Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Mo
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=3.1465589627623562
cohesive_energy=6.810535640520251
mass=95.95
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: 0.02130304126832874
Energy: 0.36974565103308665
Energy: 0.021303041268028317
Energy: 0.3697456510327487
Energy: 0.02130304126832874
Energy: 0.36974565103308665
Energy: 0.02130304126832874
Energy: 0.023132857294682677
Energy: 0.7354358167337344
Energy: 0.023132857294682677
Energy: 0.7354358167340723
Energy: 0.023132857294682677
Energy: 0.735435816733434
Energy: 0.023132857294682677
Energy: 1.899974170179524
Energy: 0.6977128354548136
Energy: 2.315384417549063
Energy: 0.6977128354541752
Energy: 0.021624664221463325
Energy: 0.6977128354544756
Energy: 0.0216246642218013
Energy: 0.02313285729532108
Energy: 0.7354358167337344
Energy: 0.023132857295020653
Energy: 0.7354358167340723
Energy: 0.02313285729532108
Energy: 0.735435816733434
Energy: 0.023132857295020653
Energy: 0.02130304126832874
Energy: 0.3697456510327487
Energy: 0.02130304126832874
Energy: 0.36974565103211027
Energy: 0.02130304126832874
Energy: 0.3697456510327487
Energy: 0.02130304126832874
Energy: 0.02313285729565906
Energy: 0.735435816733434
Energy: 0.023132857295020653
Energy: 0.7354358167337344
Energy: 0.02313285729532108
Energy: 0.7354358167337344
Energy: 0.023132857294682677

minimum gb energy = 0.021303041268028317 eV
minimum distance =  2.71888024905503 Angstroms
sigma value = 5


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

Energy: 2.13328731302139
Energy: 2.1185415836780677
Energy: 2.133287313017352
Energy: 2.1185415836821053
Energy: 2.13328731302139
Energy: 2.1185415836780677
Energy: 2.133287313017352
Energy: 2.063862132948097
Energy: 2.0502357294117717
Energy: 2.063862132944059
Energy: 2.0502357294117717
Energy: 2.063862132948097
Energy: 2.0502357294117717
Energy: 2.063862132944059
Energy: 1.8993497807034858
Energy: 1.9774998052245738
Energy: 1.8993497806994486
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Energy: 1.8993497807034858
Energy: 1.9774998052245738
Energy: 1.8993497806994486
Energy: 1.930068460047368
Energy: 2.0355552874471616
Energy: 1.9300684600433309
Energy: 2.0355552874511993
Energy: 1.930068460047368
Energy: 2.0355552874471616
Energy: 1.9300684600433309
Energy: 1.915613047104227
Energy: 2.0414661699004073
Energy: 1.915613047104227
Energy: 2.0414661699044445
Energy: 1.915613047104227
Energy: 2.0414661699004073
Energy: 1.915613047104227
Energy: 2.078135592685942
Energy: 2.0660411498090436
Energy: 2.07813559268998
Energy: 2.0660411498090436
Energy: 2.07813559268998
Energy: 2.0660411498090436
Energy: 2.07813559268998
Energy: 2.0153235583716227
Energy: 2.049390546284736
Energy: 2.0153235583716227
Energy: 2.049390546288773
Energy: 2.0153235583716227
Energy: 2.049390546284736
Energy: 2.0153235583716227
Energy: 1.9695051708993248
Energy: 2.0434086160676497
Energy: 1.9695051708993248
Energy: 2.043408616071687
Energy: 1.9695051708993248
Energy: 2.0434086160676497
Energy: 1.9695051709033622
Energy: 1.958044647546056
Energy: 2.042748098319744
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Energy: 2.0427480983157063
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Energy: 2.042748098319744
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Energy: 1.9323286934747015
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Energy: 1.9323286934747015
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Energy: 1.996479871043759
Energy: 1.9694003415699064
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Energy: 1.9694003415658692
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Energy: 1.9759688780829874
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Energy: 1.970020419888737
Energy: 2.094882412062066
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Energy: 2.094882412062066
Energy: 1.970020419888737
Energy: 2.0948824120580287
Energy: 1.970020419888737
Energy: 1.959934943295747
Energy: 2.017975796026251
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Energy: 2.0179757960222133
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Energy: 2.017975796026251
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Energy: 2.002947455603729
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Energy: 2.002947455607767
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Energy: 2.002947455603729
Energy: 2.0215421722973947
Energy: 2.002947455607767
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Energy: 1.9955802665486027
Energy: 1.8990915267983446
Energy: 1.9955802665486027
Energy: 1.8990915267983446
Energy: 1.9955802665486027
Energy: 1.8990915267943074
Energy: 2.0849599037576856
Energy: 2.0913683800977583
Energy: 2.0849599037576856
Energy: 2.0913683800937206
Energy: 2.0849599037576856
Energy: 2.0913683800937206
Energy: 2.0849599037576856
Energy: 1.9201578232962642
Energy: 2.012792369041773
Energy: 1.9201578232962642
Energy: 2.012792369041773
Energy: 1.9201578232922267
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Energy: 1.9201578232962642
Energy: 2.027586280985358
Energy: 1.9685652102903382
Energy: 2.0275862809813208
Energy: 1.9685652102903382
Energy: 2.027586280985358
Energy: 1.9685652102863014
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Energy: 2.0198401150758163
