Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_002
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784385667436
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[0.0, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-17]
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: 0.013667490378793399
Energy: 0.014170468243365522
Energy: 0.6971397356099764
Energy: 0.103803578103756
Energy: 0.014170468243365522
Energy: 0.7108661099996914
Energy: 0.10380357810316307
Energy: 0.7108661100003191
Energy: 0.6971397356179635
Energy: 0.10380357810253528
Energy: 0.013667490378793399
Energy: 0.01417046824273772
Energy: 0.10380357810316307
Energy: 0.7108661100015398
Energy: 0.014170468243365522
Energy: 0.7108661099990634

minimum gb energy = 0.013667490378793399 eV
minimum distance =  2.48450854458923 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.264138738460598
Energy: 0.8152267197959012
Energy: 0.9106024874927987
Energy: 0.9097082498385627
Energy: 0.9354334331337815
Energy: 0.8966674070315553
Energy: 0.8781652043389191
Energy: 0.8966674070315553
Energy: 0.909812729746159
Energy: 0.909781478011832
Energy: 1.3760348076093103
Energy: 0.909781478011832
Energy: 0.8739428145334451
Energy: 1.0427722570244184
Energy: 0.8782364707575312
Energy: 1.0427722570251798
Energy: 1.1735197149604149
Energy: 0.8566868254716876
Energy: 0.8242385580831171
Energy: 0.8566868254724489
Energy: 0.919053598221682
Energy: 1.1785312083261859
Energy: 0.8459837809712502
Energy: 1.1785312083254245
Energy: 0.8863017288682775
Energy: 0.9465648640613491
Energy: 1.1744282772012797
Energy: 0.9465648640621105
Energy: 0.8797836415902349
Energy: 1.202790498530449
Energy: 0.8964708604604861
Energy: 1.202790498530449
Energy: 1.0076518758581618
Energy: 0.9905385327413267
Energy: 1.0111381474236363
Energy: 0.9905385327405654
Energy: 0.8942226691697387
Energy: 1.2410432935472975
Energy: 0.8799098999727113
Energy: 1.2410432935472975
Energy: 1.0830237484837373
Energy: 0.9906902844747317
Energy: 1.0096583177322538
Energy: 0.9906902844739705
Energy: 0.8768311945559499
Energy: 1.0790993073282193
Energy: 0.899609221870556
Energy: 1.0790993073289807
Energy: 0.882724450048786
Energy: 0.9466488815576983
Energy: 1.266892163233558
Energy: 0.9466488815576983
Energy: 0.9188193128014918
Energy: 1.1791169260886731
Energy: 0.8826376240569427
Energy: 1.1791169260886731
Energy: 1.265437181743426
Energy: 0.8562045081785948
Energy: 0.8210787981292366
Energy: 0.8562045081778336
Energy: 0.8554105787288967
Energy: 1.0422061226588941
Energy: 0.8779809757598135
Energy: 1.0422061226588941
Energy: 0.9099874067812451
Energy: 0.906767379898636
Energy: 1.485774266892533
Energy: 0.906767379898636
Energy: 0.8779520031986423
Energy: 0.8749932582737835
Energy: 0.9356637244237949
Energy: 0.8749932582714993
Energy: 1.3769031176624058
Energy: 0.90811690445539
Energy: 0.9090625937319375
Energy: 0.9081169044546287
Energy: 0.9179525980861263
Energy: 1.0427202655441048
Energy: 0.8732618550080041
Energy: 1.0427202655425822
Energy: 0.821233694376325
Energy: 0.8565019637946284
Energy: 1.1743092064371776
Energy: 0.8565019637946284
Energy: 0.8699047330095258
Energy: 1.2772309987170851
Energy: 0.9186254678453293
Energy: 1.2772309987163235
Energy: 1.1738171180203676
Energy: 0.9500970594859673
Energy: 0.8824575956197879
Energy: 0.950097059485206
Energy: 0.8968358518265236
Energy: 1.2027946333657102
Energy: 0.8777381656650578
Energy: 1.2027946333657102
Energy: 1.0090531431323135
Energy: 0.9921427838535504
Energy: 1.0085053756927067
Energy: 0.9921427838535504
Energy: 0.881577689066265
Energy: 0.9916349148827546
Energy: 0.8962180134373785
Energy: 0.9916349148827546
Energy: 1.0083365219407816
Energy: 0.9925130825274971
Energy: 1.0863588142486766
Energy: 0.9925130825274971
Energy: 0.8972332074897331
Energy: 1.0211228594627815
Energy: 0.8876437420115734
Energy: 1.02112285946202
Energy: 1.2707126934468376
Energy: 0.9465569068594415
Energy: 0.8821794610670057
Energy: 0.9465569068594415
Energy: 0.8827736492873576
Energy: 1.0047584274917463
Energy: 0.9184113296439769
Energy: 1.0047584274909847
Energy: 0.820670823199447
Energy: 0.855524666690236
Energy: 1.2691247979531897
Energy: 0.855524666690236
Energy: 0.8781220181998111
Energy: 1.0421465675320432
Energy: 0.8552760627301831
Energy: 1.0421465675312818
Energy: 1.4886080942448154
Energy: 0.8715227614837104
Energy: 0.9101894825837484
Energy: 0.8715227614821877

minimum gb energy = 0.8152267197959012 eV
minimum distance =  2.29601368063329 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.433039031992044
Energy: 0.8506315822125011
Energy: 0.9579337496563234
Energy: 0.9590999849767045
Energy: 0.9884580675573237
Energy: 0.9394630827857284
Energy: 0.9224833396420091
Energy: 0.9394630827848605
Energy: 0.9598705391256085
Energy: 0.9592650881012439
Energy: 1.3148620026744045
Energy: 0.9592650881021121
Energy: 0.9199691331679286
Energy: 1.0654267410619442
Energy: 0.923049656572741
Energy: 1.0654267410636806
Energy: 1.314669637369594
Energy: 0.8993892835393674
Energy: 0.8608868874664972
Energy: 0.8993892835393674
Energy: 0.9702679987460611
Energy: 1.2876385318744907
Energy: 0.8889490775634115
Energy: 1.2876385318762271
Energy: 0.9401347792514653
Energy: 1.0040708612038591
Energy: 1.1006805047793609
Energy: 1.004070861204727
Energy: 0.9223242976777706
Energy: 1.2189968861438032
Energy: 0.9460703367209118
Energy: 1.2189968861438032
Energy: 1.1005952837142696
Energy: 1.0476837918153992
Energy: 1.0076450952210334
Energy: 1.0476837918162674
Energy: 0.9470111474172095
Energy: 1.0689943992443653
Energy: 0.9227606922596978
Energy: 1.0689943992261348
Energy: 1.1966555910841172
Energy: 1.0037107397031555
Energy: 0.941450001288552
Energy: 1.0037107397040235
Energy: 0.9317640752957065
Energy: 1.1776471220058857
Energy: 0.9697709346267857
Energy: 1.1776471220119624
Energy: 0.8617806795595712
Energy: 0.9007515864167515
Energy: 1.196137367213727
Energy: 0.9007515864176195
Energy: 0.9225456597315387
Energy: 1.0654043557515516
Energy: 0.897392234475755
Energy: 1.0654043556465886
Energy: 1.4347431293365145
Energy: 0.959479148534275
Energy: 0.9585237494710652
Energy: 0.959479148535143
Energy: 0.9885061121859124
Energy: 0.9188131251693651
Energy: 0.9225424768518405
Energy: 0.9188131251702332
Energy: 0.9586803772774235
Energy: 0.958961241993258
Energy: 1.3156091075764074
Energy: 0.9589612419949943
Energy: 0.9177387254157846
Energy: 1.0654804075244015
Energy: 0.9694954949872969
Energy: 1.0654804073899227
Energy: 1.3152192281466395
Energy: 0.8997493019034465
Energy: 0.8616907397142213
Energy: 0.8997493019034465
Energy: 0.9702582848061119
Energy: 1.2880263253891826
Energy: 0.8895496678423092
Energy: 1.288026325390919
Energy: 0.9415476653590414
Energy: 1.004090720539818
Energy: 1.1006585440725611
Energy: 1.004090720539818
Energy: 0.9223418239408087
Energy: 1.137984949618258
Energy: 0.9468011275956775
Energy: 1.1379849496217305
Energy: 1.101433830791734
Energy: 1.048177096805152
Energy: 1.012041934504037
Energy: 1.0481770968060202
Energy: 0.9472871781153845
Energy: 1.043436808197148
Energy: 0.9357693180728561
Energy: 1.0434368081954117
Energy: 1.194889361403431
Energy: 1.0029135944912375
Energy: 0.9398711510507363
Energy: 1.0029135944912375
Energy: 0.9319858962683594
Energy: 1.0574507610115598
Energy: 0.9692332885450918
Energy: 1.0574507610115598
Energy: 0.8612732578869517
Energy: 0.8616821212510238
Energy: 1.199221563513956
Energy: 0.8616821212527601
Energy: 0.9230363107410999
Energy: 0.8619564556277346
Energy: 0.897604418754652
Energy: 0.8619564556277346
Energy: 1.4388674130845411
Energy: 0.9190226420043929
Energy: 0.9578273243368227
Energy: 0.919022642005261

