
Energy: 1.101938164053912
Energy: 1.0579572129871833
Energy: 1.0401323952502777
Energy: 1.0408334830354498
Energy: 1.1019381640567536
Energy: 1.0579572129867094
Energy: 1.0401323952479098
Energy: 1.05447265955508
Energy: 1.063941818424358
Energy: 1.1853146647052228
Energy: 1.2009520610954405
Energy: 1.054472659556027
Energy: 1.0639418184262526
Energy: 1.185314664703802
Energy: 1.2006379030892882
Energy: 1.0409327864749465
Energy: 1.0728989898423527
Energy: 1.0421030285878994
Energy: 1.2006379030901926
Energy: 1.0409327864749465
Energy: 1.023517534305343
Energy: 1.080191685050891
Energy: 1.095498108468498
Energy: 1.1848989109304529
Energy: 1.0954771590888366
Energy: 1.0801916850504174
Energy: 1.0954981084694453
Energy: 1.1848989109304529
Energy: 1.2006828264811988
Energy: 1.0417397033936417
Energy: 1.12394614199372
Energy: 1.0409976167756447
Energy: 1.200682826479778
Energy: 1.0417397033926945
Energy: 1.1239461419913521
Energy: 1.0550187384763896
Energy: 1.2008851816247954
Energy: 1.185141415391234
Energy: 1.06387481678902
Energy: 1.0550187384735479
Energy: 1.2008851816257424
Energy: 1.1851414153931283
Energy: 1.1018804008297818
Energy: 1.041053190695968
Energy: 1.4457557061224282
Energy: 1.0578911637914492
Energy: 1.101880400830729
Energy: 1.0410531906940736
Energy: 1.3586299412007836
Energy: 1.056053063187163
Energy: 1.150146290537886
Energy: 1.1155299967991295
Energy: 1.09949636241813
Energy: 1.0560530631862157
Energy: 1.1501462905369388
Energy: 1.1155299967991295
Energy: 1.063696302637693
Energy: 1.041821530757947
Energy: 1.0928473166954114
Energy: 1.0076769649588135
Energy: 1.063696302636746
Energy: 1.0418215307565264
Energy: 1.0928473166973058
Energy: 1.0463641916263164
Energy: 1.1153827039947102
Energy: 1.0997468669612576
Energy: 1.1196944873317594
Energy: 1.046364191628211
Energy: 1.115382703996131
Energy: 1.0997468669603103
Energy: 1.0603991494827774
Energy: 1.0861955925296736
Energy: 1.155320645802058
Energy: 1.086104473068991
Energy: 1.0603991494837248
Energy: 1.0861955925306208
Energy: 1.1553206458034788
Energy: 1.0464747058732347
Energy: 1.1195179848493093
Energy: 1.0997723133640704
Energy: 1.1156317967221407
Energy: 1.046474705871814
Energy: 1.1195179848502568
Energy: 1.099772313363123
Energy: 1.0645581530416788
Energy: 1.0074946421630087
Energy: 1.2771844598025535
Energy: 1.0419359906613466
Energy: 1.0645581530407315
Energy: 1.0074946421630087
Energy: 1.2771844598011326
Energy: 1.0724256076376928
Energy: 1.0974485688693432
Energy: 1.115385771654842
Energy: 1.150457369523767
Energy: 1.0724256076381666
Energy: 1.0974485688717108
Energy: 1.115385771656263
Energy: 1.1019381640548596
Energy: 1.0579572129867094
Energy: 1.0401323952502777
Energy: 1.0408334830359234
Energy: 1.10193816405628
Energy: 1.0579572129876567
Energy: 1.0401323952450678
Energy: 1.0544726595565008
Energy: 1.0639418184267262
Energy: 1.1853146647052228
Energy: 1.2009520610944935
Energy: 1.0544726595565008
Energy: 1.0639418184267262
Energy: 1.185314664703802
Energy: 1.2006379030888146
Energy: 1.0409327864735256
Energy: 1.0235175343034488
Energy: 1.0421030285855315
Energy: 1.2006379030897618
Energy: 1.0409327864749465
Energy: 1.0235175343048695
Energy: 1.080191685050891
Energy: 1.0954981084680244
Energy: 1.1848989109318735
Energy: 1.0954771590883627
Energy: 1.0801916850499438
Energy: 1.0954981084689717
Energy: 1.1848989109323471
Energy: 1.2006828264807252
Energy: 1.0417397033936417
Energy: 1.1239461419922991
Energy: 1.040997616775171
Energy: 1.2006828264793044
Energy: 1.0417397033931681
Energy: 1.1239461419918257
Energy: 1.0550187384763896
Energy: 1.2008851816233745
Energy: 1.1851414153926547
Energy: 1.063874816787599