Energy: 1.9815690189165205
Energy: 2.0198401150758163
Energy: 1.9815690189165205
Energy: 2.0198401150758163
Energy: 1.9815690189165205
Energy: 2.0198401150758163
Energy: 1.9612447176186447
Energy: 1.9088021660165506
Energy: 1.9612447176186447
Energy: 1.9088021660165506
Energy: 1.9612447176226817
Energy: 1.9088021660165506
Energy: 1.9612447176186447
Energy: 1.9474449104146774
Energy: 1.8925742734212079
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Energy: 1.8925742734252453
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Energy: 1.8925742734212079
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Energy: 1.9610313974290075
Energy: 2.011316904443334
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Energy: 2.0113169044392967
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Energy: 1.9610313974290075
Energy: 1.9639550498618954
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Energy: 2.031663799392316
Energy: 1.9639550498659328
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Energy: 2.0145577823464347
Energy: 2.072988698437157
Energy: 2.0145577823464347
Energy: 2.072988698437157
Energy: 2.0145577823464347
Energy: 2.072988698437157
Energy: 2.0145577823464347
Energy: 2.163880226179653
Energy: 2.1347908043020687
Energy: 2.163880226179653
Energy: 2.1347908043020687
Energy: 2.163880226179653
Energy: 2.1347908043020687
Energy: 2.1638802261836902
Energy: 1.9047253847060872
Energy: 2.052799401276586
Energy: 1.9047253847020498
Energy: 2.052799401276586
Energy: 1.9047253847060872
Energy: 2.052799401276586
Energy: 1.9047253847020498
Energy: 2.1300791081355834
Energy: 2.0471966299000353
Energy: 2.130079108131546
Energy: 2.0471966299000353
Energy: 2.1300791081355834
Energy: 2.0471966299000353
Energy: 2.1300791081355834
Energy: 1.9022462035964312
Energy: 1.9657458366618237
Energy: 1.902246203592394
Energy: 1.9657458366618237
Energy: 1.9022462035964312
Energy: 1.9657458366618237
Energy: 1.9022462035964312
Energy: 2.025878602524628
Energy: 2.107483432338904
Energy: 2.0258786025286653
Energy: 2.107483432338904
Energy: 2.0258786025286653
Energy: 2.107483432338904
Energy: 2.0258786025286653
Energy: 1.9654284185708408
Energy: 2.142799173010772
Energy: 1.9654284185506548
Energy: 2.1427991730067344
Energy: 1.9654284185546917
Energy: 2.1427991730067344
Energy: 1.9654284185587292
Energy: 2.058483666774343
Energy: 1.9507596814624382
Energy: 2.058483666774343
Energy: 1.9507596814624382
Energy: 2.058483666774343
Energy: 1.9507596814624382
Energy: 2.058483666774343
Energy: 1.922534698553734
Energy: 1.95287623375149
Energy: 1.922534698553734
Energy: 1.9528762337434156
Energy: 1.922534698553734
Energy: 1.9528762337474526
Energy: 1.922534698553734
Energy: 1.9029792419099176
Energy: 2.057351263391636
Energy: 1.902979241913955
Energy: 2.057351263391636
Energy: 1.9029792419058806
Energy: 2.057351263391636
Energy: 1.9029792419058806
Energy: 1.9385556296277575
Energy: 2.044782641593418
Energy: 1.9385556296277575
Energy: 2.0447826415894546
Energy: 1.9385556296277575
Energy: 2.044782641593418
Energy: 1.9385556296277575
Energy: 2.021407891874673
Energy: 2.044734579627594
Energy: 2.0214078918706355
Energy: 2.044734579627594
Energy: 2.021407891874673
Energy: 2.044734579627594
Energy: 2.0214078918706355
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Energy: 2.134790589484748
Energy: 2.160433634198301
Energy: 2.134790589484748
Energy: 2.160433634198301
Energy: 2.134790589484748
Energy: 2.160433634198301
Energy: 1.957045473482112
Energy: 2.0461290992395047
Energy: 1.957045473482112
Energy: 2.0461290992354675
Energy: 1.9570454734780747
Energy: 2.0461290992395047
Energy: 1.957045473482112
Energy: 1.9722903878973235
Energy: 2.040629669922178
Energy: 1.9722903878973235
Energy: 2.040629669922178
Energy: 1.972290387901361
Energy: 2.040629669922178
Energy: 1.9722903878973235
Energy: 1.9052948601703725
Energy: 1.9253652360590199
Energy: 1.9052948601703725
Energy: 1.9253652360590199
Energy: 1.9052948601703725
Energy: 1.9253652360549824
Energy: 1.9052948601703725
Energy: 2.0961451450523882
Energy: 1.9987897084518123
Energy: 2.096145145056425
Energy: 1.9987897084477753
Energy: 2.0961451450523882
Energy: 1.9987897084477753
Energy: 2.096145145056425
Energy: 1.9953388196894752
Energy: 1.9878927579222796
Energy: 1.9953388196894752
Energy: 1.9878927579222796
Energy: 1.9953388196894752
Energy: 1.9878927579222796
Energy: 1.9953388196854378
Energy: 2.0854969109980064
Energy: 2.057731337198591
Energy: 2.0854969110020436
Energy: 2.057731337202628
Energy: 2.0854969109980064
Energy: 2.057731337198591
Energy: 2.0854969110020436
Energy: 1.9337773795018813
Energy: 2.0076155702769185
Energy: 1.9337773795018813
Energy: 2.0076155702769185
Energy: 1.9337773795018813
Energy: 2.0076155702728817
Energy: 1.9337773795018813
Energy: 1.902867635427712
Energy: 2.0254247542578105
Energy: 1.902867635427712
Energy: 2.025424754261848
Energy: 1.902867635427712
Energy: 2.0254247542578105
Energy: 1.902867635427712
Energy: 1.9166616375403005
Energy: 2.0286402638393892
Energy: 1.9166616375403005
Energy: 2.028640263843426
Energy: 1.9166616375443377
Energy: 2.0286402638393892
Energy: 1.9166616375403005
Energy: 1.936413871949962
Energy: 2.0017232153053413
Energy: 1.936413871949962
Energy: 2.0017232153053413
Energy: 1.936413871949962
Energy: 2.0017232153053413
Energy: 1.936413871949962