minimum gb energy = 0.8506315822125011 eV
minimum distance =  2.29016650290055 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.3583458371720254
Energy: 0.8884498110105046
Energy: 1.0126477628401707
Energy: 1.0125158179468816
Energy: 1.048330008040869
Energy: 0.9844875885247095
Energy: 0.9723095724581096
Energy: 0.9844875885247095
Energy: 1.0122316495664168
Energy: 1.0128003448177012
Energy: 1.2302854198779098
Energy: 1.0128003448187104
Energy: 0.9657909673952402
Energy: 1.0867762900963567
Energy: 0.9727600857873504
Energy: 1.0867762900953475
Energy: 1.2322824701702837
Energy: 0.9047889132972076
Energy: 0.9048440188106025
Energy: 0.9047889132982166
Energy: 1.0271972574610928
Energy: 1.3028099558911022
Energy: 0.9361389478819331
Energy: 1.3028099558911022
Energy: 1.0156455061371477
Energy: 1.0705942462788287
Energy: 1.0146936232164754
Energy: 1.0705942462788287
Energy: 0.9724342351051884
Energy: 1.3360271521172844
Energy: 1.0034915528207906
Energy: 1.3360271521172844
Energy: 1.0154721739258157
Energy: 1.068860154405689
Energy: 1.1072147599928106
Energy: 1.0688601544046799
Energy: 1.0274927606532944
Energy: 1.168716850954075
Energy: 0.9903474609726874
Energy: 1.168716850954075
Energy: 1.3627861969894952
Energy: 0.9469710900796289
Energy: 0.9036150016165163
Energy: 0.9469710900796289
Energy: 0.9444743727732466
Energy: 1.0869204434245785
Energy: 0.9724052470781398
Energy: 1.0869204434245785
Energy: 1.011940868881097
Energy: 1.0122632570377006
Energy: 1.3605256153504854
Energy: 1.0122632570366914
Energy: 0.9725181529607374
Energy: 0.9661107225182141
Energy: 1.0472567321450672
Energy: 0.9661107225182141
Energy: 1.2310661964713707
Energy: 1.012487938773382
Energy: 1.013779105539183
Energy: 1.012487938773382
Energy: 1.07275047608861
Energy: 0.9853900778598065
Energy: 0.9656214570077946
Energy: 0.9853900778598065
Energy: 0.9050781852650782
Energy: 0.9049223348781993
Energy: 1.2327626531175733
Energy: 0.9049223348781993
Energy: 0.9359323495726128
Energy: 1.3032817189326582
Energy: 1.027596981871637
Energy: 1.3032817189326582
Energy: 1.0147711312163166
Energy: 1.1121457234267318
Energy: 1.0164676604456815
Energy: 1.1121457234267318
Energy: 1.004560686878771
Energy: 1.0709575136494123
Energy: 0.973973703148573
Energy: 1.0709575136504212
Energy: 1.1027754873553164
Energy: 1.067923597285009
Energy: 1.0146295177615363
Energy: 1.0679235972860182
Energy: 0.9874836874407003
Energy: 1.0831601496997887
Energy: 1.026579652806352
Energy: 1.0831601496997887
Energy: 0.9049780304346364
Energy: 0.9477306858549859
Energy: 1.3613459652574647
Energy: 0.9477306858549859
Energy: 0.9724974048190236
Energy: 0.9490598964245113
Energy: 0.9440336807903174
Energy: 0.9490598964245113
Energy: 1.358781437846636
Energy: 0.9649854743222545
Energy: 1.0124997281798969
Energy: 0.9649854743222545

minimum gb energy = 0.8884498110105046 eV
minimum distance =  2.29345674712205 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.2474170570349554
Energy: 0.9221145292347114
Energy: 1.0701205773234244
Energy: 1.0695990776299542
Energy: 1.111601783665416
Energy: 1.0253974045593723
Energy: 1.0247361113735673
Energy: 1.0253974045605763
Energy: 1.0700804054098105
Energy: 1.0696204521254902
Energy: 1.46878691218907
Energy: 1.0696204521254902
Energy: 1.0122759734364917
Energy: 1.1050710051595578
Energy: 1.0248862862309709
Energy: 1.1050710051595578
Energy: 1.1187136351727562
Energy: 0.9535261304273426
Energy: 0.9532023066079093
Energy: 0.9535261304116925
Energy: 1.0921631882509029
Energy: 1.2943863165431917
Energy: 0.9844787844542695
Energy: 1.2943863165431917
Energy: 0.9902133351651007
Energy: 1.175070594733644
Energy: 1.1210816738121656
Energy: 1.1750705947348477
Energy: 1.0527271552804
Energy: 1.2911224352490192
Energy: 1.0914817910674488
Energy: 1.291122435247815
Energy: 0.9516790380672238
Energy: 0.9532148766039811
Energy: 1.2509694781142677
Energy: 0.9532148766028045
Energy: 1.024546821424897
Energy: 1.1046389606453517
Energy: 0.9904532628020257
Energy: 1.1046389606465556
Energy: 1.2502456964090696
Energy: 1.0695166142834733
Energy: 1.0766233721454181
Energy: 1.0695166142834733
Energy: 1.1112645258098264
Energy: 1.0126191117871222
Energy: 1.0246994847060351
Energy: 1.0126191117871222
Energy: 1.070632260405812
Energy: 1.069770728145206
Energy: 1.469946188557368
Energy: 1.06977072814641
Energy: 1.0125588435928154
Energy: 1.0248716326155753
Energy: 1.148739105269754
Energy: 1.0248716326143714
Energy: 1.1188407591697287
Energy: 0.9534337909750309
Energy: 0.9529724110878829
Energy: 0.9534337909726232
Energy: 1.0916405283767427
Energy: 0.9980943063868377
Energy: 0.9520166359306526
Energy: 0.9980943063868377
Energy: 0.9900958248312873
Energy: 1.1763835364445263
Energy: 1.120507323659489
Energy: 1.1763835364445263
Energy: 0.9901496441786425
Energy: 1.1404309686510066
Energy: 1.0911474770013248
Energy: 1.1404309686510066
Energy: 0.9509931307685959
Energy: 0.9525305761746309
Energy: 1.2514707344229485
Energy: 0.9525305761698428
Energy: 1.0246596823443057
Energy: 0.9997711876631572
Energy: 0.990237104634227
Energy: 0.9997711876619533
Energy: 1.2475554583732764
Energy: 1.0121866174834062
Energy: 1.0700275475670344
Energy: 1.0121866174834062

minimum gb energy = 0.9221145292347114 eV
minimum distance =  2.29592907593339 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.0871566474691319
Energy: 0.9435654097017978
Energy: 1.1382034575079034
Energy: 1.1281089332394814
Energy: 1.183938275009312
Energy: 1.0167734929363113
Energy: 1.073467478367624
Energy: 1.0167734929363113
Energy: 1.1282558758064796
Energy: 1.1283646708685886
Energy: 1.3364932823851907
Energy: 1.1283646708685886
Energy: 1.060969245649032
Energy: 1.0177259339060118
Energy: 1.073637294779645
Energy: 1.0177259339060118
Energy: 1.0092134983296015
Energy: 1.132464206422921
Energy: 1.013661052495898
Energy: 1.132464206422921
Energy: 1.1884346118774134
Energy: 1.0534387765615474
Energy: 0.9621759769671455
Energy: 1.0534387765600588
Energy: 1.0896592141995058
Energy: 1.1060119756083766
Energy: 1.0114575281658795
Energy: 1.1060119756083766
Energy: 1.0749372775122663
Energy: 1.0916206630701524
Energy: 1.0735936424786736
Energy: 1.0916206630686636
Energy: 1.1376500176873698
Energy: 1.1792917379217034
Energy: 1.5932800285916389
Energy: 1.1792917379217034
Energy: 1.0735839811541381
Energy: 1.0178860084343107
Energy: 1.1841766877814488
Energy: 1.0178860084343107
Energy: 1.3376568566412015
Energy: 1.1283415010689
Energy: 1.1299248589242545
Energy: 1.1283415010674112
Energy: 1.1876058856050855
Energy: 1.0180285767290915
Energy: 1.1298106602836762
Energy: 1.0180285767276027
Energy: 1.0801376654781303
Energy: 1.107017928024122
Energy: 1.0096687772452142
Energy: 1.107017950715342
Energy: 1.0134683213223223
Energy: 1.1059335235393504
Energy: 1.1898494554663714
Energy: 1.1059335235393504
Energy: 1.010328938974157
Energy: 1.091042666413101
Energy: 1.1516486962233567
Energy: 1.091042666413101
Energy: 1.0736242088928085
Energy: 1.0917932899185823
Energy: 1.090835148154729
Energy: 1.0917932899185823
Energy: 1.1851268160871156
Energy: 1.1796371278923978
Energy: 1.1379856750261501
Energy: 1.1796371278923978

minimum gb energy = 0.9435654097017978 eV
minimum distance =  2.29547450401166 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.5222191300224994
Energy: 1.1769359625121365
Energy: 1.277540934504643
Energy: 1.2797113951327046
Energy: 1.121828415066787
Energy: 1.0165882496669394
Energy: 1.215263964362295
Energy: 1.0165882521970784
Energy: 1.0579166512886886
Energy: 1.0635707282592266
Energy: 1.380193309072839
Energy: 1.0635707282592266
Energy: 1.0146833476042265
Energy: 1.0834507350055402
Energy: 1.215859747327909
Energy: 1.0834507350063833
Energy: 1.1399730163458548
Energy: 1.248970368500466
Energy: 1.037460548496202
Energy: 1.2489703685013096
Energy: 1.2160356691621046
Energy: 1.1426292088789791
Energy: 1.0995917943921094
Energy: 1.1426292088789791
Energy: 1.2405142659326551
Energy: 1.0652799443663516
Energy: 1.065045675671663
Energy: 1.0652799443663516
Energy: 1.2681202647309224
Energy: 1.0647002872253446
Energy: 1.0634488962193425
Energy: 1.0647002872245015
Energy: 1.279423326820272
Energy: 1.2789518510225633
Energy: 1.3818657085445656
Energy: 1.2789518510234064
Energy: 1.2052809448272286
Energy: 1.1367324319223535
Energy: 1.2139903318340661
Energy: 1.1367324319215104
Energy: 1.1385156778769014
Energy: 1.1662286553595276
Energy: 1.0532742739864507
Energy: 1.1662286553502526
Energy: 1.2701587056354553
Energy: 1.134134088306986
Energy: 0.9967147888066836
Energy: 1.1341340883002404
Energy: 1.0761686758476476
Energy: 1.1338383171419542
Energy: 0.9957259957385821
Energy: 1.133838317141111
Energy: 1.237581074943877
Energy: 1.0406262930218477
Energy: 1.0536024189926312
Energy: 1.0406262930218477
Energy: 1.2739230657684149
Energy: 1.2672804486606584
Energy: 1.3138529677780475
Energy: 1.2672804486623448
Energy: 1.2804015794835393
Energy: 1.224185045564764
Energy: 1.5508031349503415
Energy: 1.2241850455630778
Energy: 1.4387054960757197
Energy: 1.0648091422355197
Energy: 1.0644038198810437
Energy: 1.064809142236363
Energy: 1.3685874457784328
Energy: 1.0645165830131558
Energy: 1.0574591347315283
Energy: 1.0645165830123124
Energy: 1.2138861796253264
Energy: 1.1219833901200753
Energy: 1.1392919918971534
Energy: 1.1219833900964662
Energy: 1.0370570913616828
Energy: 1.3218008637504801
Energy: 1.1266871933440992
Energy: 1.321800863749637
Energy: 1.015357554056947
Energy: 1.0173086462668828
Energy: 1.2689755210156561
Energy: 1.0173086462719418
Energy: 1.0633646534763395
Energy: 1.0708989185721474
Energy: 1.2357827693666712
Energy: 1.0708989185721474
Energy: 1.2146670686553518
Energy: 1.1500426427609582
Energy: 1.2315905588591172
Energy: 1.1500426427609582
Energy: 1.381138146553449
Energy: 1.2792364546712456
Energy: 1.2802646555078856
Energy: 1.2792364546712456
Energy: 0.9985072371864101
Energy: 1.1499551620559234
Energy: 1.1741076420776309
Energy: 1.1499551620356867
Energy: 0.9957656708172725
Energy: 0.996939893613566
Energy: 1.1403054652528266
Energy: 0.9969398936144094
Energy: 1.0330156734099492
Energy: 0.9959319523362489
Energy: 1.269800301019138
Energy: 0.9959319523362489
Energy: 0.9954060594004683
Energy: 0.9970432206737484
Energy: 1.2382917581297175
Energy: 0.9970432206762779
Energy: 1.0526285163519662
Energy: 1.014316964773747
Energy: 1.1728373996581603
Energy: 1.0143169647729038
Energy: 1.5232699988992924
Energy: 1.2801730903195907
Energy: 1.2748927804451475
Energy: 1.2801730903204338