Energy: 1.0550187384740215
Energy: 1.2008851816247954
Energy: 1.1851414153926547
Energy: 1.1018804008283611
Energy: 1.0410531906954943
Energy: 1.4525230262976
Energy: 1.0578911637890815
Energy: 1.1018804008283611
Energy: 1.0410531906936002
Energy: 1.4525230262971263
Energy: 1.05605306318811
Energy: 1.1501462905383595
Energy: 1.1155299967986558
Energy: 1.0994963624176564
Energy: 1.0560530631876364
Energy: 1.1501462905369388
Energy: 1.115529996798182
Energy: 1.063696302636746
Energy: 1.0418215307584207
Energy: 1.0928473166944643
Energy: 1.0076769649588135
Energy: 1.063696302637693
Energy: 1.0418215307560528
Energy: 1.0928473166968322
Energy: 1.0463641916258428
Energy: 1.115382703993763
Energy: 1.099746866960784
Energy: 1.1196944873317594
Energy: 1.0463641916277373
Energy: 1.1153827039956574
Energy: 1.0997468669603103
Energy: 1.0603991494837248
Energy: 1.086195592530147
Energy: 1.1553206458030052
Energy: 1.0861044730685172
Energy: 1.0603991494818301
Energy: 1.0861955925310942
Energy: 1.1553206458025316
Energy: 1.046474705872761
Energy: 1.119517984849783
Energy: 1.0997723133635966
Energy: 1.1156317967221407
Energy: 1.0464747058708668
Energy: 1.1195179848512036
Energy: 1.0997723133635966

minimum gb energy = 1.0074946421630087 eV
minimum distance =  2.31425333891294 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.0717187286242105
Energy: 1.220026057353446
Energy: 1.0912580154340208
Energy: 1.2149854325509746
Energy: 1.0717187286253602
Energy: 1.220026057353446
Energy: 1.0912580154340208
Energy: 1.12140078512518
Energy: 1.1019849423112842
Energy: 1.1515378191287695
Energy: 1.0203774469272913
Energy: 1.12140078512403
Energy: 1.1019849423112842
Energy: 1.1515378191281949
Energy: 1.0796562570964232
Energy: 1.124213505246508
Energy: 1.1618357733569347
Energy: 1.020389291120487
Energy: 1.0796562570964232
Energy: 1.124213505247083
Energy: 1.1618357733563596
Energy: 1.1817654956711927
Energy: 1.0684934185557862
Energy: 1.2083298627593941
Energy: 1.0429159700074906
Energy: 1.1817654956723427
Energy: 1.0684934185563608
Energy: 1.2083298627605439
Energy: 1.039921984466144
Energy: 1.1001827279248324
Energy: 1.088047376393073
Energy: 1.1265900253127745
Energy: 1.039921984466719
Energy: 1.1001827279248324
Energy: 1.088047376393073
Energy: 1.1818645078121153
Energy: 1.0509950978021736
Energy: 1.1760417074676475
Energy: 1.0685949817868574
Energy: 1.1818645078115406
Energy: 1.0509950978021736
Energy: 1.1760417074676475
Energy: 1.0721874321407017
Energy: 1.1533601519398968
Energy: 1.1063859769551827
Energy: 1.0786856755872103
Energy: 1.0721874321424265
Energy: 1.1533601519416214
Energy: 1.1063859769551827
Energy: 1.0478456546213142
Energy: 1.112120145082069
Energy: 1.1838560938737193
Energy: 1.0626390358235982
Energy: 1.0478456546224642
Energy: 1.1121201450843687
Energy: 1.1838560938731444
Energy: 1.1207975650998758
Energy: 1.0582712242212204
Energy: 1.128414153855957
Energy: 1.1532686675365806
Energy: 1.1207975650981512
Energy: 1.0582712242200707
Energy: 1.128414153855957
Energy: 1.0396282772852117
Energy: 1.0944184284320964
Energy: 1.0727517872075396
Energy: 1.1152443094320195
Energy: 1.0396282772846366
Energy: 1.0944184284332463
Energy: 1.0727517872081143
Energy: 1.1610407784001315
Energy: 1.1459046519994256
Energy: 1.0603368590268816
Energy: 1.0226454452451126
Energy: 1.1610407783984071
Energy: 1.1459046519994256
Energy: 1.0603368590268816
Energy: 1.0323271327472856
Energy: 1.1991888873575784
Energy: 1.1283698995128009
Energy: 1.1184288989597755
Energy: 1.0323271327467105
Energy: 1.1991888873575784
Energy: 1.1283698995116511
Energy: 1.1603803263560448
Energy: 1.1452617576705355
Energy: 1.2377055150022584
