Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_000
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=3.6200000196695328
cohesive_energy=3.540278409563987
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: 0.016717195093798657
Energy: 0.4042258943458906
Energy: 0.2289060250210089
Energy: 0.4042359410712703
Energy: 0.01671719509453634
Energy: 0.4042258943458906
Energy: 0.41941334167957217
Energy: 0.4188157514348286
Energy: 0.01699961521708063
Energy: 0.22805243987574864
Energy: 0.016928056402545407
Energy: 0.4188157514345732
Energy: 0.01699961521608759
Energy: 0.22805243987549328
Energy: 0.01671719509405401
Energy: 0.404225894346146
Energy: 0.22890602502075355
Energy: 0.4042359410712703
Energy: 0.01671719509453634
Energy: 0.40422589434640127
Energy: 0.4194133416798275
Energy: 0.4188157514348286
Energy: 0.01699961521682528
Energy: 0.22805243987574864
Energy: 0.016928056402290052
Energy: 0.4188157514345732
Energy: 0.016999615216342946
Energy: 0.22805243987574864
Energy: 0.01671719509405401
Energy: 0.4042258943456636
Energy: 0.2289060250212359
Energy: 0.40423594107152566
Energy: 0.01671719509453634
Energy: 0.404225894346146
Energy: 0.4194133416798275
Energy: 0.4188157514348286
Energy: 0.016999615216598297
Energy: 0.228052439876004
Energy: 0.016928056402290052
Energy: 0.4188157514345732
Energy: 0.016999615216342946
Energy: 0.22805243987574864

minimum gb energy = 0.016717195093798657 eV
minimum distance =  2.53785975525274 Angstroms
sigma value = 5


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

Energy: 1.0465593528658548
Energy: 1.0612408815640793
Energy: 1.0387778265146068
Energy: 1.0613538183865807
Energy: 1.046559352859754
Energy: 1.0612408815640793
Energy: 1.0345234646572186
Energy: 0.9666290739784222
Energy: 0.962624983233628
Energy: 1.034136875729453
Energy: 0.9964426089837694
Energy: 0.9666290739784222
Energy: 0.962624983233628
Energy: 1.034136875729453
Energy: 0.9637647956049447
Energy: 0.9541194188531089
Energy: 1.097892380107217
Energy: 0.9775594456006484
Energy: 0.9637647956079951
Energy: 0.9541194188531089
Energy: 1.0978923801102671
Energy: 1.0217759744241697
Energy: 0.9844802301259244
Energy: 1.0599199343372065
Energy: 0.9645421214113374
Energy: 1.0217759744211194
Energy: 0.9844802301259244
Energy: 1.0599199343372065
Energy: 0.9619533904691279
Energy: 0.9431547357253985
Energy: 1.0946925466526498
Energy: 0.9873642487188817
Energy: 0.9619533904721782
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Energy: 1.1098075150582856
Energy: 1.0038222377746606
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Energy: 0.9867038961422782
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Energy: 1.0017619370898903
Energy: 1.031708742643104
Energy: 1.008392351305486
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Energy: 1.0017619370898903
Energy: 1.0404129435376164
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Energy: 0.9551161619095524
Energy: 1.0666128789162486
Energy: 0.989656225960806
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Energy: 0.9561975907692299
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Energy: 1.0037448433480691
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Energy: 0.9805176764223683
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Energy: 1.0415286215016966
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Energy: 1.1100055993562792
Energy: 0.9782906935932855
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Energy: 1.1100055993532287
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Energy: 1.0130209121521192
Energy: 1.0503047552593205
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Energy: 1.013020912149069
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Energy: 0.9574753707883265
Energy: 1.046720953019737
Energy: 0.9669543848749615
Energy: 0.9743538653163782
Energy: 0.9574753707883265
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Energy: 1.0651669708813811
Energy: 1.040712580266748
Energy: 1.0570024159026643
Energy: 1.0065793455680125
Energy: 1.0651669708783307
Energy: 1.0407125802606476
Energy: 0.9805660222377056
Energy: 0.9725137538372859
Energy: 0.9984734936467652
Energy: 1.002502518389346
Energy: 0.9805660222346554
Energy: 0.9725137538342357
Energy: 0.9984734936498154
Energy: 0.9622455790592472
Energy: 0.9402004979251851
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Energy: 0.9402004979221349
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Energy: 1.0576213615456804
Energy: 0.9759200855074589
Energy: 0.9753986020851487
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Energy: 0.9738266813401206
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Energy: 1.0055268618488546
Energy: 1.0543209578823534
Energy: 0.9634806822410862
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Energy: 1.0543209578884538
Energy: 0.9611780963475849
Energy: 0.9550837914164529
Energy: 1.0257780423383327
Energy: 0.985230369081399
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Energy: 1.012150594537698
Energy: 1.0541895697681614
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Energy: 0.9667605624294602
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Energy: 1.1221176126997838
Energy: 0.9784785133307127
Energy: 0.9654577013518019
Energy: 1.0340057199718031
Energy: 1.0264123414193358
Energy: 0.9784785133276623
Energy: 0.9654577013548521
Energy: 1.0340057199779036
Energy: 1.0416802450116223
Energy: 0.9740393463947216
Energy: 1.0216733830582339
Energy: 0.9893212849485187
Energy: 1.0416802450146727
Energy: 0.9740393463855708
Energy: 1.0216733830612839
Energy: 1.0538404030464916
Energy: 1.0193905061787079
Energy: 1.0857280110569896
Energy: 1.0178414833423013
Energy: 1.053840403049542
Energy: 1.0193905061787079
Energy: 1.085728011053939
Energy: 1.0005798383175737
Energy: 1.0038328783121828
Energy: 1.0918691765303123
Energy: 0.9733843054659541
Energy: 1.0005798383175737
Energy: 1.0038328783152333
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Energy: 0.9459162977192516
Energy: 0.989340589309406
Energy: 1.1201617014564673
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Energy: 1.0050786204495978
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Energy: 0.9837319962216192
Energy: 1.016344468517915
Energy: 0.9556614830118071
Energy: 0.9711849300646606
Energy: 0.9837319962216192
Energy: 1.0327076625248637
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Energy: 0.9560631584520188
Energy: 1.0288389535567213
Energy: 0.98977582751117
Energy: 0.9653292612182074
Energy: 0.9560631584611697
Energy: 1.0288389535567213
Energy: 0.9557946961552218
Energy: 0.955238676743292
Energy: 1.045130648262156
Energy: 1.0000269627480416
Energy: 0.9557946961643727
Energy: 0.955238676743292
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Energy: 1.0967425831716193
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Energy: 0.9625795459148975
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Energy: 0.9543273921687998
Energy: 0.9464201801339134
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Energy: 1.0390629927349895
Energy: 0.963321930095052
Energy: 0.9771596791665826
Energy: 1.0177008489052652
Energy: 0.9836929292688356
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Energy: 1.017700848902215
Energy: 0.9864780341948257
Energy: 1.0049327386341502
Energy: 1.0561928363982156
Energy: 0.9780135557556621
Energy: 0.9864780342009264
Energy: 1.0049327386310998
Energy: 1.0561928363982156
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Energy: 1.0048955744001025
Energy: 1.082910135173276
Energy: 1.0377338665708675
Energy: 1.0054523490336584
Energy: 1.004895574403153
Energy: 1.0829101351793764
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Energy: 1.0492250159802325
Energy: 1.0062283077683076
Energy: 1.0099149835990022
Energy: 0.9599448659472963
Energy: 1.049225015986333
Energy: 1.0045448178770926
Energy: 0.9756073383671474
Energy: 1.0504822438528472
Energy: 0.9798177364462386
Energy: 1.004544817880143
Energy: 0.9756073383671474
Energy: 1.0504822438558976
Energy: 1.0702674794533742
Energy: 0.9784171419063667
Energy: 1.0765918633274776
Energy: 1.0234209626578317
Energy: 1.070267479459475
Energy: 0.9784171419155175
Energy: 1.076591863330528
Energy: 1.0036270532037435
Energy: 0.9940361505265278
Energy: 1.068667127697987
Energy: 1.0087808122220538
Energy: 1.0036270532037435
Energy: 0.9940361505265278
Energy: 1.068667127697987
Energy: 0.9423084133975623
Energy: 0.9659975628412777
Energy: 1.0814303806666234
Energy: 0.9737770647452854
Energy: 0.9423084133975623
Energy: 0.9659975628443279
Energy: 1.081430380663573
Energy: 0.9746761087411902
Energy: 0.9993546550295032
Energy: 1.0806512626479083
Energy: 1.029203188056664
Energy: 0.9746761087411902
Energy: 0.9993546550325534
Energy: 1.0806512626479083
Energy: 0.9488251569741102
Energy: 0.99356199848446
Energy: 1.0120815275043984
Energy: 0.9660872751754233
Energy: 0.9488251569741102
Energy: 0.993561998487455
Energy: 1.012081527501348