minimum gb energy = 1.8925742734212079 eV
minimum distance =  2.48239912801915 Angstroms
sigma value = 401


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

Energy: 2.132397827280998
Energy: 2.173491589727486
Energy: 2.132397827283331
Energy: 2.173491589729319
Energy: 2.1323978272805815
Energy: 2.173491589730652
Energy: 2.1323978272824142
Energy: 1.9639431009378425
Energy: 1.992311432898819
Energy: 1.963943100939176
Energy: 1.9923114328969862
Energy: 1.9639431009396755
Energy: 1.9923114328979026
Energy: 1.9639431009396755
Energy: 1.9692150946618703
Energy: 1.941774188644392
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Energy: 1.9692150946637035
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Energy: 1.9593722826573354
Energy: 2.0797218752345286
Energy: 1.9593722826582518
Energy: 2.0797218752359448
Energy: 1.9593722826600852
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Energy: 1.9593722826578355
Energy: 2.005429906691524
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Energy: 2.0637637032498457
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Energy: 2.0637637032489295
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Energy: 2.0609470140246673
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Energy: 2.0609470140265005
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Energy: 2.092903195625238
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Energy: 2.017018825850082
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Energy: 2.1734915897265696
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Energy: 2.0797218752359448
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Energy: 2.0637637032484295
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Energy: 1.9916923792405035
Energy: 2.064142537971501
Energy: 1.9916923792423364
Energy: 1.958287878676827
Energy: 2.094230896540804
Energy: 1.958287878674994
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Energy: 1.9582878786731608
Energy: 2.0942308965398877
Energy: 1.9582878786745774
Energy: 1.909444443507379
Energy: 2.151287537471256
Energy: 1.9094444435064624
Energy: 2.1512875374699223
Energy: 1.9094444435082951
Energy: 2.1512875374699223
Energy: 1.9094444435077953
Energy: 1.977775892014702
Energy: 2.0049112259382578
Energy: 1.9777758920137853
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Energy: 1.9777758920151187
Energy: 2.0049112259386743
Energy: 1.977775892014702
Energy: 2.0170188258491653
Energy: 2.023774075674966
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Energy: 2.0237740756731326
Energy: 2.017018825850082
Energy: 2.0237740756717995
Energy: 2.017018825850998
Energy: 2.1323978272819146
Energy: 2.173491589727903
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Energy: 2.1734915897297356
Energy: 2.132397827280998
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Energy: 2.1323978272824142
Energy: 1.963943100938259
Energy: 1.992311432899319
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Energy: 1.9923114328969862
Energy: 1.9639431009405923
Energy: 1.992311432898819
Energy: 1.9639431009387591
Energy: 1.9692150946618703
Energy: 1.941774188644392
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Energy: 1.9417741886448086
Energy: 1.96921509466462
Energy: 1.9417741886453086
Energy: 1.9692150946618703
Energy: 1.9593722826578355
Energy: 2.0797218752345286
Energy: 1.9593722826587516
Energy: 2.0797218752359448
Energy: 1.9593722826600852
Energy: 2.0797218752345286
Energy: 1.9593722826587516
Energy: 2.0054299066911074
Energy: 2.0637637032489295
Energy: 2.0054299066906074
Energy: 2.0637637032502623
Energy: 2.005429906691524
Energy: 2.0637637032498457
Energy: 2.0054299066924406
Energy: 2.0609470140237502
Energy: 2.092864478898912
Energy: 2.060947014025584
Energy: 2.092864478899412
Energy: 2.060947014025584
Energy: 2.092864478900329
Energy: 2.060947014023334
Energy: 2.0364184985573575
Energy: 2.092903195625238
Energy: 2.0364184985560243
Energy: 2.092903195625655
Energy: 2.036418498554608
Energy: 2.0929031956261546
Energy: 2.0364184985541915
Energy: 1.9838807634158642
Energy: 2.0642502762520847
Energy: 1.9838807634144475
Energy: 2.064250276251168
Energy: 1.9838807634158642
Energy: 2.0642502762543344
Energy: 1.9838807634135311
Energy: 1.9916923792441696
Energy: 2.0641425379724176
Energy: 1.9916923792423364
Energy: 2.0641425379719176
Energy: 1.9916923792405035
Energy: 2.064142537971501
Energy: 1.9916923792427532
Energy: 1.958287878676827
Energy: 2.094230896540804
Energy: 1.9582878786745774
Energy: 2.094230896540804
Energy: 1.958287878674994
Energy: 2.094230896540804
Energy: 1.9582878786754936
Energy: 1.909444443506879
Energy: 2.151287537471256
Energy: 1.9094444435050457
Energy: 2.1512875374694227
Energy: 1.9094444435082951
Energy: 2.1512875374717555
Energy: 1.909444443507379
Energy: 1.977775892014702
Energy: 2.0049112259382578
Energy: 1.977775892012869
Energy: 2.004911225937341
Energy: 1.977775892014202
Energy: 2.0049112259410076
Energy: 1.9777758920137853
Energy: 2.0170188258491653
Energy: 2.023774075674549
Energy: 2.0170188258524147
Energy: 2.0237740756717995
Energy: 2.0170188258505815
Energy: 2.023774075670883
Energy: 2.017018825851498
Energy: 2.1323978272819146
Energy: 2.173491589726986
Energy: 2.132397827283331
Energy: 2.173491589729319
Energy: 2.1323978272819146
Energy: 2.1734915897297356
Energy: 2.132397827284248
Energy: 1.9639431009378425
Energy: 1.9923114328997353
Energy: 1.9639431009405923
Energy: 1.9923114328974858
Energy: 1.963943100939176
Energy: 1.9923114328984024
Energy: 1.9639431009387591

minimum gb energy = 1.9094444435050457 eV
minimum distance =  2.51280456146374 Angstroms
sigma value = 311


