Model name: model_name=EAM_Dynamo_BorovikovMendelevKing_2016_CuZr__MO_097471813275_000
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=3.638568460941315
cohesive_energy=3.4069304484773077
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.01301001831818793
Energy: 0.013390106284576694
Energy: 0.2527637606172662
Energy: 0.013390106284576694
Energy: 0.013390106284576694
Energy: 0.9825336947433359
Energy: 0.013390106284576694
Energy: 0.9825336947433359
Energy: 0.2527637606172662
Energy: 0.013390106285161414
Energy: 0.01301001831880705
Energy: 0.013390106284576694
Energy: 0.013390106284576694
Energy: 0.9825336947433359
Energy: 0.013390106284576694
Energy: 0.9825336947433359

minimum gb energy = 0.01301001831818793 eV
minimum distance =  2.50348103479963 Angstroms
sigma value = 1


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

Energy: 0.9820667250597617
Energy: 1.0095265367040425
Energy: 0.8964805047422336
Energy: 1.0095265367032915
Energy: 0.9260559867921072
Energy: 0.981940145278166
Energy: 0.917494710683732
Energy: 0.9819401452744116
Energy: 0.8499737519568455
Energy: 0.9978812360764552
Energy: 0.913479981535346
Energy: 0.9978812360764552
Energy: 0.9046990535840158
Energy: 1.0140394788147604
Energy: 0.8959691240756877
Energy: 1.014039478811006
Energy: 0.9047792332921057
Energy: 1.0096277489218437
Energy: 0.9094856716129177
Energy: 1.0096277489218437
Energy: 0.8690612261084906
Energy: 0.9747265599535524
Energy: 0.860535211742306
Energy: 0.9747265599535524
Energy: 0.9267816662207243
Energy: 0.9971007976985858
Energy: 0.8709773187460985
Energy: 0.997100797697835
Energy: 0.8084909482176461
Energy: 1.0113419233488108
Energy: 0.8556583531813909
Energy: 1.0113419233488108
Energy: 0.8969748036827947
Energy: 1.1581553181626494
Energy: 0.921426046497779
Energy: 1.1581553181626494
Energy: 0.8564043099495932
Energy: 0.9970872670205649
Energy: 0.8001656840597233
Energy: 0.9970872670213157
Energy: 0.919980900992252
Energy: 0.9821855671871709
Energy: 0.8951847493613376
Energy: 0.9821855671886726
Energy: 0.8787048061890684
Energy: 1.0114230073993606
Energy: 0.8669398853253774
Energy: 1.0114230073986097
Energy: 0.9167055968105811
Energy: 0.9966547212128405
Energy: 0.9268886636676261
Energy: 0.9966547212143422
Energy: 0.9170147707371052
Energy: 0.999827089764884
Energy: 0.8871503481011138
Energy: 0.9998270897663856
Energy: 0.9128194773085684
Energy: 1.0090966384593674
Energy: 0.9207700298021039
Energy: 1.0090966384586164
Energy: 0.9183986901239678
Energy: 1.0094871805908603
Energy: 0.9144389908409188
Energy: 1.0094871805908603
Energy: 0.9135835077226165
Energy: 0.9980270448759986
Energy: 0.8480727822756458
Energy: 0.9980270448752477
Energy: 0.9190261301134358
Energy: 0.9709260927103329
Energy: 0.9255317851391998
Energy: 0.9709260927118346
Energy: 0.8238482750374749
Energy: 1.0102601490470342
Energy: 0.8665696944133204
Energy: 1.010260149047785
Energy: 0.9269953694608368
Energy: 0.9176307591179851
Energy: 0.8953138106112086
Energy: 0.9176307591179851
Energy: 0.8578258857451202
Energy: 0.9977918148742869
Energy: 0.8140388815548828
Energy: 0.9977918148727853
Energy: 0.896078295024325
Energy: 0.9216667828498196
Energy: 0.9132765399132179
Energy: 0.9216667828505704
Energy: 0.9128392408158646
Energy: 1.009479076900434
Energy: 0.8563099098418158
Energy: 1.0094790769011848
Energy: 0.8906755306988381
Energy: 0.9980787412804879
Energy: 0.8689944278483062
Energy: 0.9980787412804879
Energy: 0.8711696331218598
Energy: 0.9744734261379139
Energy: 0.9270729569741695
Energy: 0.9744734261386647
Energy: 0.9074464859158157
Energy: 1.0109104394541648
Energy: 0.8568253056157662
Energy: 1.0109104394549155
Energy: 0.9150139533965795
Energy: 0.999895743930542
Energy: 0.8965379976867794
Energy: 0.9998957439290401
Energy: 0.8519569778389393
Energy: 0.9969771479680369
Energy: 0.9135307864823635
Energy: 0.9969771479710404
Energy: 0.9256563838900245
Energy: 1.0013335462092323
Energy: 0.9144710905348338
Energy: 1.0013335462107342
Energy: 0.9277699195389832
Energy: 1.0096496823118541
Energy: 0.8773608534598157
Energy: 1.009649682312605
Energy: 0.922752384588051
Energy: 1.0008868507235384
Energy: 0.916630831420525
Energy: 1.0008868507220368
Energy: 0.8915768930983362
Energy: 0.9982346831284074
Energy: 0.917088227964012
Energy: 0.9982346831269056
Energy: 0.9045856573681501
Energy: 1.0135122746753624
Energy: 0.8965426246214826
Energy: 1.0135122746768641

minimum gb energy = 0.8001656840597233 eV
minimum distance =  2.18831484418109 Angstroms
sigma value = 1


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

Energy: 1.0562095661577577
Energy: 1.070759531189336
Energy: 0.9234901458547807
Energy: 1.070759531190192
Energy: 0.9514494061112975
Energy: 1.0429528918899218
Energy: 0.9684677655582803
Energy: 1.0429528918830728
Energy: 0.9010383905215216
Energy: 1.0715762128183703
Energy: 0.962487732035457
Energy: 1.071576212824363
Energy: 0.9122837085816757
Energy: 1.0035823144362517
Energy: 0.911793776021303
Energy: 1.0035823144328273
Energy: 0.9123236598370996
Energy: 1.0608030578689949
Energy: 0.9620681298632618
Energy: 1.0608030578655705
Energy: 0.9452196240346812
Energy: 1.0609299249660844
Energy: 0.9070903735472469
Energy: 1.0609299249618038
Energy: 0.9522928356578201
Energy: 0.9462736542516977
Energy: 0.9462105338042213
Energy: 0.9462736542482733
Energy: 0.8405975552132865
Energy: 1.0714247237623657
Energy: 0.8956754404993427
Energy: 1.0714247237597974
Energy: 0.9211111637360054
Energy: 0.9804530798584389
Energy: 0.9684308510142431
Energy: 0.9804530798644316
Energy: 0.9124018327465789
Energy: 1.071574032125761
Energy: 0.8976789234660729
Energy: 1.0715740321249048
Energy: 0.9524943990084308
Energy: 1.0191899768324022
Energy: 0.9575635351456114
Energy: 1.019189976829834
Energy: 0.8804413864861149
Energy: 1.0674134903852839
Energy: 0.9661269670634959
Energy: 1.067413490387852
Energy: 0.9814320771673769
Energy: 1.054522272257834
Energy: 0.9398958369050309
Energy: 1.0545222722569778
Energy: 0.9815174346336722
Energy: 1.0545235743054187
Energy: 0.9619738698143604
Energy: 1.0545235743037062
Energy: 0.8804129232177429
Energy: 1.0673323389769722
Energy: 0.9501621208906524
Energy: 1.0673323389726916
Energy: 0.952221198433034
Energy: 1.0191740749912384
Energy: 0.9462685170952447
Energy: 1.019174074997231
Energy: 0.9124087895114082
Energy: 1.0715602783817093
Energy: 0.8948302819669531
Energy: 1.071560278379997
Energy: 0.9211579004114558
Energy: 0.9803982614093455
Energy: 0.9684297731850987
Energy: 0.9803982614119138
Energy: 0.8405756546441042
Energy: 1.0714863609124519
Energy: 0.9072510599452993
Energy: 1.071486360903891
Energy: 0.9522471752429703
Energy: 0.9462340027754214
Energy: 0.9134278109870987
Energy: 0.9462340027745653
Energy: 0.9451911603649897
Energy: 1.0609747725079277
Energy: 0.9405746327166667
Energy: 1.060974772508784
Energy: 0.9124016757591968
Energy: 1.060766882099682
Energy: 0.9411004304055023
Energy: 1.0607668820945453
Energy: 0.9122889048201375
Energy: 0.9489929003202566
Energy: 0.9460108739942146
Energy: 0.948992900323681
Energy: 0.9011505682749517
Energy: 1.0714616814461813
Energy: 0.9502475297244983
Energy: 1.071461681444469
Energy: 0.9514852851915031
Energy: 1.042937965697247
Energy: 0.9684468716705331
Energy: 1.042937965698103
Energy: 1.0562095661594701
Energy: 1.07075953118848
Energy: 0.9480173649122721
Energy: 1.070759531189336
Energy: 0.9514494061130097
Energy: 1.0429528918873536
Energy: 0.9684677655582803
Energy: 1.0429528918822168
Energy: 0.9010383905198094
Energy: 1.0715762128183703
Energy: 0.9661562047912738
Energy: 1.071576212823507
Energy: 0.9122837085816757
Energy: 1.0035823144362517
Energy: 0.9133157954632276
Energy: 1.0035823144353957

minimum gb energy = 0.8405756546441042 eV
minimum distance =  2.16096374923797 Angstroms
sigma value = 25