minimum gb energy = 0.9402004979221349 eV
minimum distance =  2.27791614587762 Angstroms
sigma value = 401


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

Energy: 0.9817237385073337
Energy: 0.9719718209266692
Energy: 1.0447575620949205
Energy: 0.9791452933343164
Energy: 0.9817237385094113
Energy: 0.9719718209290615
Energy: 1.0340315803576392
Energy: 0.953424420644569
Energy: 1.0303445583340667
Energy: 0.9638150957377677
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Energy: 1.0303445583350739
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Energy: 1.000168708059934
Energy: 0.9406231821674426
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Energy: 1.0103612419468317
Energy: 0.9558462566563076
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Energy: 0.995463302644488
Energy: 1.0256583779027375
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Energy: 0.9763894887999496
Energy: 1.000168708062704
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Energy: 1.0001687080610042
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Energy: 0.9840678736193884
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Energy: 0.9558462566580075
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Energy: 1.0103612419450694
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Energy: 1.0473367830340545
Energy: 0.954779238243479
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Energy: 0.978636414858352
Energy: 1.0473367830322917
Energy: 0.9493930752037558
Energy: 0.9711182097092766
Energy: 0.9677628031440391
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Energy: 0.9951601004911589
Energy: 0.9580863540377191
Energy: 0.9461378810425336
Energy: 0.9485093671978151
Energy: 1.0245769159637281
Energy: 0.9453137683682922
Energy: 0.9562703952403475
Energy: 0.9818346415671367
Energy: 0.954210592055404
Energy: 0.945313768370055
Energy: 0.9562703952389625
Energy: 0.9870744430400551
Energy: 0.9488327369927837
Energy: 0.9546538179795303
Energy: 1.0147825901686744
Energy: 0.9695906190068032
Energy: 0.9488327369927837
Energy: 0.9546538179819225
Energy: 1.0217937044435021
Energy: 0.9415964780509971
Energy: 0.976363215216762
Energy: 1.0150932825383072
Energy: 0.970371850858373
Energy: 0.9415964780520673
Energy: 0.9763632152170766
Energy: 1.0210127583158528
Energy: 0.9506339586542355
Energy: 0.9839441542406001
Energy: 1.0117328135908192
Energy: 0.9702996957202433
Energy: 0.9506339586542355
Energy: 0.9839441542385226
Energy: 1.0344954151612196
Energy: 0.949732672358187
Energy: 0.9762815681517464
Energy: 1.0210290389082577
Energy: 0.9706273396524068
Energy: 0.9497326723561097
Energy: 0.9762815681479691
Energy: 1.0333177538253517
Energy: 0.9536446325389835
Energy: 0.974220451925607
Energy: 0.976896864000937
Energy: 1.0256583779024229
Energy: 0.9536446325375985
Energy: 0.9742204519249145
Energy: 0.9954633026454952
Energy: 0.9557285479816849
Energy: 0.9719718209276765
Energy: 1.0447575620959908
Energy: 0.979145293333624
Energy: 0.9557285479782226
Energy: 0.9719718209300687
Energy: 1.0340315803573246
Energy: 0.953424420645954
Energy: 1.0303445583329964
Energy: 0.9638150957384601
Energy: 0.9783189232385197
Energy: 0.9534244206442543
Energy: 1.030344558334759
Energy: 0.9638150957377677

minimum gb energy = 0.9406231821667501 eV
minimum distance =  2.29178044282528 Angstroms
sigma value = 311