minimum gb energy = 0.9954060594004683 eV
minimum distance =  2.28639321628831 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.3594578692481756
Energy: 0.916725774325057
Energy: 1.173003316905427
Energy: 1.172371132667703
Energy: 1.2945711504756723
Energy: 1.1435903759474126
Energy: 1.1190224696343538
Energy: 1.1435903759454717
Energy: 1.168140147858826
Energy: 1.4373521670198453
Energy: 1.1269646386545642
Energy: 1.4373521670198453
Energy: 1.099215296876093
Energy: 1.143747377918774
Energy: 1.1189388936198725
Energy: 1.1437473779110092
Energy: 1.132483645950364
Energy: 0.9729726953505581
Energy: 0.8966144960768733
Energy: 0.9729726953486169
Energy: 1.0965744303391707
Energy: 1.4589643424958807
Energy: 0.8968151565083192
Energy: 1.4589643424958807
Energy: 1.364079683931719
Energy: 1.1952933964822292
Energy: 1.171122683451146
Energy: 1.1952933964841705
Energy: 1.2908832418655798
Energy: 1.3844544627735675
Energy: 1.21459677987735
Energy: 1.3844544627755087
Energy: 1.1690236196088273
Energy: 1.4374562447470622
Energy: 1.128768768792946
Energy: 1.4374562447470622
Energy: 1.0970055818828393
Energy: 1.1444113885453986
Energy: 1.118628466435224
Energy: 1.1444113885473397
Energy: 1.1315056342682348
Energy: 1.1834367549034024
Energy: 0.8968758678646974
Energy: 1.1834367549034024
Energy: 1.1177851277082298
Energy: 1.1833691444336916
Energy: 0.8992672215038457
Energy: 1.1833691444336916
Energy: 1.2908288812793085
Energy: 1.143611525616487
Energy: 1.1935737492907326
Energy: 1.143611525616487

minimum gb energy = 0.8966144960768733 eV
minimum distance =  2.27173125498983 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.3169410614067592
Energy: 1.2859915651426268
Energy: 1.3809289120718642
Energy: 1.3803225488919728
Energy: 1.226993052584114
Energy: 1.2532796166651208
Energy: 1.410055728855695
Energy: 1.253279616665839
Energy: 1.0086352913358898
Energy: 1.0114235061649766
Energy: 1.2268038758012643
Energy: 1.0114235061664132
Energy: 1.011969300589783
Energy: 1.0399474001403601
Energy: 1.4027179974770907
Energy: 1.0399474001389233
Energy: 1.0103773143441195
Energy: 1.0084915291815824
Energy: 1.3759067360750261
Energy: 1.0084915291808638
Energy: 1.112961237392257
Energy: 1.2523139830114298
Energy: 1.3749943412588863
Energy: 1.2523139830092744
Energy: 1.4948276627083816
Energy: 1.339143684016707
Energy: 1.38169760424005
Energy: 1.339143684018144
Energy: 1.4942934412040036
Energy: 1.3041375226515013
Energy: 1.3477953166288439
Energy: 1.3041375226500642
Energy: 1.097865510118264
Energy: 1.3495844237781884
Energy: 1.056578314639978
Energy: 1.3495844237781884
Energy: 0.9767786922821675
Energy: 1.0579250269980562
Energy: 1.288190167532606
Energy: 1.0579785861977886
Energy: 1.1369305052814473
Energy: 1.138597056386462
Energy: 1.3576996763811102
Energy: 1.138597056386462
Energy: 1.1641984383462636
Energy: 1.219842527314898
Energy: 1.3215926981626658
Energy: 1.2198425273163351
Energy: 1.495537323453562
Energy: 1.1328832707481582
Energy: 1.2893942261937887
Energy: 1.1328832707481582
Energy: 1.4800799713519002
Energy: 1.138045618976801
Energy: 1.1621691155338574
Energy: 1.138045618976801
Energy: 1.286871911174588
Energy: 1.1515659689902482
Energy: 1.0604598013897144
Energy: 1.1515659689909667
Energy: 1.1356799010538479
Energy: 1.335381893457501
Energy: 1.093940872952419
Energy: 1.335381893457501
Energy: 1.2990993451716613
Energy: 1.2933615095131916
Energy: 1.193758242003758
Energy: 1.2933615095268423
Energy: 1.3797284959760503
Energy: 1.3794935621230442
Energy: 1.3177148054307695
Energy: 1.3794935621223257
Energy: 1.3678713675587655
Energy: 1.3054545050213835
Energy: 1.2198041140893738
Energy: 1.3054545050221016
Energy: 1.226348788414492
Energy: 1.0109148024972383
Energy: 1.0085837344730098
Energy: 1.0109148025302874
Energy: 1.4028881514782168
Energy: 1.0087188206379163
Energy: 1.0117940928053748
Energy: 1.0087188206680264
Energy: 1.3775845405484461
Energy: 1.0083619124591596
Energy: 1.008282026440763
Energy: 1.008361912458441
Energy: 1.3761935040109765
Energy: 1.2514307452142137
Energy: 1.008793097605697
Energy: 1.2514307452149325
Energy: 1.3781157366412609
Energy: 1.31828470832126
Energy: 1.4974848148485544
Energy: 1.3182847083219786
Energy: 1.3492232491248652
Energy: 1.3038722502992082
Energy: 1.500939592717113
Energy: 1.3038722503042373
Energy: 1.0585634917399962
Energy: 1.3522604874465873
Energy: 1.1094367804621006
Energy: 1.3522604874465873
Energy: 1.2869780995584337
Energy: 1.122972920967639
Energy: 0.9766853939375739
Energy: 1.1229729209697943
Energy: 1.4740627347456454
Energy: 1.1327014096861925
Energy: 1.1377591817514294
Energy: 1.1327014096847554
Energy: 1.3191778382844352
Energy: 1.229928492339993
Energy: 1.1649270213840859
Energy: 1.229928492339993
Energy: 1.2683778535387293
Energy: 1.132036655689473
Energy: 1.4119557614934504
Energy: 1.132036655689473
Energy: 1.1623470490530112
Energy: 1.139014492898396
Energy: 1.2290047669934645
Energy: 1.139014492898396
Energy: 1.1062744401630045
Energy: 1.1250474298565565
Energy: 1.287621327696948
Energy: 1.1250474298565565
Energy: 1.0619982039069265
Energy: 1.1710974409385722
Energy: 1.1384119897546157
Energy: 1.1710974409385722
Energy: 1.1862660301298547
Energy: 1.3417765709207525
Energy: 1.2170301835169248
Energy: 1.341776570920034
Energy: 1.3198233527672303
Energy: 1.3800375855808182
Energy: 1.3794386693627902
Energy: 1.3800375855808182