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

Energy: 2.0922945077134334
Energy: 2.184662871484631
Energy: 1.9971818255043918
Energy: 2.063297959368528
Energy: 2.0922945077134334
Energy: 2.18466287148516
Energy: 1.9971818255038627
Energy: 2.0546728334573747
Energy: 2.0307020595807295
Energy: 2.060260822040866
Energy: 2.031736060114307
Energy: 2.0546728334568454
Energy: 2.0307020595802006
Energy: 2.0602608220419243
Energy: 2.0337921008143036
Energy: 2.0766210171424806
Energy: 2.0354956807572844
Energy: 2.0766617429592187
Energy: 2.033792100815362
Energy: 2.0766210171430095
Energy: 2.0354956807572844
Energy: 2.1586217811395114
Energy: 2.11538647796411
Energy: 2.0980735100868144
Energy: 2.11538647796411
Energy: 2.158621781141099
Energy: 2.115386477963052
Energy: 2.0980735100878727
Energy: 2.1345828105278835
Energy: 2.1160096138904603
Energy: 2.1342892627006296
Energy: 2.116009613891519
Energy: 2.134582810527354
Energy: 2.116009613890989
Energy: 2.1342892627006296
Energy: 1.9829573224867434
Energy: 2.2287043597963994
Energy: 1.9829573224867434
Energy: 2.217069648825623
Energy: 1.9829573224867434
Energy: 2.2287043597963994
Energy: 1.9829573224867434
Energy: 1.953051501341561
Energy: 2.169017699147329
Energy: 1.9530515013410321
Energy: 2.1724138933735158
Energy: 1.953051501341561
Energy: 2.1690176991468
Energy: 1.953051501341561
Energy: 2.2374314758187626
Energy: 2.134460924559559
Energy: 2.2374314758187626
Energy: 2.13446092455903
Energy: 2.237431475818233
Energy: 2.13446092455903
Energy: 2.2374314758198204
Energy: 2.2996048446238655
Energy: 2.122727988146493
Energy: 2.2996048446233366
Energy: 2.122727988147022
Energy: 2.299604844624395
Energy: 2.122727988146493
Energy: 2.2996048446238655
Energy: 2.031092605145399
Energy: 2.1933107513441366
Energy: 2.0310911393063864
Energy: 2.192584318670979
Energy: 2.03109260514434
Energy: 2.193310751344666
Energy: 2.0310911393058566
Energy: 2.0260617917850476
Energy: 2.202185059043079
Energy: 2.025620350769699
Energy: 2.206329971282994
Energy: 2.026061791787164
Energy: 2.2021850590425496
Energy: 2.02562035076917
Energy: 2.1641369311309897
Energy: 2.0661981083675904
Energy: 2.1641369311309897
Energy: 2.066198108366532
Energy: 2.164136931131519
Energy: 2.0661981083675904
Energy: 2.164136931131519
Energy: 2.1515701420739535
Energy: 2.065601652079721
Energy: 2.1515701420744824
Energy: 2.0656016520807787
Energy: 2.1515701420744824
Energy: 2.06560165208025
Energy: 2.1515701420739535
Energy: 1.9951985099702585
Energy: 2.0095568855776826
Energy: 1.9951985099702585
Energy: 2.0095568855776826
Energy: 1.9951985099697294
Energy: 2.0095568855771533
Energy: 1.9951985099697294
Energy: 2.0912408221349157
Energy: 2.1688015012292543
Energy: 2.091240822135974
Energy: 2.1688169413151708
Energy: 2.0912408221354446
Energy: 2.1688015012297837
Energy: 2.0912408221354446
Energy: 2.0056014012356136
Energy: 2.0745001641859204
Energy: 2.0056014012356136
Energy: 2.0745001641864493
Energy: 2.0056014012361434
Energy: 2.0745001641848617
Energy: 2.0056014012361434
Energy: 2.0445109576334746
Energy: 2.0265201072083006
Energy: 2.044510957634533
Energy: 2.0261462485157327
Energy: 2.0445109576324163
Energy: 2.0265201072077716
Energy: 2.0445109576329457
Energy: 2.05266291559151
Energy: 2.083958452032468
Energy: 2.0523316290583655
Energy: 2.0907686804737455
Energy: 2.0526629155920393
Energy: 2.083958452032468
Energy: 2.052331629057837
Energy: 2.1125733169473486
Energy: 2.2521024428628107
Energy: 2.1872665257171287
Energy: 2.2573864144279523
Energy: 2.119952715067134
Energy: 2.2521024428628107
Energy: 2.1199527150660757
Energy: 2.0966307870976966
Energy: 2.214399223062451
Energy: 2.0966307870987553
Energy: 2.211538516245731
Energy: 2.0966307870976966
Energy: 2.2143992230619216
Energy: 2.096630787098226
Energy: 1.974374621663618
Energy: 1.9918590864644674
Energy: 1.974374621663618
Energy: 1.9918590864644674
Energy: 1.9743746216630886
Energy: 1.9918590864639383
Energy: 1.974374621663618
Energy: 1.99296187814384
Energy: 2.0686118772067714
Energy: 1.99296187814384
Energy: 2.0686118772073003
Energy: 1.9929618781443694
Energy: 2.0686118772078297
Energy: 1.9929618781448983
Energy: 2.1437558698281003
Energy: 2.075325134134572
Energy: 2.0524715283423913
Energy: 2.0474695613861718
Energy: 2.1437558698286296
Energy: 2.0753251341351016
Energy: 2.0524715283423913
Energy: 2.226663341695016
Energy: 2.1856048563838972
Energy: 2.141471137234552
Energy: 2.1416764957448096
Energy: 2.226663341696075
Energy: 2.185604856382839
Energy: 2.1414711372340225
Energy: 2.078680245240613
Energy: 2.0395934065879797
Energy: 2.078541609901803
Energy: 2.0388616830009836
Energy: 2.078680245240613
Energy: 2.03959340658745
Energy: 2.078541609901803
Energy: 2.210680779321664
Energy: 2.0506986598206924
Energy: 2.2109803532352488
Energy: 2.063092300755494
Energy: 2.210680779322193
Energy: 2.0506986598206924
Energy: 2.2109803532352488
Energy: 2.119755918549923
Energy: 2.1163124712470496
Energy: 2.119845954258865
Energy: 2.1163124712475785
Energy: 2.119755918549394
Energy: 2.11631247124652
Energy: 2.1198459542583357
Energy: 2.083166694965994
Energy: 2.204267305588735
Energy: 2.083166694965465
Energy: 2.2006077081834596
Energy: 2.083166694965465
Energy: 2.204267305589264
Energy: 2.083166694965465
Energy: 2.0106731905643187
Energy: 2.0051776316051626
Energy: 2.0106731905643187
Energy: 2.0051776316051626
Energy: 2.010673190564848
Energy: 2.005177631604633
Energy: 2.010673190564848
Energy: 2.2162415116967513
Energy: 2.1323853752045854
Energy: 2.216241511696222
Energy: 2.1323853752045854
Energy: 2.2162415116956926
Energy: 2.132385375205114
Energy: 2.2162415116967513
Energy: 2.247432374881457
Energy: 2.120717335019861
Energy: 2.247432374881457
Energy: 2.120717335019332
Energy: 2.247432374880928
Energy: 2.12071733502039
Energy: 2.247432374881457
Energy: 2.043755523120453
Energy: 2.214536937792371
Energy: 2.043683559339571
Energy: 2.1855701199279505
Energy: 2.0437555231199243
Energy: 2.2145369377918427
Energy: 2.0436835593401
Energy: 2.0380675295648785
Energy: 2.075024101936826
Energy: 2.0380738541081245
Energy: 2.0752441007500657
Energy: 2.0380675295654083
Energy: 2.0750241019378843
Energy: 2.038073854107066
Energy: 2.168852274979984
Energy: 2.2140729287332865
Energy: 2.168852274979984
Energy: 2.2140729287327576
Energy: 2.1688522749805133
Energy: 2.2140729287327576
Energy: 2.168852274979984
Energy: 2.2086183684077114
Energy: 2.1854201481930473
Energy: 2.2087089764440364
Energy: 2.1854265731364158
Energy: 2.2086183684082408
Energy: 2.185420148192518
Energy: 2.2087089764429777
Energy: 1.9768056319946001
Energy: 2.0030744936905767
Energy: 1.9768056319946001
Energy: 2.0030744936905767
Energy: 1.9768056319935416
Energy: 2.0030744936905767
Energy: 1.9768056319935416

minimum gb energy = 1.9530515013410321 eV
minimum distance =  2.46808555681435 Angstroms
sigma value = 39