Energy: 1.0733617328903229
Energy: 1.1603803263560448
Energy: 1.1452617576693858
Energy: 1.2377055150011085
Energy: 1.0349718034511148
Energy: 1.0802433610294229
Energy: 1.0484401784215887
Energy: 1.1570120690379329
Energy: 1.0349718034516897
Energy: 1.0802433610299977
Energy: 1.0484401784227384
Energy: 1.1664550741822028
Energy: 1.0819021030726013
Energy: 1.1964303262353373
Energy: 1.0237167264178717
Energy: 1.166455074180478
Energy: 1.0819021030731761
Energy: 1.1964303262347624
Energy: 0.995368800710229
Energy: 1.1275718250125686
Energy: 1.196910495261678
Energy: 1.1190419183782958
Energy: 0.995368800710804
Energy: 1.1275718250119937
Energy: 1.1969104952605283
Energy: 1.1591275973759192
Energy: 1.0036267921022595
Energy: 1.16849904301885
Energy: 1.0237121266365579
Energy: 1.1591275973759192
Energy: 1.0036267921022595
Energy: 1.16849904301885
Energy: 0.9935643224740065
Energy: 1.0754080854288146
Energy: 1.0426889873120468
Energy: 1.1088576051729904
Energy: 0.9935643224734315
Energy: 1.0754080854282397
Energy: 1.0426889873120468
Energy: 1.089172007045754
Energy: 1.068623538258638
Energy: 1.1738604461889803
Energy: 1.043267946579441
Energy: 1.0891720070463289
Energy: 1.068623538258638
Energy: 1.1738604461901303
Energy: 0.9906735152069186
Energy: 1.1382707410442925
Energy: 1.035836576265254
Energy: 1.1383462433912335
Energy: 0.9906735152074936
Energy: 1.1382707410442925
Energy: 1.035836576266404
Energy: 1.0892248260616528
Energy: 1.0494784565100566
Energy: 1.174177956815791
Energy: 1.0684903361776186
Energy: 1.089224826061078
Energy: 1.0494784565106314
Energy: 1.1741779568152162
Energy: 0.9935979225219005
Energy: 1.108902491241287
Energy: 1.0426363159381347
Energy: 1.0778868581801822
Energy: 0.9935979225230505
Energy: 1.108902491242437
Energy: 1.0426363159398593
Energy: 1.1590001881285428
Energy: 1.023635197191039
Energy: 1.2906163869471858
Energy: 1.0036444389439023
Energy: 1.1590001881285428
Energy: 1.0236351971898892
Energy: 1.2906163869483358
Energy: 0.9966698050687913
Energy: 1.1193175584317674
Energy: 1.1974158577653382
Energy: 1.1275689295588873
Energy: 0.9966698050682163
Energy: 1.1193175584329171
Energy: 1.1974158577647631
Energy: 1.1675138031861891
Energy: 1.0237224080739367
Energy: 1.259355803710771
Energy: 1.0822220493542831
Energy: 1.167513803186764
Energy: 1.0237224080727867
Energy: 1.2593558037096213

minimum gb energy = 0.9906735152069186 eV
minimum distance =  2.30088972893082 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.1362100393985985
Energy: 1.1690113973527754
Energy: 1.1453899110657382
Energy: 1.169530045714767
Energy: 1.1362100393953902
Energy: 1.1690113973527754
Energy: 1.1453899110625296
Energy: 1.135970588809442
Energy: 1.150491637677636
Energy: 1.1995446602614526
Energy: 1.162158293027325
Energy: 1.135970588809442
Energy: 1.1504916376808447
Energy: 1.1995446602646611
Energy: 1.1366506133809822
Energy: 1.1216915977257427
Energy: 1.1545798083341319
Energy: 1.1284067761702863
Energy: 1.1366506133809822
Energy: 1.1216915977289512
Energy: 1.1545798083341319
Energy: 1.0615655266700181
Energy: 1.1565884769926091
Energy: 1.2344102732070925
Energy: 1.152800314769237
Energy: 1.0615655266668094
Energy: 1.1565884769926091
Energy: 1.2344102732070925
Energy: 1.1447900689130153
Energy: 1.0804567096347635
Energy: 1.1068507577046822
Energy: 1.0796386106141247
Energy: 1.1447900689098067
Energy: 1.0804567096315547
Energy: 1.1068507577046822
Energy: 1.0692877992563794
Energy: 1.1056538544711088
Energy: 1.1868034493269755
Energy: 1.1314426631796481
Energy: 1.0692877992595877
Energy: 1.1056538544711088
Energy: 1.1868034493269755
Energy: 1.1366481591925608
Energy: 1.080552540334764