minimum gb energy = 0.9766853939375739 eV
minimum distance =  2.2833110499137 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.3815479517091882
Energy: 1.2055043119964572
Energy: 1.2954428883486102
Energy: 1.2951593660427052
Energy: 1.3796012015983115
Energy: 1.3392947016069703
Energy: 1.455508895449334
Energy: 1.3392947016069703
Energy: 1.043186243629333
Energy: 1.2473504243616735
Energy: 1.1820379607962834
Energy: 1.2473504243628135
Energy: 1.0736266586907866
Energy: 1.0817145000593817
Energy: 1.4205728606441885
Energy: 1.0817145000593817
Energy: 1.0703531060638651
Energy: 1.051339774164777
Energy: 1.423492626117319
Energy: 1.0513397741636372
Energy: 1.142695678301236
Energy: 1.2552170213373668
Energy: 1.4155074611918508
Energy: 1.2552170213373668
Energy: 1.6637444705552664
Energy: 1.479887046062174
Energy: 1.3505077678238366
Energy: 1.479887046062174
Energy: 1.599625166002235
Energy: 1.2418319380660858
Energy: 1.308204748568411
Energy: 1.2418319380660858
Energy: 1.175496061770931
Energy: 1.2977229168388673
Energy: 1.204405487188075
Energy: 1.2977229168388673
Energy: 1.0462044788597415
Energy: 1.216442238223715
Energy: 1.2842641683454676
Energy: 1.216442238223715
Energy: 1.1873504541936746
Energy: 1.0730830947421617
Energy: 1.2849239913017494
Energy: 1.0730830947421617
Energy: 1.1434134683653598
Energy: 1.0748870546664273
Energy: 1.2495979307871476
Energy: 1.0748870546675673
Energy: 1.2273697427436718
Energy: 1.1742384220178057
Energy: 1.1643411928849121
Energy: 1.1742384220189197
Energy: 1.1819057480351152
Energy: 1.2301222842201602
Energy: 1.1157055591423761
Energy: 1.2301222842201602
Energy: 1.2831722767284108
Energy: 1.2032953380915044
Energy: 1.0756414634522606
Energy: 1.2032953380915044
Energy: 1.389600444910212
Energy: 1.3144468988533253
Energy: 1.1115900540094161
Energy: 1.314446898854465
Energy: 1.3703096956088372
Energy: 1.213642177589337
Energy: 1.1577275693303002
Energy: 1.213642177589337
Energy: 1.3165619097082366
Energy: 1.3536892703920969
Energy: 1.6601470920110493
Energy: 1.3536892703920969
Energy: 1.224581267486847
Energy: 1.2109099135181196
Energy: 1.4744534561940583
Energy: 1.2109099135181196
Energy: 1.1286990723677512
Energy: 1.2213799835468817
Energy: 1.1638850128691471
Energy: 1.2213799835468817
Energy: 1.1720934714957036
Energy: 1.2137843128058095
Energy: 1.0469081542266614
Energy: 1.2137843128069494
Energy: 1.3827218065459566
Energy: 1.2456996522401362
Energy: 1.2790301154821249
Energy: 1.245699652241276

minimum gb energy = 1.043186243629333 eV
minimum distance =  2.27565180632834 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.5760053261878149
Energy: 1.198511373707358
Energy: 1.3717946545834039
Energy: 1.3375449471740017
Energy: 1.331705923899871
Energy: 1.1924598823139585
Energy: 1.3921289100689551
Energy: 1.1924598823115402
Energy: 1.0261860128512834
Energy: 1.2294334275917385
Energy: 1.0951303995096069
Energy: 1.2294334275917385
Energy: 1.0487868657923645
Energy: 1.0906721632366536
Energy: 1.3652628909738367
Energy: 1.0906721632366536
Energy: 1.1103654483174827
Energy: 1.1088046916320276
Energy: 1.1949512048516662
Energy: 1.1088046916336396
Energy: 1.2800589917004692
Energy: 1.2025194966755544
Energy: 1.1895183742981705
Energy: 1.2025194966747486
Energy: 1.3887865340322523
Energy: 1.3373494876955454
Energy: 1.161428603570499
Energy: 1.3373494876955454
Energy: 1.3612282183176185
Energy: 1.0979124300633185
Energy: 1.1355466226568913
Energy: 1.0979124300649303
Energy: 1.350532649467854
Energy: 1.025793663550425
Energy: 1.0255006857393447
Energy: 1.025793663549619
Energy: 1.1909641905854105
Energy: 1.2301992350267688
Energy: 1.0262531861033881
Energy: 1.2301992350259627
Energy: 1.4686096904314185
Energy: 1.208534179608337
Energy: 1.2633688690027147
Energy: 1.2085341796099491
Energy: 1.3461844797009055
Energy: 1.2791915207694373
Energy: 1.3839797644186833
Energy: 1.2791915207710494
Energy: 1.134625695776636
Energy: 1.1216799425165154
Energy: 1.2544838902245021
Energy: 1.1216799425157096
Energy: 1.0984199346045118
Energy: 1.0599679555389663
Energy: 1.0016894232885512
Energy: 1.0599679555413843
Energy: 1.2280431937073015
Energy: 1.2362746938000668
Energy: 1.0003929539711685
Energy: 1.2362746938016786
Energy: 1.5791856268313602
Energy: 1.2782002175996323
Energy: 1.3469285903011932
Energy: 1.2782002176012444
Energy: 1.4954001395739174
Energy: 1.194222291353172
Energy: 1.4731622444871997
Energy: 1.19422229135156
Energy: 1.0262533947767443
Energy: 1.3931123026035486
Energy: 1.0936461954864893
Energy: 1.3931123026027428
Energy: 1.0237003683942878
Energy: 1.0256964702326576
Energy: 1.3509144540571565
Energy: 1.0256964702318516
Energy: 1.1079460748261536
Energy: 1.1079832735915724
Energy: 1.4442744473108418
Energy: 1.1079832735923785
Energy: 1.1244820222632765
Energy: 1.3371278204301416
Energy: 1.1935850182608898
Energy: 1.3371278204293355
Energy: 1.3941950575167994
Energy: 1.0981009460411728
Energy: 1.2819286851712948
Energy: 1.0981009460403666
Energy: 1.393883421451714
Energy: 1.1089029431513506
Energy: 1.1315932021781443
Energy: 1.1089029431537687
Energy: 1.3505070130026706
Energy: 1.0904074730770275
Energy: 1.0280750300432888
Energy: 1.0904074730778335
Energy: 1.1927657654547952
Energy: 1.2289805780190477
Energy: 1.0260605460779157
Energy: 1.2289805780182415
Energy: 1.2616401803430204
Energy: 1.1929266589497016
Energy: 1.390211140381504
Energy: 1.1929266590334913
Energy: 1.3683115799324967
Energy: 1.3288562204468317
Energy: 1.3807650198184203
Energy: 1.3288562204653702
Energy: 1.20323920154899
Energy: 1.1933817306644074
Energy: 1.2535758185214585
Energy: 1.1933817306644074
Energy: 1.0959897775745557
Energy: 1.1870740865833471
Energy: 1.1337888279256652
Energy: 1.1870740865841531
Energy: 1.187505841011067
Energy: 1.1642172682925596
Energy: 1.0014356197138938
Energy: 1.16421726830062
Energy: 1.5313570637048903
Energy: 1.209739611358927
Energy: 1.2787267076220419
Energy: 1.209739611358927

minimum gb energy = 1.0003929539711685 eV
minimum distance =  2.24873913253936 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9049500759557052
Energy: 0.9065328899523302
Energy: 1.173350339192148
Energy: 1.2386808413496044
Energy: 0.9088480852440666
Energy: 1.0165815476906326
Energy: 1.132166031287744
Energy: 1.0165815476898215
Energy: 1.3359821715377629
Energy: 1.2406201715687784
Energy: 1.09101804676443
Energy: 1.2406201715690592
Energy: 1.0990029274649358
Energy: 0.9247765137953976
Energy: 1.131793729489321
Energy: 0.9247765137951167
Energy: 1.0999266267351553
Energy: 1.0982704169416808
Energy: 0.908974623370534
Energy: 1.0982704169419615
Energy: 1.1316883777058948
Energy: 1.1781507456899016
Energy: 0.9089135968927523
Energy: 1.1781507456896523
Energy: 0.911743227763698
Energy: 0.9901623572135855
Energy: 1.336818140406551
Energy: 0.990162357213336
Energy: 1.13159042018442
Energy: 0.925991909024533
Energy: 0.9385793587253974
Energy: 0.925991909024533
Energy: 0.9089352492173677
Energy: 0.9285717645849242
Energy: 1.0946796799684904
Energy: 0.9285717645846746

minimum gb energy = 0.9049500759557052 eV
minimum distance =  2.32208117281028 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.2224649770555887
Energy: 0.9272548952484703
Energy: 1.2495705431786808
Energy: 1.207208744730351
Energy: 1.3012635099697853
Energy: 0.9357069749502518
Energy: 1.102655774102833
Energy: 0.9357069749502518
Energy: 1.1035995569537773
Energy: 1.0045253170495836
Energy: 1.0887483922449248
Energy: 1.0045253170495836
Energy: 0.9462428190274617
Energy: 0.9339127589078954
Energy: 1.266909393980608
Energy: 0.9339127589078954
Energy: 1.1223943065526114
Energy: 0.9736196520399875
Energy: 1.4023504014697068
Energy: 0.9736196520377033
Energy: 0.9766935081681475
Energy: 0.9792721427993611
Energy: 1.349483805710132
Energy: 0.9792721428000879
Energy: 0.933332141092468
Energy: 0.9343306661149301
Energy: 1.273746856112445
Energy: 0.9343306661156914
Energy: 0.9809286458557119
Energy: 0.9364623509560452
Energy: 1.227909049663229
Energy: 0.9364623509575679
Energy: 1.2743408844175963
Energy: 0.9826471192336869
Energy: 1.2804654656953331
Energy: 0.982647119235971
Energy: 1.0826625142791286
Energy: 0.9240806232196698
Energy: 1.1429643072126128
Energy: 0.9240806232196698
Energy: 1.2588726882899182
Energy: 0.922999603078917
Energy: 0.9242397829779447
Energy: 0.9229996030796783
Energy: 1.2437531757106062
Energy: 0.9631682234054527
Energy: 0.968264024129696
Energy: 0.963168223404726
Energy: 1.263037455334475
Energy: 1.1870402192123284
Energy: 1.1090816446841114
Energy: 1.1870402192123284
Energy: 1.2532581313627777
Energy: 1.1852128550703227
Energy: 1.0977981558184924
Energy: 1.1852128550695613
Energy: 0.939555105338094
Energy: 0.9354834043350142
Energy: 1.1007418103071371
Energy: 0.9354834043357756
Energy: 0.9380919004885864
Energy: 0.9349598312642221
Energy: 1.3007710840616056
Energy: 0.9349598312634607
Energy: 1.2428200340011446
Energy: 1.2065022481689982
Energy: 1.5999633389581454
Energy: 1.206502248166714
Energy: 1.1375982703045713
Energy: 0.9368558583441872
Energy: 1.3046911205829892
Energy: 0.9368558583441872
Energy: 1.0868883965541645
Energy: 1.0066002991921221
Energy: 1.1393609448834432
Energy: 1.0066002991928835
Energy: 1.1026121462735126
Energy: 0.9337448046016351
Energy: 0.9437449252912465
Energy: 0.9337448046449996
Energy: 1.3501956606168872
Energy: 0.9792335891806834
Energy: 1.1219994006867757
Energy: 0.9792335891814447
Energy: 1.4253065069087325
Energy: 0.99578738417704
Energy: 1.1108725735640161
Energy: 0.9957873841778014
Energy: 1.2754422414732942
Energy: 0.9346183207217869
Energy: 0.9346667401323924
Energy: 0.9346183207217869
Energy: 1.2466543314579621
Energy: 0.9351856870892755
Energy: 0.9398167308411441
Energy: 0.9351856870900369
Energy: 1.2460394696615191
Energy: 0.9816774757311237
Energy: 1.2750966057152775
Energy: 0.9816774757311237
Energy: 1.1450797463628815
Energy: 0.9252125007903964
Energy: 1.0824975261460186
Energy: 0.9252125007903964
Energy: 0.9253334746507969
Energy: 0.9604556621321879
Energy: 1.2585543507943466
Energy: 0.9604556621329492
Energy: 0.965012722284803
Energy: 0.9621234228142245
Energy: 1.2165498418320344
Energy: 0.9621234228142245
Energy: 1.1086230851133279
Energy: 0.9231177085107292
Energy: 1.2258293084197078
Energy: 0.9231177085076835
Energy: 1.0988678080225058
Energy: 1.1855104570437385
Energy: 1.2186190276417574
Energy: 1.1855104570437385
Energy: 1.0974467855199932
Energy: 0.9364831526308953
Energy: 0.9363145576497002
Energy: 0.9364831526308953
Energy: 1.261600338252047
Energy: 0.9339968276700505
Energy: 0.9357723194291376
Energy: 0.9339968276700505
Energy: 1.6022991889006821
Energy: 0.9343418052421563
Energy: 1.1006910412332298
Energy: 0.9343418052444405