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

Energy: 1.99270769907703
Energy: 2.0645530777384526
Energy: 1.9927076990751564
Energy: 2.0645530777384526
Energy: 1.9927076990764057
Energy: 2.0645530777372034
Energy: 1.9927076990751564
Energy: 1.9313399041574515
Energy: 1.872106422491735
Energy: 1.9313399041574515
Energy: 1.8721064224904858
Energy: 1.931339904156827
Energy: 1.8721064224911106
Energy: 1.931339904156827
Energy: 1.9697439036646862
Energy: 1.903411308864993
Energy: 1.9697439036646862
Energy: 1.9034113088643685
Energy: 1.9697439036646862
Energy: 1.9034113088631193
Energy: 1.9697439036653106
Energy: 2.144355749798872
Energy: 1.8528907366235003
Energy: 2.1443557497994963
Energy: 1.8528907366228755
Energy: 2.144355749798872
Energy: 1.8528907366228755
Energy: 2.1443557497976227
Energy: 1.9435991457368977
Energy: 1.8949697580807674
Energy: 1.9435991457368977
Energy: 1.8949697580820164
Energy: 1.9435991457381467
Energy: 1.8949697580795184
Energy: 1.9435991457387716
Energy: 2.0111846042823247
Energy: 1.9084620101401317
Energy: 2.0111846042823247
Energy: 1.9084620101401317
Energy: 2.0111846042823247
Energy: 1.908462010138883
Energy: 2.0111846042823247
Energy: 2.185658990056697
Energy: 1.9681199430934313
Energy: 2.235738016132836
Energy: 1.96811994309468
Energy: 2.1931438860798713
Energy: 1.9681199430940557
Energy: 2.1931438860804957
Energy: 2.0167035106193283
Energy: 1.9529593222900217
Energy: 2.0167035106193283
Energy: 1.9529593222900217
Energy: 2.016703510619953
Energy: 1.9529593222887724
Energy: 2.0167035106187043
Energy: 2.027777322457721
Energy: 1.9526058949537723
Energy: 2.027777322457721
Energy: 1.952605894953148
Energy: 2.02777732245897
Energy: 1.9526058949525231
Energy: 2.02777732245897
Energy: 1.963698829291155
Energy: 2.035165838476611
Energy: 1.9636988292917794
Energy: 2.0351658384759865
Energy: 1.9636988292917794
Energy: 2.0351658384753617
Energy: 1.963698829291155
Energy: 2.065823794371911
Energy: 1.9814729481358768
Energy: 1.9330043356498396
Energy: 1.981472948135252
Energy: 1.933004335648591
Energy: 1.9814729481371258
Energy: 1.9330043356498396
Energy: 1.9842391577518617
Energy: 1.8541049611864446
Energy: 1.9842391577499885
Energy: 1.8541049611858202
Energy: 1.9842391577512373
Energy: 1.8541049611858202
Energy: 1.9842391577518617
Energy: 1.9413890549275261
Energy: 1.8973901765641423
Energy: 1.9413890549256527
Energy: 1.8973901765635177
Energy: 1.9413890549250281
Energy: 1.8973901765628935
Energy: 1.941389054926277
Energy: 1.9692153782289774
Energy: 1.8537754157239466
Energy: 1.9692153782308508
Energy: 1.853775415724571
Energy: 1.9692153782302262
Energy: 1.8537754157239466
Energy: 1.9692153782296018
Energy: 1.9808394920152181
Energy: 1.9548382519745515
Energy: 1.9808394920551875
Energy: 1.9548382519758005
Energy: 2.1619705641536724
Energy: 1.9548382519758005
Energy: 2.099551718989156
Energy: 1.969500203282185
Energy: 1.9129969451477178
Energy: 1.969500203280936
Energy: 1.9129969451470934
Energy: 1.969500203280936
Energy: 1.9129969451477178
Energy: 1.9695002032815603
Energy: 2.008257373365235
Energy: 1.9527098600438832
Energy: 2.0082573733646107
Energy: 1.9527098600451325
Energy: 2.008257373365859
Energy: 1.9527098600451325
Energy: 2.008257373365235
Energy: 2.0667206479571747
Energy: 1.9500200727593942
Energy: 2.066720647957799
Energy: 1.9500200727587693
Energy: 2.066720647957799
Energy: 1.9500200727593942
Energy: 2.0667206479571747
Energy: 2.042896365326852
Energy: 1.9643424597710741
Energy: 2.0428963662557433
Energy: 1.9643424597710741
Energy: 2.04289636631002
Energy: 1.9643424597642045
Energy: 2.0428963666914326
Energy: 1.963997356273241
Energy: 2.0291112607153257
Energy: 1.9639973562744901
Energy: 2.0291112607159505
Energy: 1.9639973562726165
Energy: 2.0291112607147013
Energy: 1.963997356273241
Energy: 1.9887453594171547
Energy: 1.8532745345751194
Energy: 1.9887453594184037
Energy: 1.853274534574495
Energy: 1.988745359419028
Energy: 1.853274534576993
Energy: 1.9887453594177789
Energy: 2.0167174819017304
Energy: 1.8513190108603805
Energy: 2.0167174819004816
Energy: 1.8513190108591313
Energy: 2.016717481901106
Energy: 1.8513190108610051
Energy: 2.0167174819004816
Energy: 2.0432300025890386
Energy: 1.9034380104692177
Energy: 2.043230002594659
Energy: 1.9034380104692177
Energy: 2.0432300025934107
Energy: 1.9034380104692177
Energy: 2.043230002594659
Energy: 1.9407992504184826
Energy: 1.8503107458117147
Energy: 1.9407992504184826
Energy: 1.8503107458104655
Energy: 1.9407992504184826
Energy: 1.8503107458098411
Energy: 1.9407992504184826
Energy: 2.017838142978267
Energy: 1.9153371032615574
Energy: 2.0178381429776424
Energy: 1.915337103260933
Energy: 2.017838142978267
Energy: 1.915337103260933
Energy: 2.0178381429776424
Energy: 2.082485506176817
Energy: 1.9724129434785458
Energy: 2.082485506176817
Energy: 1.9724129434785458
Energy: 2.082485506176817
Energy: 1.9724129434766726
Energy: 2.082485506176817
Energy: 2.0177817256311927
Energy: 1.950445808493026
Energy: 2.0177817256311927
Energy: 1.9504458084942753
Energy: 2.0177817256299435
Energy: 1.9504458084942753
Energy: 2.0177817256305683
Energy: 1.9315525081413305
Energy: 1.945863375010835
Energy: 1.9315525081413305
Energy: 1.9458633750120837
Energy: 1.9315525081407061
Energy: 1.9458633750102101
Energy: 1.9315525081413305
Energy: 1.9927076990764057
Energy: 2.0645530777384526
Energy: 1.992707699075781
Energy: 2.0645530777384526
Energy: 1.992707699075781
Energy: 2.0645530777372034
Energy: 1.992707699075781
Energy: 1.9313399041562027
Energy: 1.8721064224923594
Energy: 1.931339904156827
Energy: 1.872106422491735
Energy: 1.931339904156827
Energy: 1.872106422491735
Energy: 1.931339904156827

minimum gb energy = 1.8503107458098411 eV
minimum distance =  2.4768368453144 Angstroms
sigma value = 21