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

Energy: 1.0044386730558608
Energy: 1.1356515286249402
Energy: 0.9985513599550058
Energy: 1.1356515286239453
Energy: 0.9507940256887164
Energy: 1.0801765981191653
Energy: 0.9797673822475218
Energy: 1.0801765981201605
Energy: 0.9594282828785933
Energy: 1.1658767035069229
Energy: 0.9813757304189542
Energy: 1.1658767035069229
Energy: 0.9721907922740096
Energy: 1.089881933495197
Energy: 0.9508669714161012
Energy: 1.089881933495197
Energy: 0.949171886645114
Energy: 1.136599559846081
Energy: 0.9375353925809641
Energy: 1.1365995598440906
Energy: 1.0148441987682875
Energy: 1.161186980720265
Energy: 0.9492348316663368
Energy: 1.161186980720265
Energy: 0.9804325149389298
Energy: 0.9873148933244768
Energy: 0.9744017309368364
Energy: 0.9873148933224863
Energy: 1.0263250906982377
Energy: 1.1365143572984047
Energy: 0.9052361062085726
Energy: 1.1365143572993996
Energy: 0.9743641005348167
Energy: 1.0697515362735546
Energy: 0.9805239497733064
Energy: 1.0697515362715644
Energy: 0.9811040183481798
Energy: 1.1644773881537387
Energy: 0.9364180193715798
Energy: 1.1644773881527435
Energy: 0.9375681772259202
Energy: 1.1359891096149939
Energy: 0.9803780986113473
Energy: 1.135989109616984
Energy: 0.9495066197409247
Energy: 1.1355250616014303
Energy: 0.9794939013360651
Energy: 1.135525061600435
Energy: 0.9812289037552475
Energy: 1.0871203270333596
Energy: 0.9371552218175734
Energy: 1.08712032703535
Energy: 0.9751588972836907
Energy: 1.0343914288356357
Energy: 1.0237345471144423
Energy: 1.0343914288376261
Energy: 0.9488693316939906
Energy: 1.1375744012946956
Energy: 0.9033199994110869
Energy: 1.1375744012946956
Energy: 0.9796046328682582
Energy: 0.9872121204174573
Energy: 0.9503245637307176
Energy: 0.9872121204154669
Energy: 0.8859939539960502
Energy: 1.1662090759570356
Energy: 0.8860650539140205
Energy: 1.1662090759570356
Energy: 0.9512944459328221
Energy: 1.080924276559388
Energy: 0.939321774252562
Energy: 1.0809242765603833
Energy: 0.9725716544325919
Energy: 1.0878622417691501
Energy: 0.9491790834454441
Energy: 1.0878622417691501
Energy: 0.9489607026632177
Energy: 1.161697337346232
Energy: 0.9795687314418227
Energy: 1.1616973373472272
Energy: 0.9934676132081008
Energy: 1.0666476999210828
Energy: 0.9795466914738858
Energy: 1.0666476999200876
Energy: 1.0031608117376085
Energy: 1.137089847788873
Energy: 0.9998886479812146
Energy: 1.1370898477878777
Energy: 0.9798778054580765
Energy: 1.080536424046497
Energy: 0.979756688409831
Energy: 1.0805364240484874
Energy: 0.9588775391661292
Energy: 1.165259520054678
Energy: 0.9811209922102324
Energy: 1.165259520054678
Energy: 0.9805169813554924
Energy: 0.9934588198171462
Energy: 0.9500514875860718
Energy: 0.9934588198181414

minimum gb energy = 0.8859939539960502 eV
minimum distance =  2.2059955966657 Angstroms
sigma value = 9


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

Energy: 1.073918078779051
Energy: 1.0709144048247539
Energy: 1.0708417006925628
Energy: 1.0709144048247539
Energy: 1.030990220127746
Energy: 1.1514374744964233
Energy: 1.0692156179227619
Energy: 1.1514374744952358
Energy: 0.9451589078085985
Energy: 1.0638590678862332
Energy: 1.0341314192593247
Energy: 1.0638590678838589
Energy: 1.0633259761815799
Energy: 1.1619632389340078
Energy: 0.9681899523804182
Energy: 1.1619632389340078
Energy: 1.0990122157626139
Energy: 1.1432199390811009
Energy: 1.0331510690331016
Energy: 1.1432199390799138
Energy: 0.9340374165750565
Energy: 1.063705749105739
Energy: 0.9682962444530113
Energy: 1.0637057491033644
Energy: 1.075642177820079
Energy: 0.9685638353263996
Energy: 0.9703263869260483
Energy: 0.9685638353252124
Energy: 1.0123748955331593
Energy: 1.0638358502261827
Energy: 0.9607578742839853
Energy: 1.0638358502261827
Energy: 1.077894461658019
Energy: 1.1427306453328565
Energy: 1.0539823356182407
Energy: 1.1427306453328565
Energy: 1.0656026252641744
Energy: 1.0643871202330606
Energy: 0.9683659408312667
Energy: 1.0643871202306863
Energy: 1.0030945675689091
Energy: 1.143766668254337
Energy: 1.034237147859587
Energy: 1.1437666682531498
Energy: 1.0634009817437136
Energy: 1.1098965005382577
Energy: 0.9681514622598408
Energy: 1.1098965005406052
Energy: 0.9344325605348487
Energy: 1.0688187143875625
Energy: 1.0075242867882745
Energy: 1.0688187143863752
Energy: 1.017406569621045
Energy: 1.0635710534175915
Energy: 1.0651719086608045
Energy: 1.0635710534175915
Energy: 0.9344477521919726
Energy: 1.0687858585441734
Energy: 1.0124383516016362
Energy: 1.0687858585441734
Energy: 1.0634039401838287
Energy: 1.1099226568434222
Energy: 0.9682878418786218
Energy: 1.1099226568422351
Energy: 1.0031833257194311
Energy: 1.1437432885400927
Energy: 1.0536677624341702
Energy: 1.1437432885400927
Energy: 1.0655704997236857
Energy: 1.0643650689724138
Energy: 0.9683704110195178
Energy: 1.0643650689736008
Energy: 1.0778673446145615
Energy: 1.1427181308359478
Energy: 1.0539504760874199
Energy: 1.1427181308395096
Energy: 1.0123304838817653
Energy: 1.0637897619837642
Energy: 0.9607945788751949
Energy: 1.0637897619837642
Energy: 1.0756279949819652
Energy: 0.9686061140953649
Energy: 0.9703217527695295
Energy: 0.9686061140965522

minimum gb energy = 0.9340374165750565 eV
minimum distance =  2.34970217649352 Angstroms
sigma value = 25


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

Energy: 1.0140162944221942
Energy: 1.2952360744739204
Energy: 1.1231215524562914
Energy: 1.2952360744739204
Energy: 0.9992618547336644
Energy: 1.1642820668481642
Energy: 0.9861871305666973
Energy: 1.1642820668466958
Energy: 0.9869600715485524
Energy: 1.089764041549057
Energy: 0.9857533250774382
Energy: 1.0897640415226293
Energy: 1.0112878796450953
Energy: 1.0658889294907692
Energy: 1.0949973302290084
Energy: 1.0658889294893008
Energy: 1.0847234099812841
Energy: 0.9986303945587774
Energy: 1.0666182656905205
Energy: 0.9986303945587774
Energy: 0.9857340166481677
Energy: 1.1620614616168399
Energy: 0.987251559895056
Energy: 1.1620614616168399
Energy: 1.0434740461331855
Energy: 1.0657411243486945
Energy: 0.9861896036056813
Energy: 1.0657411243486945
Energy: 1.0841585218188932
Energy: 0.9866432961037321
Energy: 1.0108476212713093
Energy: 0.9866432961007957
Energy: 0.985724046306535
Energy: 1.0236932008433208
Energy: 0.9992207038091628
Energy: 1.023693200147689
Energy: 1.132948912884473
Energy: 1.0895710243253522
Energy: 0.9862794518897945
Energy: 1.0895710243253522
Energy: 1.0324503374870515
Energy: 1.0659379185028774
Energy: 1.1868295807708336
Energy: 1.0659379185043458
Energy: 0.9862320525617116
Energy: 1.0245210325145564
Energy: 1.1310836664762838
Energy: 1.0245210325160246
Energy: 1.0809861264180287
Energy: 1.0590715023258304
Energy: 0.9864579568788964
Energy: 1.0591012116772707
Energy: 0.9860737842318875
Energy: 1.0658237940620807
Energy: 1.011271290515713
Energy: 1.0658237940635489
Energy: 0.9856490499765284
Energy: 1.0653424984820423
Energy: 1.0847676148856087
Energy: 1.0653424984805742
Energy: 0.9974541958280178
Energy: 1.1031589587937862
Energy: 0.9857719462588184
Energy: 1.1031589587937862
Energy: 0.9860527149380165
Energy: 1.0838461945612166
Energy: 1.132259073614199
Energy: 1.0838461945612166

minimum gb energy = 0.9856490499765284 eV
minimum distance =  2.33336575889968 Angstroms
sigma value = 17