minimum gb energy = 0.922999603078917 eV
minimum distance =  2.2909312503636 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.4245421814871568
Energy: 0.9373398954586942
Energy: 1.013512010951158
Energy: 0.9447682464028356
Energy: 1.2576679407519002
Energy: 0.9082915799099018
Energy: 1.1254894424338127
Energy: 0.9082915799109545
Energy: 1.117087971098643
Energy: 1.0005062784674783
Energy: 1.1241704458248643
Energy: 1.0005062784685312
Energy: 1.005177060012871
Energy: 1.12047490058055
Energy: 1.1775868384134653
Energy: 1.1204749005816028
Energy: 1.1690543894551757
Energy: 0.9862211075773278
Energy: 1.4666711844135198
Energy: 0.9862211075773278
Energy: 0.9848308618950271
Energy: 0.9391978177550286
Energy: 1.4670756844812474
Energy: 0.9391978177539759
Energy: 0.9099944764525654
Energy: 0.9106314493913882
Energy: 1.375930484142826
Energy: 0.9106314493913882
Energy: 0.9222207577745734
Energy: 0.9140434480737014
Energy: 1.4304963997265987
Energy: 0.9140434480737014
Energy: 1.165767430082621
Energy: 0.977099536114345
Energy: 1.3700512956688817
Energy: 0.9770995361132921
Energy: 1.198657022554377
Energy: 1.0854176465998557
Energy: 0.9875900310710861
Energy: 1.0854176465998557
Energy: 1.1722606071547215
Energy: 0.8884525043765731
Energy: 0.987263652236375
Energy: 0.8884525043776258
Energy: 1.304172221734945
Energy: 0.8822643636122192
Energy: 0.9886765056508274
Energy: 0.8822643636122192
Energy: 1.299351307635162
Energy: 0.8903826067591493
Energy: 1.016306949333047
Energy: 0.8903826067591493
Energy: 1.229963241414551
Energy: 0.8775330921698042
Energy: 1.2024146886927307
Energy: 0.8775330921698042
Energy: 1.0088108799508946
Energy: 1.0965476855888834
Energy: 1.200408389253903
Energy: 1.0965476855888834
Energy: 1.0197140502242958
Energy: 0.9118788091945026
Energy: 1.408888702385769
Energy: 0.9118788091934498
Energy: 1.3986565345496047
Energy: 0.9925532120765411
Energy: 1.6891822817153093
Energy: 0.9925532120744356
Energy: 0.9775185361246455
Energy: 0.9138601517487326
Energy: 1.4690288433404932
Energy: 0.91386015174768
Energy: 0.9371069416725304
Energy: 0.9125306727484316
Energy: 1.3697256085284157
Energy: 0.9125306727484316
Energy: 1.099669589985473
Energy: 0.9121546114938955
Energy: 1.4299725766194118
Energy: 0.9121546114938955
Energy: 1.2167725940261
Energy: 0.9787545771404448
Energy: 1.3807373033340353
Energy: 0.9787545771393921
Energy: 1.2363320380621459
Energy: 0.9071959068061132
Energy: 0.9075000342370251
Energy: 0.9071959068071659
Energy: 1.2877607228755215
Energy: 0.9061568350145219
Energy: 0.9063396399650961
Energy: 0.9061568350176801
Energy: 1.427919688127979
Energy: 0.9424806966365364
Energy: 0.9440595440883368
Energy: 0.9424806966239035

minimum gb energy = 0.8775330921698042 eV
minimum distance =  2.2847363847681 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.3775804657345165
Energy: 0.8840756679336114
Energy: 1.214573982707018
Energy: 0.9303120204091705
Energy: 1.4444008045808028
Energy: 0.8867251328481068
Energy: 1.031314169826749
Energy: 0.8867251328468054
Energy: 1.15782786141528
Energy: 0.8851505161877031
Energy: 1.0329841912964375
Energy: 0.8851505161864017
Energy: 1.1312782283102796
Energy: 0.8760168607239583
Energy: 1.1180671365429786
Energy: 0.876016860724609
Energy: 1.0283572532826146
Energy: 0.876492167889643
Energy: 1.2727417428028491
Energy: 0.8764921678902937
Energy: 0.89821342768557
Energy: 0.8946459625275344
Energy: 1.4213801109227524
Energy: 0.8946459625281851
Energy: 0.8767345837743831
Energy: 0.8756283508963135
Energy: 1.2846486558516543
Energy: 0.8756283508963135
Energy: 0.8847657176671972
Energy: 0.8780538693247872
Energy: 1.381039213596482
Energy: 0.8780538693254379
Energy: 1.2496463263708544
Energy: 0.8782768624935374
Energy: 1.2896756860647536
Energy: 0.8782768624948387
Energy: 1.0098712596320152
Energy: 0.8890947673512265
Energy: 1.0365592148262415
Energy: 0.8890947673512265
Energy: 1.3251999204748448
Energy: 0.9389534129046786
Energy: 0.8915356744656566
Energy: 0.9389534121222656
Energy: 1.4316796329737118
Energy: 0.9068583934290941
Energy: 1.067613526361899
Energy: 0.9068583934290941
Energy: 1.5508665044961387
Energy: 0.9260735755183253
Energy: 0.9491657870553657
Energy: 0.9260735755202772
Energy: 1.3460887965001662
Energy: 0.885377615458036
Energy: 0.8871608261181324
Energy: 0.885377615458036
Energy: 1.1657967391598336
Energy: 0.8877683144604385
Energy: 0.8901151423887976
Energy: 0.8877683144610891
Energy: 1.3552268367161855
Energy: 0.9266070459396069
Energy: 1.2919771969708347
Energy: 0.9266070459396069
Energy: 0.8876478472551542
Energy: 0.8901311043640514
Energy: 1.2542120285580978
Energy: 0.8901311043634007
Energy: 0.8886223676667405
Energy: 0.8863476034945321
Energy: 1.3223338961087798
Energy: 0.8863476034938814
Energy: 0.8947268445531406
Energy: 0.8885061767196669
Energy: 1.4769357298575705
Energy: 0.8885061767151122
Energy: 0.9604086903913036
Energy: 0.9370886903100015
Energy: 1.37818638372339
Energy: 0.9370886903087002
Energy: 1.0300965923867509
Energy: 0.8872560119134275
Energy: 1.4293573819136245
Energy: 0.8872560119140781
Energy: 1.028526364796829
Energy: 1.1275294831899403
Energy: 1.155982044470649
Energy: 1.1275294831892895
Energy: 1.1764386618304095
Energy: 0.8756300996480624
Energy: 1.1550871878601885
Energy: 0.8756300996480624
Energy: 1.2713963019140422
Energy: 0.8769953735806877
Energy: 1.025934249447092
Energy: 0.876995373580037
Energy: 1.4176878989341315
Energy: 0.8798076350275674
Energy: 0.8950380434815649
Energy: 0.8798076350282181
Energy: 1.2870330917632948
Energy: 0.8772559465297103
Energy: 0.8791625683325806
Energy: 0.8772559465290596
Energy: 1.3796133827626749
Energy: 0.8784894802228244
Energy: 0.8837830080053553
Energy: 0.878489480221523
Energy: 1.2856760917024326
Energy: 0.8776225721312908
Energy: 1.2492461647349868
Energy: 0.8776225721332428
Energy: 1.0331274153905088
Energy: 1.1266042274035815
Energy: 1.0120940985303033
Energy: 1.1266042274055332
Energy: 0.892865914643648
Energy: 0.8848757170431036
Energy: 1.327891880216271
Energy: 0.8848757170411515
Energy: 1.069284566146749
Energy: 0.9246882285307484
Energy: 1.5086012967093405
Energy: 0.9246882285320498
Energy: 0.9513823027322649
Energy: 0.9255773790998993
Energy: 1.4811668760633339
Energy: 0.9255773791012006
Energy: 0.885140681567903
Energy: 0.884971066353833
Energy: 1.321793617502107
Energy: 0.884971066353833
Energy: 0.8934767873138053
Energy: 0.8872067396487455
Energy: 1.1318864058655278
Energy: 0.8872067396487455
Energy: 1.2923636666429503
Energy: 0.925435638298591
Energy: 1.3531196910825434
Energy: 0.925435638298591
Energy: 1.2536394757763873
Energy: 0.889223801745112
Energy: 0.8864959492561664
Energy: 0.889223801745112
Energy: 1.3212640255787342
Energy: 0.885246893916168
Energy: 0.8858037126638237
Energy: 0.885246893916168
Energy: 1.479243166671283
Energy: 0.8892927091572007
Energy: 0.9329648420009952
Energy: 0.8892927091578514