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

Energy: 0.9739295815402845
Energy: 0.9656407557030363
Energy: 1.017340301490123
Energy: 0.9303417332030426
Energy: 0.9739295815410841
Energy: 0.9656407557026366
Energy: 1.0358723781354913
Energy: 1.019415347576519
Energy: 1.004289536046715
Energy: 1.001057807732663
Energy: 0.957392754250593
Energy: 1.0194153475753198
Energy: 1.004289536046315
Energy: 1.001057807731064
Energy: 0.965725962581145
Energy: 0.989595971094944
Energy: 0.9911435139958092
Energy: 0.9646425703274342
Energy: 0.9657259625807453
Energy: 0.9895959710941807
Energy: 0.9911435139706215
Energy: 0.9706779895474396
Energy: 0.9208596797076636
Energy: 0.9868357617100653
Energy: 0.9494040329900253
Energy: 0.970677989548239
Energy: 0.9208596797072637
Energy: 0.9868357617120643
Energy: 0.988777316410648
Energy: 0.9346297050901969
Energy: 1.0640220498231812
Energy: 0.979989533463618
Energy: 0.9887773164114477
Energy: 0.9346297050905966
Energy: 1.0372694686083017
Energy: 0.966270234074497
Energy: 0.9496971588763617
Energy: 1.0097937511069568
Energy: 0.9390918349352044
Energy: 0.9662702340720982
Energy: 0.9496971588743626
Energy: 1.0097937511073565
Energy: 0.9718295746829564
Energy: 0.9648638126804994
Energy: 1.0179855564758962
Energy: 0.9743599215416271
Energy: 0.9718295746821568
Energy: 0.9648638126816989
Energy: 1.0272166496533146
Energy: 0.9687620140583417
Energy: 0.9338246090991508
Energy: 1.029769538396051
Energy: 0.980858247693437
Energy: 0.9687620140583417
Energy: 0.9338246090991508
Energy: 1.0297695383968506
Energy: 0.9801611597591644
Energy: 0.9288851305659426
Energy: 1.0210912220637354
Energy: 0.9284892524263542
Energy: 0.9801611597583649
Energy: 0.9288851305655428
Energy: 1.0210912220645352
Energy: 0.9402514864136737
Energy: 0.9968328489065958
Energy: 1.0238377680652333
Energy: 0.9819531792259697
Energy: 0.9402514864132738
Energy: 0.9968328489057963
Energy: 1.0238377680652333
Energy: 1.007718403041894
Energy: 0.992685114551315
Energy: 1.0595979881394195
Energy: 0.9128781273535923
Energy: 1.007718403041894
Energy: 0.9926851145517148
Energy: 1.0595979881398192
Energy: 0.9977942169296204
Energy: 0.9829839014428307
Energy: 0.9974819086614948
Energy: 0.9892476616235253
Energy: 0.9977942169308198
Energy: 0.9829839014416312
Energy: 0.9974819086638937
Energy: 0.9740804560303875
Energy: 0.9660720130103838
Energy: 1.0050295339010125
Energy: 0.9382097281655034
Energy: 0.9740804560299876
Energy: 0.9660720130103838
Energy: 1.0050295339014121
Energy: 0.9439027851054957
Energy: 0.9700503600468078
Energy: 1.0149166319777134
Energy: 0.9753199821205474
Energy: 0.9439027851050961
Energy: 0.9700503600468078
Energy: 1.0149166319773137
Energy: 0.986612496292636
Energy: 0.9208629088717939
Energy: 0.9672945180526481
Energy: 0.9510637014322785
Energy: 0.9866124962914367
Energy: 0.9208629088721937
Energy: 0.9672945180526481
Energy: 0.9980251031989338
Energy: 0.9459418346396488
Energy: 1.0104768466455123
Energy: 0.980299989980205
Energy: 0.9980251031981341
Energy: 0.9459418346396488
Energy: 1.0104768466451128
Energy: 0.9892163652430884
Energy: 0.9401205884596915
Energy: 1.019937274841581
Energy: 0.9914292311222611
Energy: 0.9892163652434881
Energy: 0.9401205884596915
Energy: 1.0199372748427804
Energy: 0.956933621251438
Energy: 1.0250173931211877
Energy: 0.9950732976980347
Energy: 1.0016737327720153
Energy: 0.9569336212522377
Energy: 1.0250173931211877
Energy: 0.9950732976996339
Energy: 0.974795462309588
Energy: 0.9324728064020343
Energy: 1.0444672405456972
Energy: 0.972781590256887
Energy: 0.9747954623099877
Energy: 0.9324728064012346
Energy: 1.0444672405444977
Energy: 0.9984686539003372
Energy: 0.9265868474964516
Energy: 1.061772025397267
Energy: 0.9498529008398082
Energy: 0.9984686539011368
Energy: 0.9265868474980509
Energy: 1.0617720253976666
Energy: 0.9611339299004735
Energy: 0.9863511464248188
Energy: 1.053274499698235
Energy: 0.9836489094223229
Energy: 0.9611339299016729
Energy: 0.986351146424419
Energy: 1.0432236308486134
Energy: 0.9564212213646482
Energy: 0.988229458131926
Energy: 1.0481636437818136
Energy: 0.9110418935519137
Energy: 0.9564212213626492
Energy: 0.9882294581311264
Energy: 1.0481636437818136
Energy: 0.9885653473171414
Energy: 0.9777321763135775
Energy: 1.0135205763827815
Energy: 0.9345603112143623
Energy: 0.988565347317941
Energy: 0.9777321763135775
Energy: 1.0135205763843809
Energy: 0.9565560277534398
Energy: 0.9508160274594011
Energy: 1.0017586818584672
Energy: 0.9587887823806472
Energy: 0.9565560277538395
Energy: 0.9508160274590012
Energy: 1.0017586818572677
Energy: 0.9713762027552468
Energy: 0.9568698800439579
Energy: 0.9973311742908595
Energy: 0.9649787002631293
Energy: 0.9713762027556466
Energy: 0.9568698800443576
Energy: 0.9973311742900599
Energy: 0.9984547138172111
Energy: 0.9764168905389651
Energy: 1.0007334290263312
Energy: 0.9966476772263533
Energy: 0.9984547138160117
Energy: 0.9764168905397645
Energy: 1.000733429027531
Energy: 0.9907108752129348
Energy: 0.9442554942707068
Energy: 1.0100400849130056
Energy: 0.9299402688559819
Energy: 0.9907108752125349
Energy: 0.9442554942715063
Energy: 1.0107094926996532
Energy: 1.006445033456496
Energy: 1.011927965930926
Energy: 0.9695693092251554
Energy: 0.9586529381274274
Energy: 1.0064450334560964
Energy: 1.0119279659305263
Energy: 0.9695693092251554
Energy: 0.9609908351248365
Energy: 0.985220310297595
Energy: 0.9693132272488791
Energy: 0.961104407785067
Energy: 0.9609908351252364
Energy: 0.9852203102983946
Energy: 0.9693132272488791
Energy: 0.9578891189297306
Energy: 0.9310510187487319
Energy: 0.9885974081552434
Energy: 0.9497692531143065
Energy: 0.957889118928931
Energy: 0.9310510187479323
Energy: 0.9885974081564428
Energy: 0.9755589500394872
Energy: 0.934790588789734
Energy: 1.0151012656469545
Energy: 0.9747525128264525
Energy: 0.9755589500394872
Energy: 0.9347905887901337
Energy: 1.0151012656469545
Energy: 0.9601646252144895
Energy: 0.9109626783554191
Energy: 1.0016398892167335
Energy: 0.9183181884944913
Energy: 0.9601646252140896
Energy: 0.9109626783562187
Energy: 1.0016398892167335
Energy: 0.9714034116239294
Energy: 0.9729090294778462
Energy: 1.029186608836603
Energy: 0.9930389193029534
Energy: 0.9714034116235295
Energy: 0.9729090294782461
Energy: 1.0291866088362034
Energy: 0.9687651550128814
Energy: 0.9337758606407263
Energy: 1.0039048458307926
Energy: 0.9555026688380579
Energy: 0.9687651550124817
Energy: 0.9337758606403266
Energy: 1.003904845799208
Energy: 0.9607930812942852
Energy: 0.9300288931493644
Energy: 1.0538802502735123
Energy: 0.9739009446409421
Energy: 0.9607930812954845
Energy: 0.9300288931493644
Energy: 1.041912511637576
Energy: 0.9476902446093225
Energy: 0.9942689966439584
Energy: 1.0477490536109202
Energy: 0.9820210675645368
Energy: 0.9476902446085227
Energy: 0.9942689966451577
Energy: 1.0477490536109202