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

Energy: 1.1511196656704852
Energy: 1.1403888648447176
Energy: 1.225858127929988
Energy: 1.1403888648430547
Energy: 1.1172668913365484
Energy: 1.1044149622025876
Energy: 1.0323883952330484
Energy: 1.104414962201756
Energy: 1.1076634124843507
Energy: 1.1344757988429386
Energy: 1.0315928973533883
Energy: 1.134475798842107
Energy: 1.0339938204408718
Energy: 1.1412471324658073
Energy: 1.0897780235270376
Energy: 1.1412471324666387
Energy: 1.1411442186464198
Energy: 1.084274002584275
Energy: 1.0327420718745575
Energy: 1.0842740025826119
Energy: 1.0455628304820317
Energy: 1.071192100487013
Energy: 1.0965805792345507
Energy: 1.071192100487013
Energy: 1.0363389541830494
Energy: 1.1464881188251872
Energy: 1.032261379595601
Energy: 1.1464881188243556
Energy: 1.097499702548254
Energy: 1.1355227640084047
Energy: 1.0411052453475194
Energy: 1.1355227640084047
Energy: 1.0420135124889771
Energy: 1.1921283462587273
Energy: 1.1507898714028029
Energy: 1.1921283462603904
Energy: 1.2006365604116032
Energy: 1.1077742795995873
Energy: 1.031908816185472
Energy: 1.1077742795987557
Energy: 1.0366811922566372
Energy: 1.135044466365727
Energy: 1.11052360254332
Energy: 1.1350444663665586
Energy: 1.0416260931989392
Energy: 1.1502330626294786
Energy: 1.041932984845493
Energy: 1.1502330626311414
Energy: 1.1445556780795598
Energy: 1.1348836111088192
Energy: 1.13797717609452
Energy: 1.1348836111088192
Energy: 1.0317032824082675
Energy: 1.1432179569740275
Energy: 1.120120459440949
Energy: 1.143217956974859
Energy: 1.1051829716871762
Energy: 1.14720970604727
Energy: 1.0421824689684973
Energy: 1.1472097060481012
Energy: 1.1062827600374605
Energy: 1.1356191605577561
Energy: 1.0975532232305456
Energy: 1.1356191605569246
Energy: 1.0322490363399253
Energy: 1.1902222407377172
Energy: 1.2167677950487723
Energy: 1.1902222407385488
Energy: 1.1122084709581528
Energy: 1.1302189955112256
Energy: 1.0456605254699882
Energy: 1.1302189955112256
Energy: 1.056407026734236
Energy: 1.1985692533875731
Energy: 1.0874423050713713
Energy: 1.1985692533892363
Energy: 1.0320720999847948
Energy: 1.1940571467021073
Energy: 1.0342285005152905
Energy: 1.1940571467004442
Energy: 1.0649472024271323
Energy: 1.134660455623472
Energy: 1.1076779809518706
Energy: 1.134660455623472
Energy: 1.03248703131839
Energy: 1.2049213019335852
Energy: 1.200096293481707
Energy: 1.2049213019327536
Energy: 1.1341449578824416
Energy: 1.1403903852516877
Energy: 1.032496571375063
Energy: 1.1403903852500246
Energy: 1.0416389513446243
Energy: 1.1473586313746156
Energy: 1.1090967005675998
Energy: 1.1473586313746156
Energy: 1.0425561820150733
Energy: 1.1319025105153195
Energy: 1.1445536454239942
Energy: 1.1319025105153195
Energy: 1.1373145642348248
Energy: 1.1355970843425343
Energy: 1.033650255947004
Energy: 1.1355970843400396
Energy: 1.0334249289150914
Energy: 1.1754765128645757
Energy: 1.229437408863648
Energy: 1.1754765127506945
Energy: 1.0966467906528774
Energy: 1.0715073345674977
Energy: 1.1084941625330378
Energy: 1.0715073345650032
Energy: 1.2131470168181955
Energy: 1.1959698101583
Energy: 1.035901295405588
Energy: 1.1959698101566372
Energy: 1.0412015052075212
Energy: 1.1923475515029915
Energy: 1.1429433245586889
Energy: 1.1923475515046547

minimum gb energy = 1.0315928973533883 eV
minimum distance =  2.18918196578646 Angstroms
sigma value = 53


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

Energy: 1.0164035950611463
Energy: 1.0145145465485856
Energy: 1.2251790627405297
Energy: 1.0145145465504999
Energy: 1.1576748182323748
Energy: 1.1017682829631805
Energy: 1.1183712758000768
Energy: 1.1017682829593518
Energy: 1.016280199529451
Energy: 1.0142722030118074
Energy: 1.0515798678460742
Energy: 1.014272203007979
Energy: 1.0162704390337893
Energy: 1.0142910662824631
Energy: 1.1181573349690845
Energy: 1.014291066286292
Energy: 1.1576330016702019
Energy: 1.1017078572516867
Energy: 1.1433865159162615
Energy: 1.1017078572497725
Energy: 1.0164035950630608
Energy: 1.0145145465485856
Energy: 1.207486810803822
Energy: 1.0145145465504999
Energy: 1.1576748182323748
Energy: 1.101768282961266
Energy: 1.1340472829671648
Energy: 1.1017682829574376
Energy: 1.0162801995275368
Energy: 1.0142722030098932
Energy: 1.0799552698714485
Energy: 1.0142722030098932
Energy: 1.0162704390337893
Energy: 1.0142910662824631
Energy: 1.0941972960284638
Energy: 1.014291066286292
Energy: 1.1576330016702019
Energy: 1.1017078572516867
Energy: 1.1433865159143475
Energy: 1.1017078572478582
Energy: 1.0164035950611463
Energy: 1.0145145465466714
Energy: 1.1921977253411622
Energy: 1.0145145465504999
Energy: 1.1576748182362033
Energy: 1.1017682829631805
Energy: 1.1340465884238935
Energy: 1.1017682829593518
Energy: 1.016280199529451
Energy: 1.0142722030118074
Energy: 1.1336020540239122
Energy: 1.014272203007979

minimum gb energy = 1.014272203007979 eV
minimum distance =  2.30989506923633 Angstroms
sigma value = 9