minimum gb energy = 0.8756283508963135 eV
minimum distance =  2.29309590523987 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.4478403390951164
Energy: 0.8400867686934234
Energy: 0.8112956349424961
Energy: 0.8099448965706258
Energy: 1.3461456235272664
Energy: 1.1566806506849883
Energy: 1.080188469585958
Energy: 1.1566806506832858
Energy: 0.8008914767202879
Energy: 0.8928811638679962
Energy: 1.087260147014202
Energy: 0.8928811638679962
Energy: 0.8016646812170183
Energy: 1.084039463355142
Energy: 1.0893181328623553
Energy: 1.084039463355142
Energy: 0.8657000319355747
Energy: 0.8082363408146364
Energy: 1.1208440532993411
Energy: 0.8082363408163388
Energy: 0.8101976224485671
Energy: 0.8086709237844256
Energy: 1.1235881949434772
Energy: 0.8086709237503754
Energy: 0.8060164548465375
Energy: 0.8065264865185264
Energy: 1.0895191166756932
Energy: 0.8065264865168239
Energy: 0.8101915143264525
Energy: 0.8107573401993093
Energy: 1.4507732527601256
Energy: 0.8107573401993093
Energy: 1.0786274667998943
Energy: 1.158300672913698
Energy: 1.3481002581177575
Energy: 1.158300672913698
Energy: 1.1338535820085358
Energy: 0.8946322822725512
Energy: 1.0898723106161112
Energy: 0.8946322822725512
Energy: 1.0893518102574178
Energy: 0.8965877635829949
Energy: 0.7994204074281219
Energy: 0.8965877635829949
Energy: 1.124422707002114
Energy: 1.0859361093140756
Energy: 0.8687905429203819
Energy: 1.0859361093140756
Energy: 1.1240017937159243
Energy: 0.8090868741772357
Energy: 0.810389749226914
Energy: 0.8090868741772357
Energy: 1.3525988370123294
Energy: 0.8064739349735234
Energy: 0.8049735755293563
Energy: 0.8064739349735234
Energy: 1.3458585621997137
Energy: 0.8087837954325986
Energy: 0.8093684328222273
Energy: 0.8087837954325986

minimum gb energy = 0.7994204074281219 eV
minimum distance =  2.31748475669914 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.2816958853932827
Energy: 0.7863884428081056
Energy: 1.132474120915664
Energy: 0.7761617138485677
Energy: 1.3930688426088709
Energy: 0.7728635257757364
Energy: 0.9258897637721124
Energy: 0.7728635257757364
Energy: 1.2830594484385487
Energy: 0.7715946794255703
Energy: 0.9199366783014811
Energy: 0.7715946808706474
Energy: 1.0121735262841582
Energy: 0.8335947734177852
Energy: 1.1037781329022844
Energy: 0.8335947734177852
Energy: 1.1828462583388533
Energy: 0.8313880650234654
Energy: 1.1805860104709176
Energy: 0.8313880650263199
Energy: 0.9237858756870372
Energy: 1.0512404843379248
Energy: 1.174633699028974
Energy: 1.0512404843379248
Energy: 0.9232393205847036
Energy: 0.7739919252723797
Energy: 1.4210590888118417
Energy: 0.7739919252730934
Energy: 0.9353157254070066
Energy: 0.9255206963682656
Energy: 1.4426892298099152
Energy: 0.9255206971934956
Energy: 0.7822108005531394
Energy: 0.775547270489238
Energy: 1.4145257079331708
Energy: 0.7755472704863836
Energy: 0.7746989103167877
Energy: 0.7728398533227927
Energy: 1.4135290355409678
Energy: 0.77283985332422
Energy: 0.7724860817520799
Energy: 0.7788088393185558
Energy: 1.2822106771627355
Energy: 0.7788088393206966
Energy: 1.1744998823561568
Energy: 1.086215966396339
Energy: 1.4140347602409793
Energy: 1.0862159663956257
Energy: 1.177633225540701
Energy: 1.049588418237348
Energy: 1.1692188977215716
Energy: 1.0495884182366344
Energy: 1.2398385629331985
Energy: 0.7718594420600742
Energy: 1.013362251106311
Energy: 0.7718594420607876
Energy: 1.3823120900170338
Energy: 0.7742842073887775
Energy: 1.1520370270648324
Energy: 0.7742842073909183
Energy: 1.3805168753115908
Energy: 0.774892716619854
Energy: 0.7823002063168336
Energy: 0.7748927166177132
Energy: 1.318126977500012
Energy: 0.7734945418304083
Energy: 0.7750744473281388
Energy: 0.7734945418318355
Energy: 1.283302571838067
Energy: 0.7966987092397897
Energy: 0.7924063803523722
Energy: 0.796698709239076
Energy: 1.4346560360594651
Energy: 0.7745231676271186
Energy: 0.9434740432242632
Energy: 0.7745231676242642
Energy: 1.3600647640895227
Energy: 0.7714077741618235
Energy: 0.8940140344507848
Energy: 0.7714077741611101
Energy: 1.0102495578441366
Energy: 0.7775632105651393
Energy: 0.937577465913583
Energy: 0.7775632105679936
Energy: 1.2681505226781022
Energy: 1.1001455172735386
Energy: 1.1730010972461271
Energy: 1.1001455172749657
Energy: 0.9258168859061745
Energy: 1.0509838006331227
Energy: 1.1807022947483108
Energy: 1.0509838006338363
Energy: 0.7742144734897147
Energy: 0.7717401685615375
Energy: 1.4170001683790496
Energy: 0.7717401685615375
Energy: 0.9280309174383742
Energy: 0.794432060880633
Energy: 1.3828275055881958
Energy: 0.7944320608792059
Energy: 0.7722850082607765
Energy: 0.7935673751999154
Energy: 1.379361557992439
Energy: 0.7935673752027698
Energy: 0.7724181337723213
Energy: 0.7725753933442436
Energy: 1.4104604506577474
Energy: 0.7725753933449572
Energy: 0.772269918840655
Energy: 0.7763077849389483
Energy: 1.2845748170533262
Energy: 0.7763077849375211
Energy: 1.1686672188193534
Energy: 1.08644148088705
Energy: 1.4347305090447033
Energy: 1.0864414808856226
Energy: 0.8928677123636922
Energy: 1.0496975279858798
Energy: 1.1713401837633837
Energy: 1.0496975279880207
Energy: 1.2331231396464246
Energy: 0.8304554910179609
Energy: 1.0113078027768163
Energy: 0.8304554910215288
Energy: 1.3796020817208214
Energy: 0.7745830469604084
Energy: 1.1720675413229662
Energy: 0.7745830469554132
Energy: 1.3825324432048776
Energy: 0.7744446408722513
Energy: 0.7724932185204837
Energy: 0.7744446408736785
Energy: 1.4114708585067441
Energy: 0.7718842274224147
Energy: 0.7726286397726796
Energy: 0.7718842274231282
Energy: 1.4758980050539316
Energy: 0.773217290113149
Energy: 0.792685909176079
Energy: 0.7732172901102946

minimum gb energy = 0.7714077741611101 eV
minimum distance =  2.30655965791339 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.251520190148955
Energy: 0.7641717173294014
Energy: 0.7357953419275283
Energy: 0.7357900221482404
Energy: 1.5241133795689454
Energy: 0.7226418131512239
Energy: 0.9553441163203996
Energy: 0.7226418131512239
Energy: 1.2397838047411869
Energy: 1.0234482551754789
Energy: 0.9589671765485671
Energy: 1.0234482551754789
Energy: 1.2577684710902262
Energy: 0.8137037765299137
Energy: 1.127561368681383
Energy: 0.8137037765299137
Energy: 1.1772855407435463
Energy: 0.813253879851553
Energy: 1.0129484424757111
Energy: 0.8132538798503253
Energy: 0.9356494198172225
Energy: 0.9332838908576125
Energy: 1.1868138569428164
Energy: 0.9332838908576125
Energy: 0.8104936191785009
Energy: 0.9320530903237376
Energy: 1.3700814074682552
Energy: 0.9320530903237376
Energy: 0.9789097957586457
Energy: 0.7163882910933853
Energy: 1.5287504099306395
Energy: 0.7163882910933853
Energy: 0.810568438631453
Energy: 0.7175405337191312
Energy: 1.3756534205027657
Energy: 0.7175405337179035
Energy: 0.816956910533108
Energy: 0.7010658005075325
Energy: 1.442492968935295
Energy: 0.7010658005075325
Energy: 0.888998813912259
Energy: 0.8901012368285226
Energy: 1.1154493315934235
Energy: 0.8901012368272948
Energy: 1.0435365166489017
Energy: 0.7009227823683969
Energy: 1.442661848752492
Energy: 0.7009227823683969
Energy: 1.0515119521486667
Energy: 1.0176908071995527
Energy: 1.2393923361251222
Energy: 1.0176908071995527
Energy: 1.223419542793373
Energy: 0.8076770434342918
Energy: 1.2581892891227315
Energy: 0.8076770434342918
Energy: 1.0129484424744835
Energy: 0.9635220535248487
Energy: 1.2269740145274248
Energy: 0.9635220535236209
Energy: 1.1868138569428164
Energy: 0.9679077753986474
Energy: 0.9497701145679044
Energy: 0.9679077753986474
Energy: 1.304159856117553
Energy: 0.7225107257441595
Energy: 0.8056589931458065
Energy: 0.722510725742932
Energy: 1.5287504099306395
Energy: 0.7234152433687635
Energy: 0.8981472681219107
Energy: 0.7234152433687635
Energy: 1.3756534205027657
Energy: 0.7257366622420769
Energy: 0.7235945733895667
Energy: 0.7257366622420769
Energy: 1.5201313566564545
Energy: 0.7240295169912059
Energy: 0.7233071508725851
Energy: 0.7240295169899782