minimum gb energy = 0.9109626783554191 eV
minimum distance =  2.26767507819911 Angstroms
sigma value = 39


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

Energy: 0.8881907801868696
Energy: 0.9772012252575771
Energy: 1.029089512832469
Energy: 0.9772329317261689
Energy: 0.8881907801849821
Energy: 0.9772012252552179
Energy: 1.0133174253635666
Energy: 0.8762165284468191
Energy: 0.979361552705919
Energy: 0.9465039573247918
Energy: 0.9794892006141671
Energy: 0.87621652844965
Energy: 0.9793615527063907
Energy: 0.9465039573229043
Energy: 0.888347111209496
Energy: 0.8462562204814047
Energy: 0.9521088686827522
Energy: 0.9010079036975311
Energy: 0.8883471112109117
Energy: 0.8462562204771581
Energy: 0.9521088686818087
Energy: 0.8757472422963812
Energy: 0.979339984498129
Energy: 0.9470692967701686
Energy: 0.946582076545665
Energy: 0.8757472422949656
Energy: 0.9793399844967134
Energy: 0.9470692967687531
Energy: 0.9653663772086697
Energy: 0.9118969940874353
Energy: 0.9147334337267947
Energy: 0.9008844986782885
Energy: 0.9653663772105571
Energy: 0.9118969940869635
Energy: 0.9147334337277385
Energy: 0.8761103497201184
Energy: 0.917374967867596
Energy: 0.9863344150747148
Energy: 0.9180669674308541
Energy: 0.8761103497191747
Energy: 0.917374967867124
Energy: 0.9863344150718836
Energy: 1.0620051996760866
Energy: 0.911629735709326
Energy: 0.9418410174762334
Energy: 0.9003761259836275
Energy: 1.0620051996760866
Energy: 0.9116297357102698
Energy: 0.9418410174781207
Energy: 0.8767073707871996
Energy: 0.872450636042774
Energy: 1.086063649697194
Energy: 0.8719911890247452
Energy: 0.8767073707843686
Energy: 0.8724506360404147
Energy: 1.086063649697666
Energy: 1.0620762982042757
Energy: 0.9001830917023989
Energy: 0.9323367519533956
Energy: 0.9114487445017411
Energy: 1.0620762982033318
Energy: 0.9001830917028706
Energy: 0.9180690490804659
Energy: 0.8761333969819605
Energy: 0.9182961920752434
Energy: 0.9862950604472281
Energy: 0.91795571853989
Energy: 0.8761333969810169
Energy: 0.9182961920799619
Energy: 0.9862950604476999
Energy: 0.965359201763903
Energy: 0.9010149096060502
Energy: 0.9038362287376908
Energy: 0.9118427449359883
Energy: 0.9653592017672058
Energy: 0.9010149096046347
Energy: 0.8922999573703063
Energy: 0.8759867529891313
Energy: 0.9467535857197852
Energy: 0.9470816160708341
Energy: 0.9796397406439296
Energy: 0.8759867529872438
Energy: 0.9467535857207289
Energy: 0.9470816160708341
Energy: 0.8880209971904354
Energy: 0.9010010937784902
Energy: 0.9429342183998572
Energy: 0.8462468061215367
Energy: 0.888020997191851
Energy: 0.901001093778962
Energy: 0.9429342183984417
Energy: 0.8763278460173602
Energy: 0.979447366111313
Energy: 0.9463145023486019
Energy: 0.978984047965994
Energy: 0.8763278460159447
Energy: 0.9794473661188626
Energy: 0.9463145023504893
Energy: 0.8881907801878132
Energy: 0.9772012252580491
Energy: 1.013670092900702
Energy: 0.9772329317256969
Energy: 0.8881907801859258
Energy: 0.9772012252542742
Energy: 1.0215232546387212
Energy: 0.8762165284463472
Energy: 0.9793615527063907
Energy: 0.9465039573247918
Energy: 0.9794892006155825
Energy: 0.8762165284487063
Energy: 0.9793615527073344
Energy: 0.9465039573224325
Energy: 0.888347111209968
Energy: 0.8462562204804611
Energy: 0.9521088686827522
Energy: 0.9010079036970593
Energy: 0.8883471112109117
Energy: 0.84625622047763
Energy: 0.9521088686818087
Energy: 0.8757472422954374
Energy: 0.9793399844976572
Energy: 0.9470692967706404
Energy: 0.9465820765442492
Energy: 0.8757472422949656
Energy: 0.9793399844971853
Energy: 0.9470692967692248
Energy: 0.9653663772063105
Energy: 0.9118969940888509
Energy: 0.9147334337244355
Energy: 0.9008844986782885
Energy: 0.9653663772100852
Energy: 0.9118969940879071
Energy: 0.9147334337263229
Energy: 0.8761103497196465
Energy: 0.9173749678666522
Energy: 0.9863344150756586
Energy: 0.918066967431326
Energy: 0.8761103497187028
Energy: 0.917374967867124
Energy: 0.9863344150737711
Energy: 1.0620051996756148
Energy: 0.911629735709798
Energy: 0.8853431028939696
Energy: 0.9003761259831558
Energy: 1.0620051996760866
Energy: 0.9116297357102698
Energy: 0.8853431028958569
Energy: 0.8767073707881432
Energy: 0.872450636042774
Energy: 1.086063649697666
Energy: 0.8719911890242732
Energy: 0.876707370785784
Energy: 0.8724506360408866
Energy: 1.086063649697194
Energy: 1.0620762982038037
Energy: 0.900183091701927
Energy: 0.9082450847736321
Energy: 0.9114487445017411
Energy: 1.06207629820286
Energy: 0.9001830917009833
Energy: 0.9082450847712726
Energy: 0.8761333969810169
Energy: 0.9182961920776027
Energy: 0.9862950604467562
Energy: 0.917955718540362
Energy: 0.8761333969810169
Energy: 0.9182961920757153
Energy: 0.9862950604481718
Energy: 0.9653592017648466
Energy: 0.9010149096060502
Energy: 0.8732098087533006
Energy: 0.9118427449350446
Energy: 0.9653592017681496
Energy: 0.9010149096051066
Energy: 0.8732098087533006
Energy: 0.875986752989603
Energy: 0.9467535857197852
Energy: 0.9470816160708341
Energy: 0.9796397406444013
Energy: 0.8759867529877157
Energy: 0.9467535857207289
Energy: 0.9470816160703623
Energy: 0.8880209971909072
Energy: 0.9010010937780183
Energy: 0.9422726451831911
Energy: 0.8462468061205929
Energy: 0.8880209971923229
Energy: 0.9010010937784902
Energy: 0.9422726451831911
Energy: 0.8763278460168884
Energy: 0.9794473661127285
Energy: 0.9463145023486019
Energy: 0.978984047965994
Energy: 0.876327846015001
Energy: 0.9794473661193344
Energy: 0.9463145023504893
Energy: 0.8881907801868696
Energy: 0.9772012252575771
Energy: 1.0007614467378674
Energy: 0.9772329317261689
Energy: 0.8881907801845101
Energy: 0.9772012252542742
Energy: 1.0136700929021174
Energy: 0.8762165284463472
Energy: 0.9793615527063907
Energy: 0.9465039573252637
Energy: 0.9794892006151107
Energy: 0.87621652844965
Energy: 0.979361552705919
Energy: 0.9465039573233762