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

Energy: 1.1062836671697778
Energy: 1.2296687578526384
Energy: 1.2893785318297821
Energy: 1.2296687575658172
Energy: 1.188053044310161
Energy: 1.1519383373124163
Energy: 1.097147482044871
Energy: 1.15193833731525
Energy: 1.0754857213688809
Energy: 1.093623063808661
Energy: 1.0867541751842267
Energy: 1.0936230638107867
Energy: 1.1511796120116482
Energy: 1.2506852594177185
Energy: 1.0806677723966496
Energy: 1.2506852594205524
Energy: 1.1767420603642453
Energy: 1.1562190753001622
Energy: 1.0935319407280495
Energy: 1.1562190753015793
Energy: 1.0953558245104638
Energy: 1.0928869786274635
Energy: 1.1441743104411328
Energy: 1.092886978629589
Energy: 1.3058989687127494
Energy: 1.1529827753803377
Energy: 1.0880731450673624
Energy: 1.1529827753824633
Energy: 1.0835591349187195
Energy: 1.2489843190296852
Energy: 1.1664234131394493
Energy: 1.2489843191373158
Energy: 1.0773292779756136
Energy: 1.2835633257912236
Energy: 1.0990464471591213
Energy: 1.2835633257869723
Energy: 1.076774332202044
Energy: 1.1445362812335178
Energy: 1.0866888002205648
Energy: 1.1445362812321007
Energy: 1.0850778969862451
Energy: 1.234928903673126
Energy: 1.2726919386115512
Energy: 1.2349289038707065
Energy: 1.1805091983535725
Energy: 1.209278048822615
Energy: 1.0796291602687424
Energy: 1.2092780488190724
Energy: 1.0772049342869643
Energy: 1.1454879820229313
Energy: 1.2321524044304208
Energy: 1.145487982022223
Energy: 1.1549653350014326
Energy: 1.1653864911161949
Energy: 1.1116487437021534
Energy: 1.1653864911572889
Energy: 1.0853984365978635
Energy: 1.2145085784849388
Energy: 1.1650861077386143
Energy: 1.2145085782547664
Energy: 1.0795573114557657
Energy: 1.2840168018950753
Energy: 1.1498718656833258
Energy: 1.2840168018964924
Energy: 1.132221344446514
Energy: 1.2120672051297512
Energy: 1.085327099660332
Energy: 1.212067205311776
Energy: 1.0872489482983954
Energy: 1.1530898743662923
Energy: 1.1981708996483977
Energy: 1.153089874368418
Energy: 1.2222703603578644
Energy: 1.1475768165780034
Energy: 1.0974767835049983
Energy: 1.1475768165439946
Energy: 1.0798303155130733
Energy: 1.1563594722650015
Energy: 1.1416600287862044
Energy: 1.1563594722642931
Energy: 1.1497337130746998
Energy: 1.2353702183775233
Energy: 1.1526769035023008
Energy: 1.2353702183753976
Energy: 1.146238605905346
Energy: 1.1893337003046187
Energy: 1.0764136357780005
Energy: 1.1893337003060358
Energy: 1.0998358405961237
Energy: 1.222271350350197
Energy: 1.0775155604844415
Energy: 1.2222713503494884
Energy: 1.303381446734397
Energy: 1.1345252919186661
Energy: 1.083426778045934
Energy: 1.1345252918889084
Energy: 1.1026938946532892
Energy: 1.2245225943467013
Energy: 1.2548151188353869
Energy: 1.2245225943488267
Energy: 1.110522211536259
Energy: 1.0935623818676072
Energy: 1.075807829673652
Energy: 1.0935623818640647
Energy: 1.1354497701545765
Energy: 1.2189036175922543
Energy: 1.150756094637581
Energy: 1.2189036175660712
Energy: 1.1061565303828635
Energy: 1.2501559074211672
Energy: 1.1511540269547942
Energy: 1.25015590742822
Energy: 1.1222525696971097
Energy: 1.0934291810011199
Energy: 1.0751808848351374
Energy: 1.093429180993326
Energy: 1.09664501186472
Energy: 1.2869357936472205
Energy: 1.2546424899988948
Energy: 1.2869357936443864
Energy: 1.250879372252885
Energy: 1.1927802030891395
Energy: 1.0828852091025687
Energy: 1.1927802032265276
Energy: 1.0967476154323705
Energy: 1.1547278960154443
Energy: 1.076218751873602
Energy: 1.154727896016153
Energy: 1.097863282655432
Energy: 1.1907757099543728
Energy: 1.0760052216721072
Energy: 1.1907757099593324
Energy: 1.149592056691468
Energy: 1.237582328873823
Energy: 1.1511408531859733
Energy: 1.2375823293964847
Energy: 1.08192463146312
Energy: 1.2462186660522154
Energy: 1.307679728786222
Energy: 1.2462186660493815

minimum gb energy = 1.0751808848351374 eV
minimum distance =  2.21388692816965 Angstroms
sigma value = 73


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

Energy: 1.101568716337715
Energy: 1.0977599997753669
Energy: 1.2930590027047606
Energy: 1.0977599997753669
Energy: 1.1056628444124672
Energy: 1.1984992213407106
Energy: 1.1029425331261147
Energy: 1.1984992213418093
Energy: 1.0865500000573425
Energy: 1.2983610731314377
Energy: 1.08610245298556
Energy: 1.2983610731325619
Energy: 1.070971072194772
Energy: 1.1995430388252826
Energy: 1.0846482145094691
Energy: 1.1995430388264068
Energy: 1.0700182844365014
Energy: 1.1863726628691562
Energy: 1.091074449468109
Energy: 1.1863726628691562
Energy: 1.085424182950446
Energy: 1.0960180926701675
Energy: 1.2439584796618353
Energy: 1.0960180926712917
Energy: 1.3153328584589696
Energy: 1.3055962623760309
Energy: 1.085293997782539
Energy: 1.3055962623760309
Energy: 1.0710459371316845
Energy: 1.0976727205931085
Energy: 1.271810927430844
Energy: 1.0976727205931085
Energy: 1.25792234761999
Energy: 1.1007331379245966
Energy: 1.0975430616915887
Energy: 1.1007331379245966
Energy: 1.0858027683978588
Energy: 1.169060964107609
Energy: 1.0868117199673675
Energy: 1.169060964107609
Energy: 1.0687217634522932
Energy: 1.0996532514343011
Energy: 1.2570206117072071
Energy: 1.0996532514343011
Energy: 1.1981022766454708
Energy: 1.1906337630237012
Energy: 1.071504948273114
Energy: 1.1906337630237012
Energy: 1.084307289142575
Energy: 1.1811139887984885
Energy: 1.2218033643496775
Energy: 1.1811139887996127
Energy: 1.2956657746887787
Energy: 1.1819008071241748
Energy: 1.0846915732686278
Energy: 1.1819008071241748
Energy: 1.083050135975638
Energy: 1.1279065716279777
Energy: 1.19529743742044
Energy: 1.127906571629102
Energy: 1.2571525993531316
Energy: 1.0982432744153496
Energy: 1.0712146197028685
Energy: 1.0982432744153496
Energy: 1.0860913208694356
Energy: 1.101871152707196
Energy: 1.0864825932580011
Energy: 1.101871152707196
Energy: 1.1023132615120803
Energy: 1.1026084084966596
Energy: 1.0861726047215605
Energy: 1.1026084084955354
Energy: 1.0895710230477096
Energy: 1.097684939316544
Energy: 1.0695461537157875
Energy: 1.097684939316544
Energy: 1.1027082204778906
Energy: 1.1274597982363124
Energy: 1.3157455504816207
Energy: 1.1274597982363124
Energy: 1.3066914257489786
Energy: 1.096515599774361
Energy: 1.087432244363361
Energy: 1.096515599774361
Energy: 1.083893502360162
Energy: 1.1818698969264834
Energy: 1.2216308596101226
Energy: 1.1818698969253594

minimum gb energy = 1.0687217634522932 eV
minimum distance =  2.22137128900604 Angstroms
sigma value = 7


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

Energy: 1.1743650027048833
Energy: 1.1746743964415949
Energy: 1.2996656970575504
Energy: 1.1746744386998824
Energy: 1.2837713382218794
Energy: 1.1699713438913564
Energy: 1.1022367789201755
Energy: 1.1699713438913564
Energy: 1.0857859789224167
Energy: 1.254296723785416
Energy: 1.1058322789411883
Energy: 1.2542967237830314
Energy: 1.0960826888803417
Energy: 1.2313722807952205
Energy: 1.108433897913154
Energy: 1.2313722807936307
Energy: 1.0922153467347349
Energy: 1.170727346485409
Energy: 1.113176171821758
Energy: 1.170727346486999
Energy: 1.0993480841141519
Energy: 1.1248610840942725
Energy: 1.2017785260122231
Energy: 1.1248610840942725
Energy: 1.2039632988444497
Energy: 1.2101425243154527
Energy: 1.1007772506312552
Energy: 1.2101425244457398
Energy: 1.0991282044667918
Energy: 1.1245415156425382
Energy: 1.2890200074530356
Energy: 1.1245415156401535
Energy: 1.202164233661986
Energy: 1.2277247886796983
Energy: 1.1133862746563774
Energy: 1.2277247886852627
Energy: 1.0886684549666734
Energy: 1.19017670607291
Energy: 1.2202401496236268
Energy: 1.190176706073705
Energy: 1.098581276164535
Energy: 1.2543635997471547
Energy: 1.1029289534850768
Energy: 1.2543635968543139
Energy: 1.1158127079987041
Energy: 1.2076677044361503
Energy: 1.099608050075423
Energy: 1.2076677044369453
Energy: 1.1352291518709725
Energy: 1.1708947790671016
Energy: 1.1020136247419112
Energy: 1.1708947790631272
Energy: 1.1222019385174142
Energy: 1.1157272061622245
Energy: 1.0995345349002121
Energy: 1.1157272061614298
Energy: 1.092578105941348
Energy: 1.2667885910293106
Energy: 1.3154759208295734
Energy: 1.2667885910245413
Energy: 1.2373615541649043
Energy: 1.1903056647180341
Energy: 1.110332098423536
Energy: 1.190305664730752
Energy: 1.1040865500962247
Energy: 1.1894671213020152
Energy: 1.162656477483443
Energy: 1.1894671213004253
Energy: 1.1088788374244305
Energy: 1.24193802256402
Energy: 1.0994596892043786
Energy: 1.241938022563225
Energy: 1.1045889680470253
Energy: 1.1266540904544549
Energy: 1.101911439978441
Energy: 1.1266540904528652
Energy: 1.0951352086151056
Energy: 1.1818442155664395
Energy: 1.139846432828111
Energy: 1.1818442155616704
Energy: 1.1001823351331375
Energy: 1.3218059358457763
Energy: 1.1133312365121597
Energy: 1.3218059358425969
Energy: 1.0883357468214683
Energy: 1.12317974002619
Energy: 1.1847528082263719
Energy: 1.1231797400238055
Energy: 1.2716799365425577
Energy: 1.1916120411100535
Energy: 1.1015636668794389
Energy: 1.1916120411060789
Energy: 1.17505115559214
Energy: 1.1705132536403022
Energy: 1.2436652934935157
Energy: 1.1705132536387126
Energy: 1.155351506871836
Energy: 1.1707695242505753
Energy: 1.0997951360747267
Energy: 1.1707695242489855
Energy: 1.095007656730575
Energy: 1.2608822972660882
Energy: 1.1055560409304293
Energy: 1.2608822972724472
Energy: 1.0857272550191794
Energy: 1.2226392436998512
Energy: 1.108214871711255
Energy: 1.2226392437006461
Energy: 1.1328465907321785
Energy: 1.177371039386248
Energy: 1.1215630352024697
Energy: 1.1773710393838637
Energy: 1.096103766101181
Energy: 1.1234515295029694
Energy: 1.126375381002641
Energy: 1.1234515295005851
Energy: 1.3014725726393788
Energy: 1.115085043981528
Energy: 1.1059712082958337
Energy: 1.1150850439807332
Energy: 1.0959782414814616
Energy: 1.123512240909073
Energy: 1.1724848740906415
Energy: 1.1235122409074831

minimum gb energy = 1.0857272550191794 eV
minimum distance =  2.20210441989535 Angstroms
sigma value = 29