minimum gb energy = 0.7009227823683969 eV
minimum distance =  2.2973550637797 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.4415573249739546
Energy: 0.6755928228317539
Energy: 0.6464645334875563
Energy: 0.6471064383047398
Energy: 1.4389497549954737
Energy: 0.6389544216961142
Energy: 0.826600692762267
Energy: 0.6389544216961142
Energy: 1.3112148444872604
Energy: 0.6393251091946409
Energy: 0.8247547867251261
Energy: 0.6393251092319855
Energy: 1.0378235013302055
Energy: 0.638700402602322
Energy: 1.1311094020155565
Energy: 0.6387004026032805
Energy: 1.2714162198207295
Energy: 0.9299144284209524
Energy: 1.1319824663443392
Energy: 0.9299144284199937
Energy: 1.0650328810894978
Energy: 1.1181945863208758
Energy: 1.1297717538192644
Energy: 1.1181945863208758
Energy: 1.0762866363399177
Energy: 0.9154964135913319
Energy: 1.2115170937525228
Energy: 0.9154964135913319
Energy: 1.1014579148315418
Energy: 0.8064775668715678
Energy: 1.2360906021211848
Energy: 0.806477566870609
Energy: 0.8082296143829012
Energy: 0.805830302987703
Energy: 1.379164441726099
Energy: 0.805830302987703
Energy: 0.8089158418599023
Energy: 0.8060295542947749
Energy: 1.2468581120262008
Energy: 0.8060295542957335
Energy: 0.7092513267708142
Energy: 0.6405608960909708
Energy: 1.2325092801057773
Energy: 0.6405608962452298
Energy: 0.7145164656729399
Energy: 0.638398922379058
Energy: 1.2467432434857735
Energy: 0.6383989224796751
Energy: 0.7256613654898013
Energy: 0.6295248994302292
Energy: 1.4985467573214892
Energy: 0.6295248994283118
Energy: 0.9143670370447281
Energy: 0.6373942151455483
Energy: 1.3345544639273348
Energy: 0.6373942151455483
Energy: 0.9056547395668391
Energy: 0.6277325826161826
Energy: 1.3238298246000324
Energy: 0.6277325826161826
Energy: 0.9007563260379778
Energy: 0.6365104218905334
Energy: 1.3148565457367258
Energy: 0.6365104218914922
Energy: 1.1202937255683916
Energy: 0.805599217013852
Energy: 1.3191448894783013
Energy: 0.805599217013852
Energy: 0.8614150006388535
Energy: 1.0800988500856676
Energy: 1.3166517977565906
Energy: 1.0800988500856676
Energy: 1.1155721677965915
Energy: 1.049890284975801
Energy: 1.0747714224690827
Energy: 1.049890284975801
Energy: 1.3863131441061494
Energy: 0.9235878636767784
Energy: 1.065504099954838
Energy: 0.9235878636777372
Energy: 1.234261970563318
Energy: 0.6387359176082897
Energy: 0.830199193126854
Energy: 0.6387359175383502
Energy: 1.3890854569274096
Energy: 0.639456242009011
Energy: 0.7079967147176538
Energy: 0.639456241922774
Energy: 1.437808616303711
Energy: 0.639867750050595
Energy: 0.8365407426185368
Energy: 0.639867750047719
Energy: 1.2355925776214114
Energy: 0.6451192104495106
Energy: 0.6385353047229311
Energy: 0.6451192104485518
Energy: 1.5164715889341736
Energy: 0.6387311744032589
Energy: 0.6401128143181285
Energy: 0.6387311744013415
Energy: 1.31298755992775
Energy: 0.6489157817320995
Energy: 0.6383689453963259
Energy: 0.648915781731141

minimum gb energy = 0.6277325826161826 eV
minimum distance =  2.30731720298815 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.4684385720507078
Energy: 0.6041148531699985
Energy: 0.5808376959960951
Energy: 0.5796593681899567
Energy: 1.5385344964261085
Energy: 0.5727837538878547
Energy: 0.7303703540802854
Energy: 0.5727837538933566
Energy: 1.3124276241519646
Energy: 0.5743764834720825
Energy: 0.7014974617730337
Energy: 0.5743764834697246
Energy: 1.1331652385322595
Energy: 0.5751440464896986
Energy: 1.0088555443178993
Energy: 0.5751440464904848
Energy: 1.3185359932511176
Energy: 0.8241592377840028
Energy: 0.9897877463990751
Energy: 0.8241592377832169
Energy: 1.0963451764934933
Energy: 0.8289324724768355
Energy: 0.9896370630090523
Energy: 0.8289324724791933
Energy: 1.101463948028941
Energy: 1.0251917901421668
Energy: 1.209059384435625
Energy: 1.025191790140595
Energy: 1.1074895539442786
Energy: 1.02723103939616
Energy: 0.9772917187145888
Energy: 1.0272310393953739
Energy: 0.8259782441645434
Energy: 1.0178749012105772
Energy: 1.2048444183222902
Energy: 1.0178749012097914
Energy: 0.8762495252631382
Energy: 0.8251039829266597
Energy: 1.4196761702566247
Energy: 0.8251039829266597
Energy: 0.7006828943478932
Energy: 0.5733496868791772
Energy: 1.3008760685134608
Energy: 0.5733496868744614
Energy: 0.697108841601602
Energy: 0.5741118509092699
Energy: 1.4206682680712472
Energy: 0.5741118509124136
Energy: 0.7426165889422919
Energy: 0.5747021526654721
Energy: 1.421525975498209
Energy: 0.5747021526615781
Energy: 0.5726883860017887
Energy: 0.5828730612236719
Energy: 1.3013057235998258
Energy: 0.5828730612244221
Energy: 0.5742742068726291
Energy: 0.573098182964197
Energy: 1.3197865893149279
Energy: 0.5730981829626252
Energy: 0.584356172905229
Energy: 0.57621867613201
Energy: 1.3151269434335664
Energy: 0.576218676131224
Energy: 0.7366702877927276
Energy: 0.5764540210935402
Energy: 1.319170868346364
Energy: 0.5764540210424888
Energy: 0.6961149027837609
Energy: 0.5717593706967069
Energy: 1.3173595372352533
Energy: 0.5717593706967069
Energy: 0.7340940889299696
Energy: 0.577890277723808
Energy: 1.1256576167486088
Energy: 0.5778902777222361
Energy: 1.0018285570573058
Energy: 0.8269280562540641
Energy: 1.1246708134618586
Energy: 0.8269280562540641
Energy: 0.9768733694737957
Energy: 0.8309952234282575
Energy: 1.209144763485063
Energy: 0.8309952234180399
Energy: 0.9930869137698968
Energy: 0.8301173217171346
Energy: 1.1177286071720627
Energy: 0.8301173217187064
Energy: 1.205250393015521
Energy: 1.0641102966017868
Energy: 1.0958996532545155
Energy: 1.0641102966010008
Energy: 0.9774097584251472
Energy: 0.8303236340386904
Energy: 0.994061563337564
Energy: 0.8303236340394763
Energy: 1.2109712065659513
Energy: 1.0220744827584352
Energy: 0.8190591807697631
Energy: 1.0220744827584352
Energy: 1.207396350882209
Energy: 0.5731148988821813
Energy: 0.990666372586268
Energy: 0.5731148987297775
Energy: 1.2088089946793552
Energy: 0.5769214397115153
Energy: 0.743754256492972
Energy: 0.5769214397107651
Energy: 1.4248883810618478
Energy: 0.5739559697269148
Energy: 0.6979988227912526
Energy: 0.5739559697284865
Energy: 1.2228406572905537
Energy: 0.5786434976211404
Energy: 0.752346185195307
Energy: 0.5786434976180325
Energy: 1.2199480762069848
Energy: 0.5768141476753038
Energy: 0.5718272702509216
Energy: 0.5768141476760897
Energy: 1.4214300860263536
Energy: 0.5722635140362976
Energy: 0.5735982289595454
Energy: 0.5722635140370836
Energy: 1.321736022587666
Energy: 0.5782461578061912
Energy: 0.572433573324057
Energy: 0.5782461578061912