minimum gb energy = 0.8462468061205929 eV
minimum distance =  2.30413107511578 Angstroms
sigma value = 21


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

Energy: 0.9662674575002881
Energy: 1.0463564331423878
Energy: 1.0103852116586174
Energy: 1.044869583810425
Energy: 0.9662674574997153
Energy: 1.0463564331435333
Energy: 0.9923502005236903
Energy: 0.9767072551566504
Energy: 0.9124573425296874
Energy: 1.0008806273465098
Energy: 0.9123194725162976
Energy: 0.9767072551560776
Energy: 0.912457342530833
Energy: 1.0008806273465098
Energy: 0.9664546568567255
Energy: 0.9206097724129947
Energy: 0.992663010126235
Energy: 0.993005578864435
Energy: 0.966454656857871
Energy: 0.9206097724135677
Energy: 0.992663010123944
Energy: 0.9524206891047644
Energy: 0.9485849439250732
Energy: 0.9319608616219871
Energy: 0.9095157305503926
Energy: 0.95242068910591
Energy: 0.9485849439250732
Energy: 0.9319608616208414
Energy: 0.928139870641814
Energy: 0.9341268679268809
Energy: 0.946440511029392
Energy: 0.9514498666479871
Energy: 0.9281398706423869
Energy: 0.934126867924017
Energy: 0.9464405110288192
Energy: 0.9524279545804312
Energy: 0.9444830350703296
Energy: 1.0230757375267527
Energy: 0.9138994918542578
Energy: 0.9524279545821236
Energy: 0.9444830350691839
Energy: 1.0230757375267527
Energy: 0.9581888946553615
Energy: 0.9379566978579685
Energy: 0.9441288400702172
Energy: 0.9393088262505962
Energy: 0.958188894653643
Energy: 0.9379566978573958
Energy: 0.9441288400696445
Energy: 0.9501649118628196
Energy: 0.9845794635456545
Energy: 0.9478601155564425
Energy: 0.9138207759590781
Energy: 0.9501649118616741
Energy: 0.9845794635462273
Energy: 0.9478601155581607
Energy: 0.9581657040475894
Energy: 0.9131514305646257
Energy: 0.9275386876985701
Energy: 0.9646426721963061
Energy: 0.9581657040493077
Energy: 0.9131514305634801
Energy: 0.9275386876979972
Energy: 0.9391575192845512
Energy: 0.9422483735614335
Energy: 0.9320995496447014
Energy: 0.9128399221270823
Energy: 0.9391575192856969
Energy: 0.9422483735620063
Energy: 0.932099549645847
Energy: 0.9680538687951594
Energy: 0.9221029877713912
Energy: 0.927267816880951
Energy: 0.9518055050682409
Energy: 0.9680538687945867
Energy: 0.9221029877736825
Energy: 0.9272678168786597
Energy: 0.8777365864477712
Energy: 0.9632060409990943
Energy: 0.9244037529236107
Energy: 0.9005468536649119
Energy: 0.8777365864500625
Energy: 0.9632060409990943
Energy: 0.9244037529236107
Energy: 0.9676560308084433
Energy: 0.9203272892824439
Energy: 0.9481718100059463
Energy: 0.9489433320748838
Energy: 0.9676560308090162
Energy: 0.9203272892830168
Energy: 0.9481718100048008
Energy: 0.877529634569496
Energy: 0.9639345080551498
Energy: 0.948225538867102
Energy: 0.9277283566935046
Energy: 0.8775296345672049
Energy: 0.9639345080562953
Energy: 0.9482255388659563
Energy: 0.9777481507909945
Energy: 0.8942622089539907
Energy: 0.9306063892072469
Energy: 0.9275347052283982
Energy: 0.977748150789849
Energy: 0.894262208952845
Energy: 0.9306063892066739
Energy: 0.8777299694695014
Energy: 0.9968149729128183
Energy: 0.9246334328925351
Energy: 0.926830826756065
Energy: 0.8777299694695014
Energy: 0.996814972913391
Energy: 0.9246334328913896
Energy: 0.9768208345454704
Energy: 0.8939277759516071
Energy: 0.9609154153912648
Energy: 0.9273395882614995
Energy: 0.9768208345454704
Energy: 0.8939277759527527
Energy: 0.9609154153906919
Energy: 0.8777383564305884
Energy: 0.9282828280956356
Energy: 0.9300080942913399
Energy: 0.9808302413198628
Energy: 0.8777383564305884
Energy: 0.9282828280950628
Energy: 0.9300080942901944
Energy: 0.9666638667329396
Energy: 0.8959633632780689
Energy: 1.0130254125223186
Energy: 0.9090896387217507
Energy: 0.9666638667329396
Energy: 0.8959633632792146
Energy: 1.0130254125228915
Energy: 0.8775598558842683
Energy: 0.9863859471255921
Energy: 0.9185802542305785
Energy: 0.9863801029774806
Energy: 0.8775598558842683
Energy: 0.9863859471267378
Energy: 0.9185802542294329
Energy: 0.9666729222620707
Energy: 0.9095554605131944
Energy: 1.0128298019219169
Energy: 0.8958937568677904
Energy: 0.9666729222609252
Energy: 0.9095554605137671
Energy: 1.0128298019201984
Energy: 0.877737145269303
Energy: 0.9808650763924431
Energy: 0.9300231561559335
Energy: 0.9282934257742227
Energy: 0.8777371452687303
Energy: 0.9808650763924431
Energy: 0.9300231561559335
Energy: 0.9767323869479182
Energy: 0.9273212704316012
Energy: 0.9610078737404152
Energy: 0.8939589581864941
Energy: 0.9767323869461997
Energy: 0.9273212704316012
Energy: 0.9610078737415607
Energy: 0.8777432190497388
Energy: 0.9266899821135975
Energy: 0.9246990653144871
Energy: 0.9968452613239095
Energy: 0.8777432190497388
Energy: 0.926689982115316
Energy: 0.9246990653144871
Energy: 0.9771669666440264
Energy: 0.9275437000983863
Energy: 1.0244445005850074
Energy: 0.8942231566381459
Energy: 0.9771669666440264
Energy: 0.927543700098959
Energy: 1.0244445005861529

minimum gb energy = 0.8775296345672049 eV
minimum distance =  2.27445529630058 Angstroms
sigma value = 113