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

Energy: 1.833415553005004
Energy: 1.9203591040513985
Energy: 1.833415553005004
Energy: 1.9203591040513985
Energy: 1.833415553005004
Energy: 1.9203591040513985
Energy: 1.833415553005004
Energy: 1.7361208686489453
Energy: 1.6983064249607984
Energy: 1.736120868647429
Energy: 1.6983064249600401
Energy: 1.7361208686489453
Energy: 1.6983064249607984
Energy: 1.736120868647429
Energy: 1.8060485913512956
Energy: 1.7760950164770857
Energy: 1.8060485913512956
Energy: 1.7760950164770857
Energy: 1.8060485913512956
Energy: 1.776095016477844
Energy: 1.8060485913512956
Energy: 1.6758002804508307
Energy: 1.6961106746060934
Energy: 1.6758002804508307
Energy: 1.6961106746053354
Energy: 1.6758002804508307
Energy: 1.6961106746060934
Energy: 1.675800280451589
Energy: 1.6377620763895295
Energy: 1.7351351235695356
Energy: 1.6377620763887712
Energy: 1.7351351235680192
Energy: 1.6377620763895295
Energy: 1.7351351235687773
Energy: 1.6377620763887712
Energy: 1.6683461659394287
Energy: 1.7084564502456725
Energy: 1.6683461659394287
Energy: 1.7084564502441564
Energy: 1.6683461659394287
Energy: 1.7084564502449142
Energy: 1.6683461659394287
Energy: 1.597392482475708
Energy: 2.4057754374933116
Energy: 1.597392482475708
Energy: 2.4057754374940696
Energy: 1.597392482475708
Energy: 2.4057754374933116
Energy: 1.597392482476466
Energy: 1.7221725175016855
Energy: 1.7026768995211659
Energy: 1.7221725175009273
Energy: 1.7026768995204078
Energy: 1.7221725175016855
Energy: 1.7026768995211659
Energy: 1.7221725175009273
Energy: 1.8220959881539494
Energy: 1.6563512034017793
Energy: 1.8220959881539494
Energy: 1.6563512034025374
Energy: 1.8220959881539494
Energy: 1.6563512034017793
Energy: 1.8220959881539494
Energy: 1.6848188383742344
Energy: 2.368026437828505
Energy: 1.6848188383734763
Energy: 2.368026437829263
Energy: 1.6848188383734763
Energy: 2.368026437828505
Energy: 1.6848188383734763
Energy: 1.5883659949458964
Energy: 1.7030194278095283
Energy: 1.5883659949466544
Energy: 1.7030194278095283
Energy: 1.5883659949458964
Energy: 1.7030194278102864
Energy: 1.5883659949466544
Energy: 1.6662445330927595
Energy: 1.7359774387230098
Energy: 1.6662445330927595
Energy: 1.7359774387237679
Energy: 1.6662445330927595
Energy: 1.7359774387230098
Energy: 1.6662445330920017
Energy: 1.7330757462000563
Energy: 1.6582970673347512
Energy: 1.7330757462000563
Energy: 1.658297067333235
Energy: 1.7330757462000563
Energy: 1.658297067333235
Energy: 1.7330757462000563
Energy: 1.7631701772386368
Energy: 2.4283230150904447
Energy: 1.7631701772386368
Energy: 2.4283230150904447
Energy: 1.7631701772386368
Energy: 2.428323015089721
Energy: 1.7631701772386368
Energy: 1.7286971741477424
Energy: 1.7127089923488985
Energy: 1.7286971741485004
Energy: 1.7127089923481402
Energy: 1.7286971741477424
Energy: 1.7127089923481402
Energy: 1.728697174146984
Energy: 1.8383699108094032
Energy: 1.8662908940230742
Energy: 1.838369910810161
Energy: 1.8662908940223162
Energy: 1.838369910810161
Energy: 1.8662908940230742
Energy: 1.8383699108109193
Energy: 1.7609746810621152
Energy: 1.6930454961689343
Energy: 1.760974681061357
Energy: 1.6930454961704509
Energy: 1.7609746810621152
Energy: 1.6930454961696926
Energy: 1.7609746810621152
Energy: 1.788103628081033
Energy: 2.4284055805400415
Energy: 1.788103628081033
Energy: 2.4284055805407996
Energy: 1.788103628081791
Energy: 2.4284055805400415
Energy: 1.788103628081033
Energy: 1.7263727185883229
Energy: 1.7125348047790376
Energy: 1.7263727185875652
Energy: 1.712534804779796
Energy: 1.7263727185875652
Energy: 1.7125348047790376
Energy: 1.7263727185875652
Energy: 1.6656555837624187
Energy: 1.6491285263905433
Energy: 1.665655583761661
Energy: 1.649128526389785
Energy: 1.6656555837624187
Energy: 1.649128526389785
Energy: 1.6656555837624187
Energy: 1.67085365311852
Energy: 1.8154437908022016
Energy: 1.670853653117762
Energy: 1.8154437908022016
Energy: 1.67085365311852
Energy: 1.8154437908022016
Energy: 1.67085365311852
Energy: 1.5818995002576632
Energy: 2.4191362589893894
Energy: 1.5818995002576632
Energy: 2.4191362589901475
Energy: 1.5818995002576632
Energy: 2.4191362589901475
Energy: 1.5818995002576632
Energy: 1.7435182380406864
Energy: 1.7127634982240036
Energy: 1.7435182380406864
Energy: 1.7127634982232454
Energy: 1.7435182380406864
Energy: 1.7127634982240036
Energy: 1.7435182380406864
Energy: 1.7894103960036307
Energy: 1.6490807647618846
Energy: 1.7894103960036307
Energy: 1.6490807647626422
Energy: 1.7894103960043888
Energy: 1.6490807647618846
Energy: 1.7894103960036307
Energy: 1.6703066976991703
Energy: 1.8481104753245186
Energy: 1.6703066976991703
Energy: 1.8481104753252766
Energy: 1.6703066976991703
Energy: 1.8481104753252766
Energy: 1.6703066976991703

minimum gb energy = 1.5818995002576632 eV
minimum distance =  2.53105955434976 Angstroms
sigma value = 113