Energy: 1.1185705024513684
Energy: 1.0853859081043962
Energy: 1.1366481591893522
Energy: 1.0805525403283467
Energy: 1.133322474751629
Energy: 1.0299387654859118
Energy: 1.1251310948827122
Energy: 1.2225462431160097
Energy: 1.1255018513363675
Energy: 1.029938765482703
Energy: 1.1251310948858624
Energy: 1.2225462431160097
Energy: 1.1368068748771474
Energy: 1.0519332375787978
Energy: 1.1610288352230111
Energy: 1.0824201452566304
Energy: 1.1368068748803561
Energy: 1.0519332375820063
Energy: 1.1610288352230111
Energy: 1.0518593789092556
Energy: 1.118234257695151
Energy: 1.2500918789249447
Energy: 1.1414855678626503
Energy: 1.0518593789092556
Energy: 1.118234257695151
Energy: 1.2500918789281534
Energy: 1.1108435577592732
Energy: 1.1355621343782818
Energy: 1.2629048293059895
Energy: 1.057603816520097
Energy: 1.1108435577624818
Energy: 1.1355621343814903
Energy: 1.2629048293059895
Energy: 1.051872512696505
Energy: 1.0959781447537
Energy: 1.3011935202557225
Energy: 1.1168554486696092
Energy: 1.0518725126997135
Energy: 1.0959781447504917
Energy: 1.3011935202557225
Energy: 1.128199699994124
Energy: 1.1137565542655194
Energy: 1.2811892844475223
Energy: 1.1021425502593556
Energy: 1.1281996999973327
Energy: 1.1137565542655194
Energy: 1.281189284444314
Energy: 1.1301105332082864
Energy: 1.1965104494677936
Energy: 1.3120360497760961
Energy: 1.1856235624020435
Energy: 1.1301105332114951
Energy: 1.1965104494710024
Energy: 1.3120360497760961
Energy: 1.1282117825471656
Energy: 1.1362934426057136
Energy: 1.285361878117586
Energy: 1.1965700038778624
Energy: 1.1282117825471656
Energy: 1.1362934426089222
Energy: 1.285361878117586
Energy: 1.1296795961570245
Energy: 1.0959731862095583
Energy: 1.2557964954384937
Energy: 1.1584215258467119
Energy: 1.129679596153816
Energy: 1.0959731862095583
Energy: 1.2557964954384937
Energy: 1.1377590216641136
Energy: 1.1153641064523352
Energy: 1.3429134029990912
Energy: 1.1035390140230534
Energy: 1.1377590216609048
Energy: 1.1153641064555437
Energy: 1.3429134030022998
Energy: 1.0481206153132732
Energy: 1.0956256462780847
Energy: 1.1596121784650983
Energy: 1.1905425408100145
Energy: 1.0481206153164822
Energy: 1.0956256462780847
Energy: 1.159612178468307
Energy: 1.1299781791051131
Energy: 1.1406844507595673
Energy: 1.2813490052336867
Energy: 1.1461218631395793
Energy: 1.129978179108322
Energy: 1.1406844507595673
Energy: 1.2813490052304781
Energy: 1.0620073366065597
Energy: 1.1154032422274418
Energy: 1.1581898827702133
Energy: 1.1192038197594785
Energy: 1.0620073366129767
Energy: 1.1154032422274418
Energy: 1.1581898827670045
Energy: 1.0973193009176938
Energy: 1.088497356888625
Energy: 1.2645535074739087
Energy: 1.1901281179575027
Energy: 1.0973193009176938
Energy: 1.088497356888625
Energy: 1.2645535074739087
Energy: 1.0906008610303726
Energy: 1.1256431620259033
Energy: 1.1396057118514455
Energy: 1.0774028651607581
Energy: 1.0906008610303726
Energy: 1.1256431620259033
Energy: 1.1396057118514455
Energy: 1.0984729631261883
Energy: 1.1138933608390398
Energy: 1.1509009268460235
Energy: 1.1496376620350366
Energy: 1.09847296312298
Energy: 1.1138933608422483
Energy: 1.1509009268524406
Energy: 1.1108429357988643
Energy: 1.088414689867213
Energy: 1.1474449377035276
Energy: 1.0652878348587485
Energy: 1.1108429357956557
Energy: 1.088414689867213
Energy: 1.1474449377035276
Energy: 1.0896278720529775
Energy: 1.1465969995752823
Energy: 1.1998347636251223
Energy: 1.202036680333039
Energy: 1.0896278720561863
Energy: 1.1465969995720735
Energy: 1.1699927408506055
Energy: 1.0431644488535425
Energy: 1.138566306629533
Energy: 1.199856382785655
Energy: 1.1424639201579312
Energy: 1.0431644488535425