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

Energy: 0.9703239873201915
Energy: 1.031648836831657
Energy: 0.9405463695855012
Energy: 1.0317634502477
Energy: 0.9703239873233883
Energy: 1.031648836831657
Energy: 0.9405463695823043
Energy: 0.9990050848532942
Energy: 0.9963404032290755
Energy: 0.9992768012191104
Energy: 0.970306295751872
Energy: 0.9990050848532942
Energy: 0.9963404032290755
Energy: 0.9992768012159137
Energy: 0.9730250589259063
Energy: 0.9759545971867802
Energy: 0.9377868805603088
Energy: 0.9829346123587986
Energy: 0.9730250589259063
Energy: 0.9759545971835835
Energy: 0.9377868805571119
Energy: 0.9219453163733504
Energy: 1.0051315475047846
Energy: 1.0193234805846954
Energy: 0.9710355203363397
Energy: 0.9219453163701535
Energy: 1.005131547498391
Energy: 1.019323480587892
Energy: 1.0026675077150158
Energy: 0.9328144974616561
Energy: 0.9552248132568814
Energy: 0.9396969366790388
Energy: 1.0026675077150158
Energy: 0.9328144974616561
Energy: 0.9552248132536846
Energy: 0.9198729610664182
Energy: 0.9349676862441453
Energy: 0.975557360302569
Energy: 0.9354281900012976
Energy: 0.9198729610664182
Energy: 0.9349676862409487
Energy: 0.975557360302569
Energy: 0.9148648021102465
Energy: 0.9386590470404047
Energy: 0.9436792081772412
Energy: 0.9252189610194222
Energy: 0.9148648021070497
Energy: 0.9386590470404047
Energy: 0.9436792081772412
Energy: 0.921998039309869
Energy: 0.9620659038683882
Energy: 1.0120772239541347
Energy: 0.9113806511372975
Energy: 0.921998039309869
Energy: 0.962065903871585
Energy: 1.0120772239541347
Energy: 0.913336245805442
Energy: 0.940605002006265
Energy: 0.928107923331218
Energy: 0.9198947753432547
Energy: 0.9133362458086388
Energy: 0.9406050020094617
Energy: 0.9281079233344149
Energy: 0.8970903388711057
Energy: 0.9627108968641945
Energy: 0.9855856219332342
Energy: 0.9418900444095948
Energy: 0.897090338867909
Energy: 0.9627108968673914
Energy: 0.9855856219364308
Energy: 0.9138411867658033
Energy: 0.9789135820227985
Energy: 1.0414191006765776
Energy: 0.9200662133151685
Energy: 0.9138411867658033
Energy: 0.9789135820259952
Energy: 1.0414191006797742
Energy: 0.8974637795048168
Energy: 0.9581692297837343
Energy: 1.0820771193313017
Energy: 0.9611218544050103
Energy: 0.8974637795048168
Energy: 0.9581692297773409
Energy: 1.0820771193344987
Energy: 0.9586868764492598
Energy: 0.967802531216893
Energy: 1.0411623567178379
Energy: 0.9577791372058688
Energy: 0.9586868764460629
Energy: 0.967802531216893
Energy: 1.0411623567178379
Energy: 0.9808359814028336
Energy: 1.0447481843797244
Energy: 1.0819605158498362
Energy: 0.9772166149619204
Energy: 0.9808359813996368
Energy: 1.044748184382921
Energy: 1.0819605158530328
Energy: 0.9590080838269096
Energy: 1.0032020495722167
Energy: 1.087913467835352
Energy: 1.0133929213823265
Energy: 0.9590080838237128
Energy: 1.0032020495690779
Energy: 1.0879134678385485
Energy: 0.9809050656022794
Energy: 0.9538068887465155
Energy: 1.0077601521398933
Energy: 0.9612750271611511
Energy: 0.9809050656054763
Energy: 0.9538068887433188
Energy: 1.0077601521430901
Energy: 1.0169064319669685
Energy: 0.9684123262483428
Energy: 1.0966032391629483
Energy: 0.9577093640615744
Energy: 1.0169064319669685
Energy: 0.968412326245146
Energy: 1.0966032391693419
Energy: 0.8989569535384452
Energy: 0.9561929620324083
Energy: 0.9781563296064557
Energy: 0.9210963072657353
Energy: 0.898956953541642
Energy: 0.9561929620324083
Energy: 0.9781563296064557
Energy: 1.016244469587514
Energy: 0.955031083745469
Energy: 0.9862841283351423
Energy: 0.9823207397116612
Energy: 1.0162444695843171
Energy: 0.9550310837422721
Energy: 0.9862841283351423
Energy: 0.9364130652497789
Energy: 0.96812422158013
Energy: 0.9442807120812048
Energy: 0.9173959964829357
Energy: 0.9364130652497789
Energy: 0.96812422158013
Energy: 0.9442807120875983
Energy: 0.9735731192516336
Energy: 0.9246144708883279
Energy: 1.017373567244589
Energy: 0.9978809532315542
Energy: 0.9735731192516336
Energy: 0.9246144708883279
Energy: 1.0173735672509825
Energy: 0.9434176380598255
Energy: 0.9204334973287492
Energy: 0.9296877887186441
Energy: 0.9301836871683129
Energy: 0.9434176380566287
Energy: 0.9204334973255524
Energy: 0.9296877887154473
Energy: 0.9743965782646707
Energy: 0.9110047738284092