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

Energy: 1.5718751728000535
Energy: 1.606618212869777
Energy: 1.5718751728022078
Energy: 1.6066182128680844
Energy: 1.5718751727996692
Energy: 1.6066182128706232
Energy: 1.5718751728022078
Energy: 1.5476374351043614
Energy: 1.4808944248246299
Energy: 1.5476374351055924
Energy: 1.4808944248246299
Energy: 1.5476374351039002
Energy: 1.480894424824245
Energy: 1.547637435104746
Energy: 1.5637631519407462
Energy: 1.5512304509629589
Energy: 1.5637631519386692
Energy: 1.5512304509633434
Energy: 1.5637631519407462
Energy: 1.5512304509629589
Energy: 1.5637631519386692
Energy: 1.4795772871159723
Energy: 1.4755716713324722
Energy: 1.4795772871168187
Energy: 1.4755716713307798
Energy: 1.4795772871163568
Energy: 1.475571671331626
Energy: 1.4795772871168187
Energy: 1.48216062653634
Energy: 1.57755054375731
Energy: 1.482160626535955
Energy: 1.5775505437518482
Energy: 1.48216062653634
Energy: 1.577550543755233
Energy: 1.482160626535955
Energy: 1.472368711810899
Energy: 1.4934552103426388
Energy: 1.472368711813053
Energy: 1.4934552103417924
Energy: 1.4723687118105147
Energy: 1.4934552103421772
Energy: 1.4723687118122069
Energy: 1.4567062191282119
Energy: 1.5207874647824877
Energy: 1.4567062191319813
Energy: 1.520787464783719
Energy: 1.4567062191294426
Energy: 1.5207874647828727
Energy: 1.4567062191315967
Energy: 1.4673585733216619
Energy: 1.4344256788279466
Energy: 1.467358573322508
Energy: 1.4344256788275618
Energy: 1.467358573322508
Energy: 1.4344256788258696
Energy: 1.467358573322508
Energy: 1.517771933303045
Energy: 1.4772224180501496
Energy: 1.517771933303045
Energy: 1.4772224180497646
Energy: 1.5177719333035065
Energy: 1.4772224180497646
Energy: 1.5177719333035065
Energy: 1.4909052445922468
Energy: 1.4362595842540409
Energy: 1.4909052445930928
Energy: 1.4362595842528099
Energy: 1.4909052445927085
Energy: 1.4362595842519639
Energy: 1.4909052445930928
Energy: 1.4207367355031817
Energy: 1.391301498675493
Energy: 1.4207367355001812
Energy: 1.3913014986767238
Energy: 1.4207367355031817
Energy: 1.3913014986750314
Energy: 1.4207367355010274
Energy: 1.4237101077293455
Energy: 1.4564208917146069
Energy: 1.423710107731038
Energy: 1.4564208917112216
Energy: 1.4237101077298073
Energy: 1.4564208917137602
Energy: 1.4237101077306533
Energy: 1.3610353862137572
Energy: 1.6186231318716828
Energy: 1.3610353862171423
Energy: 1.6186231318721445
Energy: 1.3610353862137572
Energy: 1.6186231318543733
Energy: 1.3610353862166806
Energy: 1.5018076573302328
Energy: 1.4343707338256309
Energy: 1.5018076573293866
Energy: 1.4343707338251694
Energy: 1.5018076573306174
Energy: 1.4343707338260157
Energy: 1.5018076573293866
Energy: 1.4886841824746055
Energy: 1.3980824090692254
Energy: 1.488684182475067
Energy: 1.3980824090815345
Energy: 1.488684182474221
Energy: 1.3980824090882273
Energy: 1.4886841824754518
Energy: 1.4111547626144465
Energy: 1.789496023234267
Energy: 1.4111547626127539
Energy: 1.7894960232321897
Energy: 1.411154762614831
Energy: 1.7894960232351131
Energy: 1.4111547626136003
Energy: 1.3609903660472564
Energy: 1.449471699363227
Energy: 1.3609903660506413
Energy: 1.4494716993623808
Energy: 1.3609903660477178
Energy: 1.449471699363227
Energy: 1.3609903660502565
Energy: 1.4199296415618987
Energy: 1.445414727041819
Energy: 1.4199296415605909
Energy: 1.445414727038819
Energy: 1.4199296415618987
Energy: 1.4454147270413575
Energy: 1.419929641561437
Energy: 1.456375886014061
Energy: 1.4137289770020314
Energy: 1.4563758860127531
Energy: 1.4137289770003392
Energy: 1.4563758860144456
Energy: 1.4137289769986467
Energy: 1.4563758860132148
Energy: 1.4753117627222914
Energy: 1.6352162480994155
Energy: 1.475311762723984
Energy: 1.6352162480981076
Energy: 1.4753117627243686
Energy: 1.6352162480994155
Energy: 1.475311762723984
Energy: 1.4555356164013498
Energy: 1.4300765964771254
Energy: 1.455535616402196
Energy: 1.4300765964766635
Energy: 1.455535616402196
Energy: 1.43007659647751
Energy: 1.4555356164017346
Energy: 1.4466863479503311
Energy: 1.4605664396745521
Energy: 1.446686347949023
Energy: 1.4605664404692456
Energy: 1.4466863479511771
Energy: 1.46056644190554
Energy: 1.446686347949023
Energy: 1.4535385500024316
Energy: 1.4033880490845294
Energy: 1.4535385499990467
Energy: 1.4033880490819906
Energy: 1.4535385500024316
Energy: 1.4033880490807598
Energy: 1.4535385500015854
Energy: 1.4080550412551207
Energy: 1.7228342695764174
Energy: 1.4080550412542745
Energy: 1.722834269575571
Energy: 1.4080550412568134
Energy: 1.7228342695764174
Energy: 1.4080550412551207
Energy: 1.5906918619628965
Energy: 1.461715106089941
Energy: 1.5906918619642043
Energy: 1.4617151060907871
Energy: 1.590691861963743
Energy: 1.4617151060882483
Energy: 1.5906918619642043
Energy: 1.5256238872181245
Energy: 1.4705167132465333
Energy: 1.5256238872206633
Energy: 1.470516713246918
Energy: 1.525623887218586
Energy: 1.4705167132465333
Energy: 1.5256238872211247
Energy: 1.5496376490988895
Energy: 1.7019043108403524
Energy: 1.5496376490967354
Energy: 1.7019043108365057
Energy: 1.5496376490967354
Energy: 1.7019043108398906
Energy: 1.5496376490955044
Energy: 1.5110663488176752
Energy: 1.6965502142718818
Energy: 1.5110663488205986
Energy: 1.6965502142681121
Energy: 1.5110663488176752
Energy: 1.696550214271497
Energy: 1.5110663488202138
Energy: 1.6909894798702505
Energy: 1.5001510053911484
Energy: 1.6909894798727894
Energy: 1.5001510053898406
Energy: 1.690989479873174
Energy: 1.5001510053919946
Energy: 1.690989479873174
Energy: 1.5319992334356332
Energy: 1.4706009275978897
Energy: 1.5319992334301713
Energy: 1.4706009276004284
Energy: 1.531999233433941
Energy: 1.4706009275961973
Energy: 1.5319992334356332
Energy: 1.5157768232263606
Energy: 1.5131178862851031
Energy: 1.5157768232275917
Energy: 1.51311788628218
Energy: 1.5157768232258995
Energy: 1.5131178862855645
Energy: 1.5157768232280535
Energy: 1.408033898311664
Energy: 1.680546888172786
Energy: 1.408033898311664
Energy: 1.680546888170632
Energy: 1.408033898311664
Energy: 1.6805468881731709
Energy: 1.4080338983108178
Energy: 1.6064253780855264
Energy: 1.5108750197849106
Energy: 1.6064253780880653
Energy: 1.510875019786603
Energy: 1.6064253780851419
Energy: 1.51087501978368
Energy: 1.6064253780876805
Energy: 1.4127737570395749
Energy: 1.444379187267162
Energy: 1.4127737570374976
Energy: 1.444379187267624
Energy: 1.4127737570395749
Energy: 1.4443791872680085
Energy: 1.4127737570378822
Energy: 1.4640158214111043
Energy: 1.6396448014706069
Energy: 1.4640158214115655
Energy: 1.6396448014714526
Energy: 1.4640158214115655
Energy: 1.6396448014706069
Energy: 1.4640158214124122
Energy: 1.4598726097334551
Energy: 1.615485431744858
Energy: 1.4598726097322243
Energy: 1.6154854317440117
Energy: 1.4598726097343013
Energy: 1.6154854317440117
Energy: 1.4598726097317627
Energy: 1.6587611490119811
Energy: 1.4396543731119977
Energy: 1.6587611490136736
Energy: 1.439654373109459
Energy: 1.6587611490119811
Energy: 1.4396543731111517
Energy: 1.6587611490124425
Energy: 1.411689634648634
Energy: 1.3965737952192405
Energy: 1.4116896346494805
Energy: 1.3965737952192405
Energy: 1.4116896346474033
Energy: 1.3965737952192405
Energy: 1.4116896346490957
Energy: 1.4156095675684779
Energy: 1.4213764658521544
Energy: 1.4156095675705547
Energy: 1.4213764658546932
Energy: 1.4156095675684779
Energy: 1.4213764658530006
Energy: 1.4156095675705547
Energy: 1.3607393061152513
Energy: 1.4126858466186558
Energy: 1.3607393061186361
Energy: 1.4126858466169632
Energy: 1.3607393061139434
Energy: 1.412685846619117
Energy: 1.3607393061181745
Energy: 1.4384590823495966
Energy: 1.4583809617699446
Energy: 1.4384590823508274
Energy: 1.4583809617686367
Energy: 1.4384590823508274
Energy: 1.4583809617690986
Energy: 1.4384590823512893
Energy: 1.4443104250002365
Energy: 1.400605730009954
Energy: 1.4443104250014673
Energy: 1.4006057299727195
Energy: 1.444310425000621
Energy: 1.4006057299342543
Energy: 1.4443104250014673
Energy: 1.4172392004067758
Energy: 1.821780989350641
Energy: 1.4172392004072374
Energy: 1.8217809893477175
Energy: 1.4172392004072374
Energy: 1.821780989350641
Energy: 1.4172392004072374
Energy: 1.36057697273195
Energy: 1.4248655537224753
Energy: 1.360576972732796
Energy: 1.4248655537253987
Energy: 1.3605769727315653
Energy: 1.4248655537241677
Energy: 1.3605769727336425
Energy: 1.4121624179702528
Energy: 1.443364942305376
Energy: 1.4121624179719452
Energy: 1.443364942303222
Energy: 1.4121624179702528
Energy: 1.4433649423049144
Energy: 1.4121624179715606