Energy: 1.138566306629533
Energy: 1.1998563827824464
Energy: 1.2220177374226262
Energy: 1.147335680518793
Energy: 1.1461712100538028
Energy: 1.1918296821347996
Energy: 1.222017737425835
Energy: 1.147335680518793
Energy: 1.1461712100538028
Energy: 1.0373336707498433
Energy: 1.1996852850224267
Energy: 1.187620223918948
Energy: 1.1973879515593224
Energy: 1.0373336707466347
Energy: 1.1996852850192181
Energy: 1.1876202239221567
Energy: 1.2049102314872318
Energy: 1.123935035908519
Energy: 1.1263230335232042
Energy: 1.17650484352808
Energy: 1.2049102314904405
Energy: 1.1239350359117275
Energy: 1.1263230335232042
Energy: 1.0446566099769923
Energy: 1.1239538654487045
Energy: 1.1779294982306907
Energy: 1.1529036413682752
Energy: 1.0446566099802008
Energy: 1.1239538654519132
Energy: 1.1779294982242734
Energy: 1.118049199496093
Energy: 1.1240701720518753
Energy: 1.190760616396191
Energy: 1.1715898149097175
Energy: 1.1180491994928845
Energy: 1.1240701720486665
Energy: 1.190760616396191
Energy: 1.0744993402694172
Energy: 1.0859840145439572
Energy: 1.15671160851528
Energy: 1.1056398535280465
Energy: 1.0744993402662086
Energy: 1.0859840145407484
Energy: 1.1567116085120712
Energy: 1.1246390387494192
Energy: 1.063485076968153
Energy: 1.1918500269620913
Energy: 1.151104296699046
Energy: 1.1246390387494192
Energy: 1.063485076968153
Energy: 1.191850026955674
Energy: 1.058394356466039
Energy: 1.086211254910201
Energy: 1.084535245136794
Energy: 1.0958539594887102
Energy: 1.058394356466039
Energy: 1.086211254910201
Energy: 1.0845352451400025
Energy: 1.0588402963674703
Energy: 1.0439685998150918
Energy: 1.213422021602411
Energy: 1.1618365444910452
Energy: 1.058840296364262
Energy: 1.0439685998183001
Energy: 1.2134220215992024
Energy: 1.058284056642476
Energy: 1.0462477621965942
Energy: 1.1215268424869198
Energy: 1.0543233708085553
Energy: 1.058284056642476
Energy: 1.0462477621933854
Energy: 1.1215268424869198
Energy: 1.0751602684150372
Energy: 1.0559982900624914
Energy: 1.2272161990653614
Energy: 1.1553881855732768
Energy: 1.0751602684150372
Energy: 1.0559982900592826
Energy: 1.227216199071779
Energy: 1.0601962364439232
Energy: 1.026825083753788
Energy: 1.2054781479170937
Energy: 1.0545473079835683
Energy: 1.0601962364439232
Energy: 1.026825083753788
Energy: 1.2054781479170937
Energy: 1.0754787581801164
Energy: 1.0965834799627654
Energy: 1.3202353028351574
Energy: 1.1702301149593377
Energy: 1.0754787581833252
Energy: 1.0965834799627654
Energy: 1.320235302831949
Energy: 1.0806423592774386
Energy: 1.0892292860822521
Energy: 1.1728832968667402
Energy: 1.1025229778427
Energy: 1.0806423592774386
Energy: 1.0892292860790436
Energy: 1.1728832968667402
Energy: 1.1562992870279936
Energy: 1.1076323440982407
Energy: 1.3312878171768854
Energy: 1.1666655457824548
Energy: 1.1562992870279936
Energy: 1.1076323440982407
Energy: 1.3312878171800944
Energy: 1.0809552903310333
Energy: 1.1612894887957197
Energy: 1.2326185427640695
Energy: 1.1695638301795586
Energy: 1.0809552903310333
Energy: 1.1612894887957197
Energy: 1.2326185427576524
Energy: 1.1511258649210374
Energy: 1.1075713897264003
Energy: 1.2749060439094375
Energy: 1.1357850896623636
Energy: 1.1511258649242462
Energy: 1.1075713897231916
Energy: 1.2749060439094375
Energy: 1.0988125219733493
Energy: 1.113724905181686
Energy: 1.2785725081548263
Energy: 1.1041279145307268
Energy: 1.098812521976558
Energy: 1.113724905181686
Energy: 1.2785725081548263
Energy: 1.058442755986303
Energy: 1.1080947966943258
Energy: 1.2668609015997854
Energy: 1.1373006292662755
Energy: 1.0584427559830942
Energy: 1.1080947966943258
Energy: 1.2668609015965766

minimum gb energy = 1.026825083753788 eV