Energy: 1.0051436975674377
Energy: 0.9954597058262337
Energy: 0.9743965782646707
Energy: 0.9110047738220154
Energy: 1.005143697564241
Energy: 0.9294614316989227
Energy: 0.9402608477258583
Energy: 0.9238285688795997
Energy: 0.9208371321821734
Energy: 0.9294614316989227
Energy: 0.9402608477258583
Energy: 0.9238285688795997
Energy: 0.922999664019896
Energy: 0.9900568751995992
Energy: 1.057681259952159
Energy: 1.0145216800027994
Energy: 0.922999664019896
Energy: 0.9900568751964022
Energy: 1.0576812599457657
Energy: 0.9442431887138204
Energy: 0.9656441842576297
Energy: 1.0273660320413887
Energy: 0.9753855150774949
Energy: 0.9442431887138204
Energy: 0.9656441842608264
Energy: 1.0273660320477822
Energy: 0.998632755973257
Energy: 0.9957941704562736
Energy: 0.9574110915673826
Energy: 0.9930030673639217
Energy: 0.9986327559764537
Energy: 0.9957941704594705
Energy: 0.9911290940003544
Energy: 0.9515525092589904
Energy: 1.0050005918160134
Energy: 1.0273000870775781
Energy: 1.0118705476606695
Energy: 0.9515525092557936
Energy: 1.0050005918160134
Energy: 1.0273000870775781
Energy: 0.9986391556391608
Energy: 0.9773700342732898
Energy: 1.01974977784489
Energy: 0.9971395608134972
Energy: 0.9986391556327671
Energy: 0.9773700342732898
Energy: 1.0197497778416933
Energy: 0.9429300151004301
Energy: 0.9595528197657016
Energy: 0.9975366225393384
Energy: 1.0025543920007125
Energy: 0.9429300150972332
Energy: 0.9595528197657016
Energy: 0.9975366225361416
Energy: 0.9253586749690541
Energy: 0.9566669862748657
Energy: 1.0511522123884371
Energy: 0.9622282678979592
Energy: 0.9253586749690541
Energy: 0.956666986271669
Energy: 1.051152212391634
Energy: 0.9479515563117197
Energy: 0.929663713671368
Energy: 0.9871739504659728
Energy: 0.9682749925337873
Energy: 0.9479515563149167
Energy: 0.9296637136681711
Energy: 0.987173950462776
Energy: 0.9245088688814123
Energy: 0.9337259274504189
Energy: 1.0259885352068232
Energy: 0.9620899194038964
Energy: 0.9245088688878059
Energy: 0.9337259274440252
Energy: 1.0259885352068232
Energy: 0.9195021283374365
Energy: 0.9298101160550453
Energy: 0.9425914602959571
Energy: 0.929935085450692
Energy: 0.9195021283438299
Energy: 0.9298101160550453
Energy: 0.9425914602959571
Energy: 0.9307966701961281
Energy: 0.889210006680103
Energy: 1.0366744485155135
Energy: 0.9623152938257317
Energy: 0.9307966701897347
Energy: 0.889210006680103
Energy: 1.0366744485155135
Energy: 0.9197917101979508
Energy: 0.9420428411283538
Energy: 0.944530167256443
Energy: 0.9245393520586339
Energy: 0.9197917101979508
Energy: 0.9420428411315508
Energy: 0.9445301672532461
Energy: 0.919152358081559
Energy: 0.9231265188547467
Energy: 1.006316310873281
Energy: 0.9575957572325515
Energy: 0.9191523580847558
Energy: 0.9231265188579435
Energy: 1.006316310860494
Energy: 0.9229941946958169
Energy: 0.90342753935762
Energy: 0.9547122169106365
Energy: 0.9239756762849863
Energy: 0.9229941946926202
Energy: 0.9034275393512263
Energy: 0.9547122169106365
Energy: 0.9207471549874408
Energy: 0.9305068785656416
Energy: 1.0899661110666807
Energy: 0.9601905783068193
Energy: 0.920747154984244
Energy: 0.930506878559248
Energy: 1.0899661110698775
Energy: 0.9233029219481738
Energy: 0.9625150486483499
Energy: 0.9553951832954471
Energy: 0.9469991839440082
Energy: 0.92330292194178
Energy: 0.9625150486547435
Energy: 0.9553951832986439
Energy: 0.9650768062319633
Energy: 0.9288327382928271
Energy: 1.089982226495579
Energy: 0.9727299013585935
Energy: 0.9650768062351601
Energy: 0.9288327382928271
Energy: 1.0899822264987757
Energy: 0.923336437109245
Energy: 1.00492872701129
Energy: 1.0969110379752318
Energy: 1.0118515177574492
Energy: 0.9233364371156384
Energy: 1.0049287270144867
Energy: 1.0969110379784288
Energy: 0.9603301577210176
Energy: 0.9132793943389039
Energy: 0.9774572921351399
Energy: 0.9229913108255791
Energy: 0.9603301577242145
Energy: 0.9132793943421007
Energy: 0.9774572921383369
Energy: 0.9499061271496719
Energy: 0.9780639106750695
Energy: 1.097311961787827
Energy: 0.9626856829636755
Energy: 0.9499061271560655
Energy: 0.9780639106782663
Energy: 1.09731196178463
Energy: 0.9137199203553484
Energy: 0.9264930576845403
Energy: 1.0068414589539458
Energy: 0.9757302786394123
Energy: 0.913719920348955
Energy: 0.9264930576845403
Energy: 1.0068414589603398