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

Energy: 1.0724611826804213
Energy: 1.0588884232428095
Energy: 1.0744014637797907
Energy: 1.0588884232425326
Energy: 1.0420982656945563
Energy: 1.0753951032999527
Energy: 1.074415899187846
Energy: 1.0753951033018598
Energy: 1.0409750361740049
Energy: 1.1523533397230332
Energy: 1.0408356842415547
Energy: 1.1523533397230332
Energy: 1.074403930162872
Energy: 1.0417885815441847
Energy: 1.0744832054732016
Energy: 1.0417885815436618
Energy: 1.0720148071175994
Energy: 1.1276931775503467
Energy: 1.142993773994031
Energy: 1.1276931775503467
Energy: 1.0329856701035485
Energy: 1.1566113073169584
Energy: 1.0328223771988605
Energy: 1.1566113073174813
Energy: 1.0415209761018611
Energy: 1.1287837756109693
Energy: 1.071978184077987
Energy: 1.1287837756106924
Energy: 1.0744461753097674
Energy: 1.0419151887277898
Energy: 1.0743787777454183
Energy: 1.0419151887275129
Energy: 1.0406479405887872
Energy: 1.1523455130448232
Energy: 1.0323936197808483
Energy: 1.1523455130472535

minimum gb energy = 1.0323936197808483 eV
minimum distance =  2.28232532214697 Angstroms
sigma value = 5


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

Energy: 1.0378671466228533
Energy: 1.0366935853910901
Energy: 1.1732766035966118
Energy: 1.0366935853925918
Energy: 1.0056889862286904
Energy: 1.0967668874381657
Energy: 0.9900607639947144
Energy: 1.0967668874381657
Energy: 0.9875713713420275
Energy: 1.0335027577709974
Energy: 1.1611445567802754
Energy: 1.0335027577755027
Energy: 0.9981991677924034
Energy: 1.0869719721099749
Energy: 1.0214026505367213
Energy: 1.0869719721099749
Energy: 1.007405904579002
Energy: 1.0887788649260584
Energy: 1.180484856480268
Energy: 1.0887788649268093
Energy: 1.0237620424720209
Energy: 1.0458964075590216
Energy: 1.0055638704065228
Energy: 1.0458964075620252
Energy: 1.0094486329215848
Energy: 1.0981353832253113
Energy: 1.0065795180394188
Energy: 1.098135383221557
Energy: 1.008456827908773
Energy: 1.050455281881814
Energy: 0.9887798738930557
Energy: 1.0504552818833157
Energy: 1.0262734296802978
Energy: 1.0357468248446668
Energy: 1.0028925332973464
Energy: 1.0357468248484212
Energy: 1.0247192392763824
Energy: 1.084848337815032
Energy: 1.0008137885757584
Energy: 1.08484833781353
Energy: 0.9806461063451154
Energy: 1.0497513755909422
Energy: 0.9917105375352145
Energy: 1.0497513755939458
Energy: 0.9873337298912995
Energy: 1.2077349764033654
Energy: 1.125987928310861
Energy: 1.207734976400362
Energy: 1.0347805684523808
Energy: 1.0442905068786976
Energy: 1.042145762561178
Energy: 1.044290506875694
Energy: 1.0017249734634333
Energy: 1.0441203459933133
Energy: 1.0660655459503319
Energy: 1.044120345988808
Energy: 1.097282497619564
Energy: 0.9982332800865377
Energy: 0.9914692805402158
Energy: 0.998233280131589
Energy: 1.015648872791336
Energy: 1.1919978783249998
Energy: 1.1615679040328928
Energy: 1.1919978783340097
Energy: 1.0269237791010222
Energy: 1.0074391189055765
Energy: 0.9898588636592476
Energy: 1.0074391189018221
Energy: 1.0059792449895923
Energy: 1.0440173645748425
Energy: 1.0838497207032882
Energy: 1.0440173645770952
Energy: 1.0026768615680026
Energy: 1.1013665146396767
Energy: 1.007045456491226
Energy: 1.1013665146374243
Energy: 0.9872083363299884
Energy: 1.0765763446096923
Energy: 1.047658819685356
Energy: 1.076576344610443
Energy: 0.9854830212350776
Energy: 1.0463589819249723
Energy: 1.0241164434550147
Energy: 1.0463589819257233
Energy: 1.0065677172750869
Energy: 1.0828917428142157
Energy: 1.02303979228591
Energy: 1.0828917428074583
Energy: 0.994168572683288
Energy: 1.0465427908670304
Energy: 0.9857937093500231
Energy: 1.0465427908662794
Energy: 1.1321753733625217
Energy: 1.0444188348346868
Energy: 0.9879190064055484
Energy: 1.0444188348376902
Energy: 1.1294313997618848
Energy: 1.0284275085932726
Energy: 0.9907714953466393
Energy: 1.0284275085925216
Energy: 1.0297089616242303
Energy: 1.044400221353981
Energy: 1.007715196160357
Energy: 1.0444002213592367
Energy: 0.997439974940665
Energy: 1.074015971822251
Energy: 1.091973267012958
Energy: 1.0740159718199986
Energy: 1.0237359355639506
Energy: 1.0874749857749817
Energy: 1.0163456301467844
Energy: 1.0874749857749817
Energy: 0.9878576323868068
Energy: 1.0063035380690317
Energy: 1.0196945116879483
Energy: 1.006303538072786
Energy: 1.1826712291750892
Energy: 1.0439772563438643
Energy: 1.007385573758946
Energy: 1.0439772563438643
Energy: 0.9963481836852363
Energy: 1.029612621521507
Energy: 1.0939704792516
Energy: 1.0296126215305172
Energy: 1.177776194097809
Energy: 1.0599659219197999
Energy: 0.9871738507642682
Energy: 1.0599659219265574
Energy: 1.0190068297925885
Energy: 1.0878598007798044
Energy: 0.980321603104999
Energy: 1.087859800777552

minimum gb energy = 0.980321603104999 eV
minimum distance =  2.22534944457979 Angstroms
sigma value = 1


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

Energy: 0.9970416693202309
Energy: 0.994452451776628
Energy: 0.9735025111622981
Energy: 0.9944524517745515
Energy: 0.9910117604235764
Energy: 1.0080124402987234
Energy: 0.9475610917066823
Energy: 1.008012440302876
Energy: 0.9233275926919601
Energy: 0.9939039965670138
Energy: 1.2854856526829308
Energy: 0.9939039965607847
Energy: 0.9591786081496217
Energy: 1.0563958398439433
Energy: 0.9538200059219338
Energy: 1.0563958398429052
Energy: 0.9243164798161654
Energy: 1.0879945068595474
Energy: 1.1385895176448464
Energy: 1.0879945068595474
Energy: 0.9298680245823081
Energy: 1.0011042311965088
Energy: 0.9494050074829948
Energy: 1.0011042311996234
Energy: 0.9234459570877701
Energy: 1.0886331613533937
Energy: 0.969262841755692
Energy: 1.0886331613565083
Energy: 0.9235270599287597
Energy: 1.002300452423423
Energy: 0.9899077310526172
Energy: 1.0023004524213466
Energy: 0.9939406305453218
Energy: 0.9909858513566149
Energy: 0.9779673628814654
Energy: 0.9909858513566149
Energy: 0.9938554560313204
Energy: 0.9909456447579568
Energy: 0.9821308535836385
Energy: 0.9909456447589714
Energy: 0.9235283006948196
Energy: 1.0023319275641098
Energy: 0.9898464653385411
Energy: 1.0023319275630718
Energy: 0.9234163393769674
Energy: 1.0885825095840092
Energy: 0.9643506614404738
Energy: 1.088582509581933
Energy: 0.9298555353921468
Energy: 1.0010366588876614
Energy: 0.9494025906766792
Energy: 1.001036658886623
Energy: 0.92373289272781
Energy: 1.0879756486701626
Energy: 1.0995036222983958
Energy: 1.0879756486680863
Energy: 0.9591703662844422
Energy: 1.0563795277796422
Energy: 0.9538173059318431
Energy: 1.0563795277786039
Energy: 0.9233222912475691
Energy: 0.9939885943507537
Energy: 1.0127543348215031
Energy: 0.9939885943528302
Energy: 0.9909955590364189
Energy: 1.0080269894155842
Energy: 0.9476497795248673
Energy: 1.0080269894114313
Energy: 0.9970416693202309
Energy: 0.9944524517776662
Energy: 1.1380914029949218
Energy: 0.9944524517745515
Energy: 0.991011760426691
Energy: 1.0080124402997614
Energy: 0.9475610917077205
Energy: 1.008012440301838
Energy: 0.9233275926929982
Energy: 0.9939039965659755
Energy: 1.2854856526829308
Energy: 0.9939039965607847
Energy: 0.9591786081465071
Energy: 1.0563958398439433
Energy: 0.9538200059219338
Energy: 1.0563958398439433
Energy: 0.9243164798172036
Energy: 1.0879945068585093
Energy: 1.138589517643808
Energy: 1.0879945068595474
Energy: 0.9298680245812699
Energy: 1.0011042311954708
Energy: 0.9494050074829948
Energy: 1.0011042311996234
Energy: 0.9234459570856938
Energy: 1.0886331613533937
Energy: 0.9692628417588066
Energy: 1.0886331613565083