minimum distance =  2.27665621596407 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9234205266598007
Energy: 1.1536200175202262
Energy: 1.1533476293933491
Energy: 1.1536200175202262
Energy: 0.9480663948219644
Energy: 1.1533476293955192
Energy: 1.153620017519503
Energy: 1.0316474807147846
Energy: 1.1536200175209497
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 0.9480663949253819
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 1.2661632894354526
Energy: 1.153620017519503
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663948566891
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.948066394934063
Energy: 1.1536200175202262
Energy: 1.1533476293940723
Energy: 1.153620017519503
Energy: 0.9480663948248581
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 1.0316474808312237
Energy: 1.1536200175202262
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663950172246
Energy: 1.1533476293955192
Energy: 1.1536200175209497
Energy: 1.0132542565397893
Energy: 1.153620017519503
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663950439585
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.94461915015863
Energy: 1.1536200175202262
Energy: 1.1533476293933491
Energy: 1.153620017519503
Energy: 0.9480663948855932
Energy: 1.1533476293955192
Energy: 1.153620017519503
Energy: 0.9937865617138228
Energy: 1.1536200175209497
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663948617529
Energy: 1.1533476293955192
Energy: 1.1536200175202262
Energy: 0.9937865618946146
Energy: 1.1536200175187794
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663948913807
Energy: 1.1533476293955192
Energy: 1.1536200175223965
Energy: 0.9480663949181475
Energy: 1.1536200175202262
Energy: 1.1533476293940723
Energy: 1.1536200175202262
Energy: 0.948066394855242
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663948545187
Energy: 1.1536200175209497
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663947916133
Energy: 1.1533476293955192
Energy: 1.1536200175209497
Energy: 0.9480663946722803
Energy: 1.153620017519503
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663948480077
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 0.9480663948631998
Energy: 1.153620017519503
Energy: 1.1533476293933491
Energy: 1.1536200175202262
Energy: 0.9480663948501781
Energy: 1.1533476293955192
Energy: 1.1536200175202262
Energy: 0.9480663948537952
Energy: 1.1536200175209497
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 0.9480663948024646
Energy: 1.1533476293955192
Energy: 1.1536200175209497
Energy: 0.9480663947988475
Energy: 1.153620017519503
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 0.9480663948140067
Energy: 1.153347629394796
Energy: 1.1536200175216733
Energy: 0.9480663949514253
Energy: 1.1536200175202262
Energy: 1.1533476293940723
Energy: 1.1536200175209497
Energy: 0.9480663949217646
Energy: 1.1533476293955192
Energy: 1.153620017519503
Energy: 0.9480663948472843
Energy: 1.1536200175202262
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663948639232
Energy: 1.1533476293955192
Energy: 1.1536200175216733
Energy: 0.9480663948899338
Energy: 1.153620017519503
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663948429437
Energy: 1.153347629394796
Energy: 1.1536200175209497
Energy: 0.9480663949579032
Energy: 1.153620017519503
Energy: 1.1533476293933491
Energy: 1.1536200175187794
Energy: 0.9480663949673077
Energy: 1.153347629394796
Energy: 1.1536200175202262
Energy: 0.948066394829922
Energy: 1.1536200175209497
Energy: 1.153347629394796
Energy: 1.153620017519503
Energy: 0.9480663948328157

minimum gb energy = 0.9234205266598007 eV
minimum distance =  2.38654259234476 Angstroms
sigma value = 23