minimum gb energy = 0.889210006680103 eV
minimum distance =  2.25087244043708 Angstroms
sigma value = 365


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

Energy: 1.0572412009309329
Energy: 0.7653340416810678
Energy: 1.1371125256979804
Energy: 0.7653340416803469
Energy: 1.0572412009316536
Energy: 0.7653340416796262
Energy: 0.9520549535102547
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8961619799891336
Energy: 0.7653340416810678
Energy: 1.0572412009294911
Energy: 0.7653340416803469
Energy: 0.8776815069355512
Energy: 1.0572412009302121
Energy: 0.7653340416803469
Energy: 0.8961619763228231
Energy: 0.7653340416796262
Energy: 1.0572412009294911
Energy: 0.7653340416810678
Energy: 0.8961619749597346
Energy: 1.0572412009302121
Energy: 0.7653340416817885
Energy: 1.0126731954731587
Energy: 0.7653340416789055
Energy: 1.0572412009309329
Energy: 0.7653340416789055
Energy: 0.8126584961552396
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 1.0633332173706664
Energy: 0.7653340416810678
Energy: 1.0572412009309329
Energy: 0.7653340416803469
Energy: 0.8775352713210344
Energy: 1.0572412009294911
Energy: 0.7653340416803469
Energy: 1.010542227364858
Energy: 0.7653340416803469
Energy: 1.0572412009302121
Energy: 0.7653340416810678
Energy: 0.95193773587113
Energy: 1.0572412009302121
Energy: 0.7653340416817885
Energy: 0.8126584950962135
Energy: 0.7653340416796262
Energy: 1.0572412009316536
Energy: 0.7653340416796262
Energy: 0.812658494927621
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.9519377358718506
Energy: 0.7653340416803469
Energy: 1.0572412009294911
Energy: 0.7653340416803469
Energy: 0.8774495154573093
Energy: 1.0572412009302121
Energy: 0.7653340416789055
Energy: 0.952054953508813
Energy: 0.7653340416796262
Energy: 1.0572412009294911
Energy: 0.7653340416810678
Energy: 0.8775352713203136
Energy: 1.0572412009294911
Energy: 0.7653340416803469
Energy: 0.9520549535095337
Energy: 0.7653340416796262
Energy: 1.0572412009316536
Energy: 0.7653340416803469
Energy: 0.9520549535080922
Energy: 1.0572412009302121
Energy: 0.7653340416789055
Energy: 0.952054953508813
Energy: 0.7653340416810678
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8775352713203136
Energy: 1.0572412009302121
Energy: 0.7653340416803469
Energy: 0.8776815069723101
Energy: 0.7653340416810678
Energy: 1.0572412009302121
Energy: 0.7653340416796262
Energy: 0.8776815069838422
Energy: 1.0572412009302121
Energy: 0.7653340416803469
Energy: 0.8776815069377136
Energy: 0.7653340416803469
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8776815069967833
Energy: 1.0572412009302121
Energy: 0.7653340416796262
Energy: 0.8776815069420381
Energy: 0.7653340416803469
Energy: 1.0572412009302121
Energy: 0.7653340416803469
Energy: 0.877681507006153
Energy: 1.0572412009302121
Energy: 0.7653340416789055
Energy: 0.8776815070126398
Energy: 0.7653340416803469
Energy: 1.0572412009302121
Energy: 0.7653340416810678
Energy: 0.8776815069463627
Energy: 1.0572412009294911
Energy: 0.7653340416810678
Energy: 0.8776815069434798
Energy: 0.7653340416803469
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8776815070234514
Energy: 1.0572412009302121
Energy: 0.7653340416796262
Energy: 0.8776815069672648
Energy: 0.7653340416810678
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8776815069499665
Energy: 1.0572412009302121
Energy: 0.7653340416796262
Energy: 0.8776815069341098
Energy: 0.7653340416803469
Energy: 1.0572412009302121
Energy: 0.7653340416803469
Energy: 0.8776815069550118
Energy: 1.0572412009294911
Energy: 0.7653340416817885
Energy: 0.8776815069269022
Energy: 0.7653340416810678
Energy: 1.0572412009309329
Energy: 0.7653340416796262
Energy: 0.8776815070176852
Energy: 1.0572412009294911
Energy: 0.7653340416796262
Energy: 0.8776815069773554
Energy: 0.7653340416810678
Energy: 1.0572412009294911
Energy: 0.7653340416803469
Energy: 0.8776815069355512

minimum gb energy = 0.7653340416789055 eV
minimum distance =  2.3861715717 Angstroms
sigma value = 23