minimum gb energy = 0.9233222912475691 eV
minimum distance =  2.25219955548588 Angstroms
sigma value = 17


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

Energy: 0.9793577822942869
Energy: 0.9767137387299644
Energy: 1.1334744590223678
Energy: 0.9767137387312477
Energy: 1.1279720335583567
Energy: 0.9616848356214578
Energy: 0.9343714585037484
Energy: 0.9616848356246662
Energy: 0.933981256864676
Energy: 0.9643840616147182
Energy: 1.1633560163414527
Energy: 0.9643840616134932
Energy: 0.97104647255654
Energy: 1.1289220569028169
Energy: 0.9354182627619759
Energy: 1.1289220569028169
Energy: 0.9272934254286626
Energy: 1.0392846617631266
Energy: 1.1666077143395468
Energy: 1.0392846617605598
Energy: 0.9172075790582587
Energy: 0.9491550933148031
Energy: 0.9510320193259527
Energy: 0.9491550933353369
Energy: 0.9383456297899108
Energy: 1.0240234006032924
Energy: 0.9863075651979593
Energy: 1.0240234006013675
Energy: 0.9209304857586522
Energy: 1.1512183179932138
Energy: 0.9269215939536538
Energy: 1.151218317997706
Energy: 0.9813578981458264
Energy: 0.9569715937289336
Energy: 0.9687960230996598
Energy: 0.9569715937212335
Energy: 0.9844735347279788
Energy: 0.95693353502607
Energy: 0.9370835954462388
Energy: 0.9569335350331284
Energy: 0.9382717887579574
Energy: 0.9329665237893684
Energy: 0.9256705375309084
Energy: 0.9329665237887267
Energy: 0.9394733098990218
Energy: 1.012812108939422
Energy: 0.9252266646754632
Energy: 1.012812108943914
Energy: 0.9170708507860931
Energy: 0.9514101640190853
Energy: 0.9352294976625959
Energy: 0.9514101639607507
Energy: 0.9230867784774727
Energy: 1.0384209937649505
Energy: 1.0003275690632971
Energy: 1.0384209937649505
Energy: 0.9275026524147134
Energy: 0.9403189490791315
Energy: 0.9867604504870859
Energy: 0.9403189490746399
Energy: 0.9434584414216611
Energy: 0.9654992951910796
Energy: 1.1674659131293166
Energy: 0.9654992951917214
Energy: 0.9489628428871838
Energy: 0.9370426913812618
Energy: 0.9351916594660161
Energy: 0.9370426913825451
Energy: 0.9301286872184081
Energy: 0.9772058099662546
Energy: 0.9406318954293081
Energy: 0.9772058099681796
Energy: 1.0748813497182133
Energy: 1.016940263884877
Energy: 0.935024072511374
Energy: 1.016940263888727
Energy: 0.9454968272379657
Energy: 0.9645418373449303
Energy: 0.9695592370891344
Energy: 0.9645418373468552
Energy: 1.0930346290305357
Energy: 0.9534354188189011
Energy: 0.9354997064156084
Energy: 0.9534354188176177
Energy: 0.9353943057135049
Energy: 1.0118089294571124
Energy: 0.9352787625047807
Energy: 1.0118089294577541
Energy: 1.0733511670719509
Energy: 0.9422775583282583
Energy: 0.9493624269557517
Energy: 0.9422775583327501
Energy: 0.9365153321382369
Energy: 1.025571479044341
Energy: 1.0898241912532007
Energy: 1.0255714790456245
Energy: 0.9565158699031785
Energy: 0.9779633265363951
Energy: 0.9316305428857236
Energy: 0.9779633265338282
Energy: 0.9363994381803459
Energy: 1.0403323498109913
Energy: 0.9581659523845277
Energy: 1.040332349811633
Energy: 1.069426688693027
Energy: 0.9986099918497222
Energy: 0.9373811278252642
Energy: 0.9986099918510056
Energy: 0.9908248159703354
Energy: 0.9400760136545624
Energy: 0.9259940315591564
Energy: 0.9400760136577706
Energy: 0.9757171487124143
Energy: 1.0382452068925472
Energy: 0.9238922947533308
Energy: 1.0382452068931889
Energy: 0.9366834669142582
Energy: 0.9499844026063479
Energy: 0.9666607759551484
Energy: 0.9499844026108396
Energy: 0.9238327002494673
Energy: 1.0382046625559311
Energy: 0.9351301188834912
Energy: 1.0382046625552894
Energy: 0.9259142457806131
Energy: 0.935371301507828
Energy: 0.9408778601570519
Energy: 0.9353713015084696
Energy: 0.9375629231148328
Energy: 1.0078092567694505
Energy: 1.1001872738034009
Energy: 1.0078092567662422
Energy: 0.9698846638958976
Energy: 0.9573841006107994
Energy: 0.9554233841666013
Energy: 0.9573841006127243
Energy: 0.9267593477701039
Energy: 0.9778903791439735
Energy: 0.9585488919265107
Energy: 0.9778903791426903
Energy: 0.9888132820632938
Energy: 1.0254929086607987
Energy: 0.9371619117502504
Energy: 1.0254929086614404
Energy: 0.9494084903935601
Energy: 0.9502349813888515
Energy: 0.9177736581705422
Energy: 0.9502351296497407
Energy: 0.9433863206151463
Energy: 1.0407780542997775
Energy: 0.9359393111148314
Energy: 1.0407780542997775

minimum gb energy = 0.9170708507860931 eV
minimum distance =  2.23324835206143 Angstroms
sigma value = 89


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

Energy: 0.8649097186664443
Energy: 0.8634446340746157
Energy: 1.1017955946428875
Energy: 0.8634446340746157
Energy: 0.8661607000063167
Energy: 0.892924303721043
Energy: 0.8743923672144068
Energy: 0.892924303721043
Energy: 0.8715822365019433
Energy: 1.0197825364944895
Energy: 1.2099245313036422
Energy: 1.0197825364928106
Energy: 0.8523612687708723
Energy: 0.8929396966224106
Energy: 0.8750538051633491
Energy: 0.8929396966224106
Energy: 0.8636357303624875
Energy: 0.9521515297998595
Energy: 0.8756319272675427
Energy: 0.9521515297981806
Energy: 0.8651336696531866
Energy: 0.8648608551582858
Energy: 0.865979587419134
Energy: 0.8648608551582858
Energy: 0.8716901105162883
Energy: 1.018329679064466
Energy: 0.8654281583934164
Energy: 1.0183296790661067
Energy: 0.8549674630600711
Energy: 1.0178286032008343
Energy: 0.8745009760300679
Energy: 1.0178286032008343
Energy: 0.8638138893419472
Energy: 0.9523235739431429
Energy: 0.8548777696721789
Energy: 0.9523235739431429
Energy: 0.8924651070543663
Energy: 0.9512850665332044
Energy: 0.8654809605228839
Energy: 0.9512850665315257
Energy: 0.8619580844609118
Energy: 0.8938025237616306
Energy: 0.8649740546453192
Energy: 0.8938025237616306
Energy: 0.8730032810762565
Energy: 1.0192651937132469
Energy: 0.8728770577082741
Energy: 1.0192651937132469
Energy: 0.8639144477395813
Energy: 0.8676867027992005
Energy: 0.8526957172630728
Energy: 0.8676867028008795
Energy: 0.8655405871383903
Energy: 0.9532560410241457
Energy: 0.8653648282850961
Energy: 0.9532560410258246
Energy: 0.8541415355839791
Energy: 0.8676527384605262
Energy: 0.864015593382816
Energy: 0.8676527384588472

minimum gb energy = 0.8523612687708723 eV
minimum distance =  2.28824822033578 Angstroms
sigma value = 13