minimum gb energy = 1.3605769727315653 eV
minimum distance =  2.51551042542902 Angstroms
sigma value = 365


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

Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 3.0362448007457488
Energy: 1.6713479356453567
Energy: 3.0362740190424207
Energy: 1.6713479356453567
Energy: 3.0363471672954576
Energy: 1.6713479356453567
Energy: 3.0361402846444028
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 3.341910187334732
Energy: 1.6713479356463106
Energy: 3.3422017153662846
Energy: 1.6713479356453567
Energy: 3.035893909226794
Energy: 1.6713479356463106
Energy: 3.0360218719594494
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 3.34196113262933
Energy: 1.6713479356453567
Energy: 3.342305616429056
Energy: 1.6713479356453567
Energy: 3.035861643157521
Energy: 1.6713479356453567
Energy: 3.0358654676106083
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 3.0364216350018296
Energy: 1.6713479356453567
Energy: 3.0363880273120065
Energy: 1.6713479356453567
Energy: 3.0364270458668976
Energy: 1.6713479356453567
Energy: 3.0364662174397834
Energy: 0.48047536233882143
Energy: 0.584373372019203
Energy: 0.48047536233882143
Energy: 0.584373372019203
Energy: 0.48047536233882143
Energy: 0.584373372019203
Energy: 0.48047536233882143
Energy: 3.035938166657831
Energy: 1.6713479356453567
Energy: 3.035882558736201
Energy: 1.6713479356453567
Energy: 3.0358578976240342
Energy: 1.6713479356453567
Energy: 3.0358815447038445
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 3.0364663356560984
Energy: 1.6713479356453567
Energy: 3.036555282439944
Energy: 1.6713479356463106
Energy: 3.0362907242302213
Energy: 1.6713479356453567
Energy: 3.036583227207159
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 3.036318302619825
Energy: 1.6713479356453567
Energy: 3.036441071318885
Energy: 1.6713479356453567
Energy: 3.036471396558918
Energy: 1.6713479356453567
Energy: 3.0365104134202467
Energy: 0.48047536233882143
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.48047536233882143
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 3.0366867910833353
Energy: 1.6713479356453567
Energy: 3.036751826652226
Energy: 1.6713479356453567
Energy: 3.036551331689174
Energy: 1.6713479356453567
Energy: 3.036578069880415
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 3.0364653084533186
Energy: 1.6713479356453567
Energy: 3.0364778944181197
Energy: 1.6713479356453567
Energy: 3.0364875102579276
Energy: 1.6713479356453567
Energy: 3.0364916681873484
Energy: 0.4804753623378674
Energy: 0.584373372020157
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 0.584373372019203
Energy: 0.4804753623378674
Energy: 3.0363518558218647
Energy: 1.6713479356463106
Energy: 3.036352671428143
Energy: 1.6713479356453567
Energy: 3.036348133551144
Energy: 1.6713479356463106
Energy: 3.0363456613392352

minimum gb energy = 0.4804753623378674 eV
minimum distance =  2.49632629928474 Angstroms
sigma value = 23