minimum gb energy = 0.5717593706967069 eV
minimum distance =  2.31016893283813 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.2696521765500774
Energy: 0.5542835254223819
Energy: 0.5365834773589983
Energy: 0.5337870416746563
Energy: 1.462960357547377
Energy: 0.5281114576109303
Energy: 0.6374693356622692
Energy: 0.5281114576089327
Energy: 1.3594852294066
Energy: 0.5298101880334083
Energy: 0.6378515261277589
Energy: 0.5298101880347399
Energy: 1.2711128317479308
Energy: 0.5313618751396798
Energy: 0.8960484897317748
Energy: 0.5313618751396798
Energy: 1.3656035504331756
Energy: 0.7480900490849893
Energy: 0.8617311407946052
Energy: 0.7480900490849893
Energy: 1.1692147764574103
Energy: 0.7481058073959196
Energy: 0.8858216280998197
Energy: 0.748105807397917
Energy: 0.9996505727757325
Energy: 0.7555877490931289
Energy: 1.0822883824189582
Energy: 0.7555877490931289
Energy: 1.1803355617054625
Energy: 0.9741572080354669
Energy: 0.8643214404687344
Energy: 0.9741572080348011
Energy: 0.9815512470016882
Energy: 0.9661815293768752
Energy: 1.075668253083096
Energy: 0.9661815293768752
Energy: 0.9806709333801934
Energy: 0.971617080810849
Energy: 1.2644087910479576
Energy: 0.971617080810849
Energy: 0.8765923126943108
Energy: 0.7547393793549153
Energy: 1.132740528797234
Energy: 0.7547393793549153
Energy: 0.73617930853518
Energy: 0.9253366983735598
Energy: 1.2642493097085905
Energy: 0.9253366983735598
Energy: 0.8870292196793719
Energy: 0.7496581239774281
Energy: 1.2635769088447102
Energy: 0.7496581239787599
Energy: 0.667354074552309
Energy: 0.5308696858964667
Energy: 1.1331802355064484
Energy: 0.5308696875962292
Energy: 0.63145222635968
Energy: 0.5290494875088197
Energy: 1.4525331988639705
Energy: 0.5290494875094855
Energy: 0.6785501938044876
Energy: 0.5320337467436159
Energy: 1.2673473351004798
Energy: 0.5320337467302996
Energy: 0.5447064671690274
Energy: 0.5336241951949008
Energy: 1.2707132484055956
Energy: 0.5336241951935691
Energy: 0.5270459485250591
Energy: 0.5280812015879776
Energy: 1.4563958803889383
Energy: 0.52808120158598
Energy: 0.5422803511083332
Energy: 0.5315005750051869
Energy: 1.2103756643975765
Energy: 0.5315005750071844
Energy: 0.6496264769379055
Energy: 0.5318552134755141
Energy: 1.3644784096930496
Energy: 0.5318552134781774
Energy: 0.6303985293923113
Energy: 0.5284243366638798
Energy: 1.3663836078070233
Energy: 0.5284243351225204
Energy: 0.6521412628529655
Energy: 0.5347534248558168
Energy: 1.1774835987310892
Energy: 0.5347534248524877
Energy: 0.8970345260323423
Energy: 0.7486854020958192
Energy: 1.1681055770426798
Energy: 0.748685402096485
Energy: 0.8653917060115246
Energy: 0.7509411650527743
Energy: 1.2672521899502374
Energy: 0.7509411650521085
Energy: 0.9042269485157313
Energy: 0.753567803717998
Energy: 0.9933688653498965
Energy: 0.7535678037186638
Energy: 1.0756554446257982
Energy: 0.96961132650415
Energy: 1.2662179774858562
Energy: 0.96961132650415
Energy: 0.869585507650095
Energy: 0.9682078840639631
Energy: 1.077522000111871
Energy: 0.9682078840632973
Energy: 1.0881128312581214
Energy: 0.9754345902966775
Energy: 0.9943397027561297
Energy: 0.9754345902966775
Energy: 1.0780643518245283
Energy: 0.7483738798844004
Energy: 1.080429223231796
Energy: 0.7483738798870637
Energy: 1.0761157817195817
Energy: 0.7484315587866596
Energy: 0.8650871764714503
Energy: 0.7484315587879912
Energy: 1.2730338861584374
Energy: 0.7478441065549656
Energy: 0.7357116282077982
Energy: 0.7478441065582946
Energy: 1.1338597898617744
Energy: 0.5295483664121655
Energy: 0.9056226414484458
Energy: 0.529548366562579
Energy: 1.264925123302458
Energy: 0.5309030926523955
Energy: 0.6374100752841035
Energy: 0.5309030926417425
Energy: 1.3671892044082319
Energy: 0.5283111431504427
Energy: 0.6364488339017561
Energy: 0.528311143153106
Energy: 1.414367004976985
Energy: 0.5378562340020298
Energy: 0.6586346774438987
Energy: 0.5378562341803469
Energy: 1.451671231903585
Energy: 0.528819839602396
Energy: 0.5334357529153262
Energy: 0.5288198396030618
Energy: 1.3576261894672041
Energy: 0.5294096911708198
Energy: 0.532647911860983
Energy: 0.5294096911674907

minimum gb energy = 0.5270459485250591 eV
minimum distance =  2.31261369825365 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.4203977297104846
Energy: 0.5262535063075011
Energy: 0.4773174266667409
Energy: 0.477573933596564
Energy: 1.4257119058918322
Energy: 0.47762267494510213
Energy: 0.5663402836237926
Energy: 0.4776226749439472
Energy: 1.2530357656228575
Energy: 0.47672426098508697
Energy: 0.5657614901767101
Energy: 0.47672426098508697
Energy: 1.1739758739048025
Energy: 0.4775180169458357
Energy: 0.7860201160020642
Energy: 0.4775180170151048
Energy: 1.3850738648635335
Energy: 0.6752576088033063
Energy: 0.7761076011646546
Energy: 0.6752576088050386
Energy: 1.0830505474549086
Energy: 0.4761144123597561
Energy: 0.7794303891114006
Energy: 0.4761144323702983
Energy: 1.0872125275256572
Energy: 0.57975224032975
Energy: 0.9639589377042714
Energy: 0.57975224032975
Energy: 1.2203026630612304
Energy: 0.8788450384278462
Energy: 0.821227901169059
Energy: 0.8788450384272687
Energy: 1.0870991850798692
Energy: 0.8823312506996724
Energy: 0.9655959170235027
Energy: 0.8823312507002499
Energy: 1.0860185741700303
Energy: 0.8835767795357549
Energy: 1.1288047415218698
Energy: 0.8835767795363323
Energy: 0.9741651649438705
Energy: 0.8781253964247224
Energy: 1.0543508579236376
Energy: 0.8781253964247224
Energy: 0.9376928907291301
Energy: 0.8776859093675731
Energy: 1.1300868599800187
Energy: 0.8776859093675731
Energy: 0.9622710621352898
Energy: 0.8733568465824375
Energy: 1.1685280626854382
Energy: 0.8733568465818601
Energy: 0.7602731670489918
Energy: 0.5816683010837798
Energy: 1.0548532544908402
Energy: 0.5816683010826249
Energy: 0.709203942736036
Energy: 0.5974801558205336
Energy: 1.297460383066458
Energy: 0.5974801558205336
Energy: 0.7634418256570371
Energy: 0.4770756215031541
Energy: 1.1695289254482797
Energy: 0.4770756215048865
Energy: 0.5852320345247803
Energy: 0.47558404818765604
Energy: 1.1735323721346922
Energy: 0.4755840481865012
Energy: 0.5755787366034407
Energy: 0.5805403536512879
Energy: 1.4616627671720288
Energy: 0.5805403536518654
Energy: 0.5801584734837167
Energy: 0.4771202002435325
Energy: 1.3359086512366893
Energy: 0.47712020018639
Energy: 0.5200759969419223
Energy: 0.477969152637914
Energy: 1.3355716126347343
Energy: 0.4779691526384915
Energy: 0.5193286884311183
Energy: 0.47318564294705734
Energy: 1.5039668521729423
Energy: 0.4731856429476349
Energy: 0.5220241449674384
Energy: 0.4736972669183342
Energy: 1.2091571626825006
Energy: 0.4736972669171792
Energy: 0.6103250481247957
Energy: 0.47620369435176946
Energy: 1.3808260242550185
Energy: 0.47620369435119203
Energy: 0.612304502206799
Energy: 0.47552284492253455
Energy: 1.3781087215432628
Energy: 0.47552284492311203
Energy: 0.6103865210134797
Energy: 0.47704953669374034
Energy: 1.1726601732389386
Energy: 0.47704953668796574
Energy: 0.7813556739236917
Energy: 0.7711876965730172
Energy: 1.4198225229005532
Energy: 0.7711876965735948
Energy: 0.7901533971076738
Energy: 0.7702674604979781
Energy: 1.2531342686535851
Energy: 0.770267460499133
Energy: 0.9581967329674161
Energy: 0.5797313329240279
Energy: 1.1747051410439593
Energy: 0.5797313329240279
Energy: 0.9537001811897908
Energy: 0.8067153518896145
Energy: 1.2638705331464497
Energy: 0.8067153518901921
Energy: 0.9579550308615195
Energy: 0.8767429365524914
Energy: 1.084041674798013
Energy: 0.8767429365530688
Energy: 1.1356830904703301
Energy: 0.8810859492068542
Energy: 0.937539755895665
Energy: 0.8810859492056994
Energy: 1.040524904046802
Energy: 0.8858025791154622
Energy: 1.1274244273022775
Energy: 0.8858025791148848
Energy: 1.1298293052667732
Energy: 0.8815163497976339
Energy: 0.9277912504638013
Energy: 0.8815163497970565
Energy: 1.2975726552828633
Energy: 0.8780231638870313
Energy: 0.9281629288693846
Energy: 0.8780231638876087
Energy: 1.0524216133904782
Energy: 0.7295895724504559
Energy: 0.9529221928134577
Energy: 0.7295895724510333
Energy: 1.2967579255302728
Energy: 0.6550485069869545
Energy: 0.7724141412101213
Energy: 0.6550485069846447
Energy: 1.336854693854921
Energy: 0.6757141218908959
Energy: 0.7747621078953123
Energy: 0.6757141218926282
Energy: 1.2971820022378164
Energy: 0.47759227962676554
Energy: 0.5662389123104068
Energy: 0.4775922796134839
Energy: 1.461045881051136
Energy: 0.47647871323466284
Energy: 0.5673967097529152
Energy: 0.47647871323466284
Energy: 1.3391177595304933
Energy: 0.47976320417922597
Energy: 0.5671284790926094
Energy: 0.47976320417922597
Energy: 1.1740528849391345
Energy: 0.4760589876212541
Energy: 0.4761219978776812
Energy: 0.4760589876218316
Energy: 1.425337762606013
Energy: 0.476313836292867
Energy: 0.47645718910473145
Energy: 0.4763138362934444
Energy: 1.2561572205025635
Energy: 0.47596997846490735
Energy: 0.47621682737685017
Energy: 0.47596997846432987

minimum gb energy = 0.47318564294705734 eV
minimum distance =  2.30327483911749 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.015463000208152996
Energy: 0.01621276385071136
Energy: 1.109534005207182
Energy: 0.49483245262810494
Energy: 0.01617293614766658
Energy: 0.11151452225394985
Energy: 0.721641655964494
Energy: 0.11151452225436911
Energy: 0.016070305116398835
Energy: 0.11005208483600407
Energy: 0.7201359920639722
Energy: 0.11005208483600407
Energy: 0.017167518322580008
Energy: 0.11139829744288547
Energy: 0.7224777681900069
Energy: 0.11139829744288547
Energy: 0.7213035810103151
Energy: 0.11192646468860683
Energy: 0.7225910918588909
Energy: 0.11192646468860683
Energy: 0.015969694487192012
Energy: 0.10987156294584745
Energy: 0.720295306864179
Energy: 0.10987156294584745

minimum gb energy = 0.015463000208152996 eV
minimum distance =  2.52121301542232 Angstroms
sigma value = 1