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

Energy: 0.9232698932792055
Energy: 0.9704340806359026
Energy: 1.0280210412295634
Energy: 0.9704340806337914
Energy: 1.0322487090721824
Energy: 0.8369871552380866
Energy: 0.8001668515997981
Energy: 0.8369871552380866
Energy: 0.8267410036291793
Energy: 0.8166660861647871
Energy: 0.9666659862867987
Energy: 0.8166660861809725
Energy: 0.8342174714846878
Energy: 0.837336439897379
Energy: 0.8072973879710695
Energy: 0.8373364398980827
Energy: 0.8191735167208499
Energy: 1.0735856057864692
Energy: 0.8829790685202396
Energy: 1.073585605782951
Energy: 0.8025124312871413
Energy: 0.8373112371276121
Energy: 0.9012028745578633
Energy: 0.8373112371346173
Energy: 0.8191041334807084
Energy: 0.884241321857772
Energy: 1.2147747288975517
Energy: 0.8842413218584758
Energy: 0.7954954100112462
Energy: 0.8374152559336264
Energy: 0.9012276044261731
Energy: 0.8374152559251817
Energy: 0.8171672665990676
Energy: 0.8927708890575007
Energy: 1.0643408415911182
Energy: 0.8927708890652416
Energy: 0.9688901485596907
Energy: 0.8991057691774913
Energy: 0.8074947745369826
Energy: 0.899105769178195
Energy: 0.8283773363051496
Energy: 0.8992656211947255
Energy: 0.8102529673820957
Energy: 0.8992656211841696
Energy: 1.1513503064857824
Energy: 0.8991547716485117
Energy: 0.8069396920200924
Energy: 0.8991547716534378
Energy: 0.8496025604422927
Energy: 0.8232875523409244
Energy: 0.8045980368509876
Energy: 0.8232875523317762
Energy: 1.0996561192825345
Energy: 0.8994901897171966
Energy: 0.8065218223215187
Energy: 0.8994901897164929
Energy: 0.8285419478468026
Energy: 0.8171731289365889
Energy: 0.8030711602121509
Energy: 0.8171731289281443
Energy: 0.8966130517881651
Energy: 0.8996502924238219
Energy: 0.8134116624267593
Energy: 0.8996502924266367
Energy: 0.8210815472917251
Energy: 0.8161235245249916
Energy: 0.8123195136881132
Energy: 0.816123524513732
Energy: 0.820380578155259
Energy: 0.8820346846741774
Energy: 0.9071692835125346
Energy: 0.8820346846769922
Energy: 0.8198692465694449
Energy: 0.8823322705441838
Energy: 0.9071445056447082
Energy: 0.8823322705441838
Energy: 0.8195249954846349
Energy: 0.9837399907301784
Energy: 0.9076209267992993
Energy: 0.9837399907273635
Energy: 0.8201130717966497
Energy: 0.8919937578795145
Energy: 0.9068798609125757
Energy: 0.8919937578752921
Energy: 0.8164623819661574
Energy: 0.8169810972871845
Energy: 0.810406062448834
Energy: 0.8169810972780361
Energy: 0.8972680049852327
Energy: 0.8995489147815274
Energy: 0.8118640455816726
Energy: 0.8995489147836386
Energy: 0.828452219934762
Energy: 0.8167031965310748
Energy: 0.8010918444188587
Energy: 0.8167031965360009
Energy: 1.1352070540936388
Energy: 0.8991873850898072
Energy: 0.8043274985432043
Energy: 0.8991873850835059
Energy: 0.9270310483131022
Energy: 0.9820973075707016
Energy: 0.8008052478623148
Energy: 0.9820973075707016
Energy: 1.084213881768246
Energy: 0.8991367988353915
Energy: 0.8004720827269914
Energy: 0.8991367988297618
Energy: 0.8283457269930242
Energy: 0.8994925693647323
Energy: 0.8099232453856035
Energy: 0.899492569365436
Energy: 0.886358674898587
Energy: 1.0091450749734394
Energy: 0.8078360651889687
Energy: 1.0091450749734394
Energy: 0.8191803075302403
Energy: 0.8841223439035839
Energy: 1.0163266046989161
Energy: 0.8841223439071023
Energy: 0.794786671220243
Energy: 0.8371667036729383
Energy: 0.9012060781761664
Energy: 0.8371667036876842
Energy: 0.8190137491295654
Energy: 0.8840460687642435
Energy: 1.1367439199410936
Energy: 0.8840460687642435
Energy: 0.8156388570218905
Energy: 0.8377970316294349
Energy: 0.901149652830964
Energy: 0.8377970316259162
Energy: 0.8195509645546164
Energy: 1.1655126890696261
Energy: 1.028630722816613
Energy: 1.1655126890773349
Energy: 0.8848076378836278
Energy: 0.8370582740574388
Energy: 0.807781689229456
Energy: 0.8370582740560314

minimum gb energy = 0.794786671220243 eV
minimum distance =  2.31428466830333 Angstroms
sigma value = 37


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

Energy: 0.9099167484774109
Energy: 0.9071693237894256
Energy: 0.7317962188924932
Energy: 0.9071693237906363
Energy: 0.8824404419237386
Energy: 0.7722766136066536
Energy: 0.7296693550579832
Energy: 0.7722766136078368
Energy: 0.7670366709897857
Energy: 0.8741647055131541
Energy: 1.026993954626503
Energy: 0.8741647055119433
Energy: 0.8487616428380177
Energy: 0.7727481170164424
Energy: 0.7468332616069797
Energy: 0.7727481170176532
Energy: 0.7464488139024892
Energy: 0.7721829330868291
Energy: 0.7578365382070943
Energy: 0.7721829330892506
Energy: 0.7386799101748459
Energy: 0.7723559968077883
Energy: 0.8629490256187745
Energy: 0.772355996808999
Energy: 0.7557362491835478
Energy: 1.3342066179182221
Energy: 1.087657021931147
Energy: 1.33420661791459
Energy: 0.7282819086672535
Energy: 0.7737570239329067
Energy: 0.7717110384086961
Energy: 0.7737570239353282
Energy: 0.7427147005996672
Energy: 0.7718843614822467
Energy: 0.9690394320409532
Energy: 0.7718843614798253
Energy: 1.0325240870734915
Energy: 0.8660050742500729
Energy: 0.862561079098095
Energy: 0.8660050742512836
Energy: 0.7614129049679917
Energy: 1.2632552971419875
Energy: 0.8486805153357214
Energy: 1.26325529714562
Energy: 1.0394752120523598
Energy: 0.7728106501087709
Energy: 0.7463779358509701
Energy: 0.7728106501075603
Energy: 0.8627218894470935
Energy: 0.7718758409355153
Energy: 0.7325886091525673
Energy: 0.7718758409355153
Energy: 1.088543321626622
Energy: 0.8090268711205294
Energy: 0.7285049411744692
Energy: 0.8090268711217401
Energy: 0.9069103759136228
Energy: 0.9185230183941319
Energy: 0.7298150860211973
Energy: 0.9185230183929212
Energy: 0.9092688895863132
Energy: 0.7723804756884898
Energy: 0.7321367303894961
Energy: 0.7723804756884898
Energy: 0.8628101934029166
Energy: 0.8651629214824663
Energy: 0.7267910012754348
Energy: 0.8651629214812555
Energy: 0.8497636132410284
Energy: 0.8386965404740824
Energy: 0.7437537161575561
Energy: 0.8386965404740824
Energy: 0.746223769784626
Energy: 0.7746351130040414
Energy: 0.7429468791067455
Energy: 0.7746351130040414
Energy: 0.7428785363994167
Energy: 0.772798971531484
Energy: 0.8527457397471472
Energy: 0.7727989715326947

minimum gb energy = 0.7267910012754348 eV
minimum distance =  2.32848869124175 Angstroms
sigma value = 25


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

Energy: 0.704912089122034
Energy: 0.6627142481048998
Energy: 0.6499661753272785
Energy: 0.6627142481048998
Energy: 1.0139282345920986
Energy: 0.6800917711647566
Energy: 0.6640848629525173
Energy: 0.6800917711647566
Energy: 0.6617048208702042
Energy: 0.6609122662751211
Energy: 1.14810310148319
Energy: 0.6609122662741757
Energy: 0.8263989138900028
Energy: 0.6800222622780139
Energy: 0.6645338773308302
Energy: 0.6800222056228639
Energy: 0.6635081888127845
Energy: 0.6801390391251199
Energy: 0.6386597621812027
Energy: 0.6801390391307924
Energy: 0.6383198113835953
Energy: 0.6796351546397807
Energy: 0.6640822564756544
Energy: 0.6796350569984393
Energy: 0.6658648313807602
Energy: 0.6606564085129932
Energy: 0.8276024526187123
Energy: 0.6606564085158294
Energy: 0.6346138203166146
Energy: 0.7029048384005094
Energy: 0.6629235154935453
Energy: 0.7029048384005094
Energy: 0.6634498125026245
Energy: 0.680195162233379
Energy: 0.9958265756851089
Energy: 0.6801951622295973
Energy: 0.6385609187359618
Energy: 1.11457660010085
Energy: 0.7059153578512348
Energy: 1.1145766000999044
Energy: 0.6658458131711954
Energy: 0.6607948814275443
Energy: 1.0137153918240458
Energy: 0.6607948814265988
Energy: 0.8878673734251863
Energy: 1.1732763857914328
Energy: 0.662908833503126
Energy: 1.1732763857933235
Energy: 0.663510880860612
Energy: 0.6801686228355363
Energy: 0.8283110220274434
Energy: 0.6801686228449904
Energy: 0.8809991497959133
Energy: 0.7357966550926863
Energy: 0.664037697541774
Energy: 0.7357966552505271
Energy: 0.6658838827170911
Energy: 0.6606870980005205
Energy: 0.6387108764408321
Energy: 0.6606870979995751
Energy: 0.8676531805765659
Energy: 0.7799122292923963
Energy: 0.6636248251093039
Energy: 0.7799122292999597
Energy: 0.6637237539629415
Energy: 0.7026457523178088
Energy: 0.6344039042426785
Energy: 0.7026457523178088
Energy: 0.8568996979747122
Energy: 1.135940301929844
Energy: 0.6641732092000061
Energy: 1.1359403019317351
Energy: 0.7062763847058602
Energy: 0.6607186342560308
Energy: 0.6390643687714548
Energy: 0.6607186342569762
Energy: 1.0200500621988828
Energy: 0.7798378021316681
Energy: 0.663575613006798
Energy: 0.7798378021297773
Energy: 0.6637017048341121
Energy: 0.7768761308962365
Energy: 0.6347452333489257
Energy: 0.7768761308962365
Energy: 0.6602274267293177
Energy: 0.6801459078622731
Energy: 0.6642651804077915
Energy: 0.6801459078603823
Energy: 0.6659928182730175
Energy: 0.735280767463236
Energy: 0.88163404226672
Energy: 0.7352807674774172
Energy: 0.641411307427787
Energy: 0.7802403134349033
Energy: 0.6635351385206227
Energy: 0.7802403134358488
Energy: 0.6634559215396905
Energy: 0.7766033922183673
Energy: 0.8652169596824442
Energy: 0.7766033922164765
Energy: 0.6385093313564683
Energy: 0.7029396653479186
Energy: 0.666397263697715
Energy: 0.7029396653479186

minimum gb energy = 0.6344039042426785 eV
minimum distance =  2.3355971364704 Angstroms
sigma value = 41


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

Energy: 0.9081214221784024
Energy: 0.6105767427970119
Energy: 0.867538029303567
Energy: 0.6105767428016625
Energy: 1.0224104867741626
Energy: 0.5967568908985224
Energy: 0.5892551822538387
Energy: 0.5967568908977472
Energy: 0.6104591527135889
Energy: 0.586685246097577
Energy: 0.5775277002559978
Energy: 0.5866852460991272
Energy: 0.8830771980919452
Energy: 0.8374886181294992
Energy: 0.5891288819505343
Energy: 0.8374972704136606
Energy: 0.5858068048217532
Energy: 0.7742025108952333
Energy: 0.5854044558762619
Energy: 0.7742025108665551
Energy: 0.732167862609041
Energy: 0.5972178233546651
Energy: 0.589072386275415
Energy: 0.5972190209528192
Energy: 0.5885843224488755
Energy: 0.5970016125063371
Energy: 0.5918552457344997
Energy: 0.5970016125125378
Energy: 0.5731920968862161
Energy: 0.6102179231548214
Energy: 0.58649174259247
Energy: 0.6102179231540464
Energy: 0.5910426095417217
Energy: 1.0392625872636676
Energy: 0.9932217551454922
Energy: 1.0392625872636676
Energy: 0.5775489392584808
Energy: 0.5868155394556526
Energy: 0.6111965979614995
Energy: 0.5868151427111551
Energy: 0.5884567037129455
Energy: 0.9988081986045941
Energy: 1.0305181785272985
Energy: 0.9988081985976185
Energy: 0.5731031278037989
Energy: 0.9945893530133009
Energy: 0.9086391659320139
Energy: 0.994589353014851
Energy: 0.5910927815611345
Energy: 0.6105900258187636
Energy: 1.0945912444171044
Energy: 0.6105900258265144
Energy: 0.7808574282459112
Energy: 0.6760258426564383
Energy: 0.6112217638870961
Energy: 0.6760258426564383
Energy: 0.5885187833898142
Energy: 0.5971498214119059
Energy: 0.8839956018385726
Energy: 0.5971498214095806
Energy: 0.7788185575865683
Energy: 1.0448166667281102
Energy: 0.5865202002792478
Energy: 1.0448166667281102
Energy: 0.5911038771529019
Energy: 0.6125442994333697
Energy: 0.7306377022359544
Energy: 0.6125442994333697
Energy: 0.774321149749375
Energy: 0.674826458329652
Energy: 0.5892428102218517
Energy: 0.674826458328877
Energy: 0.5884742015328972
Energy: 0.6101096724574525
Energy: 0.5734373704961925
Energy: 0.6101096724574525
Energy: 0.7758278465552093
Energy: 1.0302947806377518
Energy: 0.5901437023504313
Energy: 1.030294780634687
Energy: 0.6127253062928197
Energy: 0.6109699907378775
Energy: 0.5705694665155276
Energy: 0.6109699907378775
Energy: 1.0280095619067462
Energy: 0.6261161891265078
Energy: 0.5893064884606062
Energy: 0.6261161891265078
Energy: 0.9101417497225115
Energy: 0.6096673899352968
Energy: 0.5736730515517603
Energy: 0.6096673899430476
Energy: 0.9122906919555981
Energy: 1.0385352713370513
Energy: 0.5901077453294188
Energy: 1.0385352713370513
Energy: 0.6131593602509442
Energy: 0.6741904591616757
Energy: 0.5761243157963836
Energy: 0.6741904591616757
Energy: 0.8919832110241366
Energy: 0.6259946673120265
Energy: 0.5893851271181588
Energy: 0.6259946673112513
Energy: 0.5884769095625246
Energy: 1.0254351965771105
Energy: 0.7763610287088709
Energy: 1.0254351965825008
Energy: 0.5852075663833581
Energy: 0.6108840908683243
Energy: 0.5901625256446011
Energy: 0.6108840908683243
Energy: 0.5911892843668756
Energy: 0.6744904308296832
Energy: 0.771115054873126
Energy: 0.6744904308296832
Energy: 0.5813470789497261
Energy: 0.6452659664148626
Energy: 0.5914141859519673
Energy: 0.6452659664156377
Energy: 0.5922790261982317
Energy: 1.0333362337638217
Energy: 0.7765560619837342
Energy: 1.0333362337630465
Energy: 0.5733661959997186
Energy: 0.610285798820583
Energy: 0.6155139783012534
Energy: 0.6102857988221332

minimum gb energy = 0.5705694665155276 eV
minimum distance =  2.32207483215953 Angstroms
sigma value = 15


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

Energy: 0.8172585485769095
Energy: 0.5493841551624603
Energy: 0.9982533728276294
Energy: 0.5493841551631169
Energy: 1.0342163898409034
Energy: 0.5466848079924989
Energy: 0.5483000707462957
Energy: 0.5466848079931554
Energy: 0.5683562192322963
Energy: 0.546407091884593
Energy: 1.088414226116148
Energy: 0.5464070918826232
Energy: 0.9190616931831227
Energy: 0.5477449450888606
Energy: 0.5482337389835487
Energy: 0.547744945088204
Energy: 0.5461193478155443
Energy: 0.5504608876579602
Energy: 0.5375877782973101
Energy: 0.550460887651394
Energy: 0.8003550405391854
Energy: 0.9458594130693303
Energy: 0.5481050662337991
Energy: 0.945859413068017
Energy: 0.5477220563508195
Energy: 0.556733274732252
Energy: 0.5389438098925513
Energy: 0.5567332765410175
Energy: 0.6752193843292222
Energy: 0.5571575410694788
Energy: 0.5482449818619846
Energy: 0.5571575410688223
Energy: 0.5494202812946004
Energy: 0.5579765334856791
Energy: 0.7458732522399678
Energy: 0.5579765334883056
Energy: 0.5377251413252192
Energy: 0.5473538697841985
Energy: 0.5466512778267706
Energy: 0.547353869783542
Energy: 0.547872979346913
Energy: 0.5475016574646897
Energy: 0.9513606380389842
Energy: 0.5475016574476776
Energy: 0.535918759354919
Energy: 0.8859861525605146
Energy: 0.5687867177381712
Energy: 0.885986152559858
Energy: 0.5494137083362955
Energy: 0.5579517651457544
Energy: 1.0342611550067133
Energy: 0.5579517651470677
Energy: 0.5356621065910937
Energy: 0.5491067119342133
Energy: 0.8177122319898152
Energy: 0.5491067119342133
Energy: 0.547826815267875
Energy: 0.547065001333537
Energy: 1.0318701807009765
Energy: 0.5470650013289408
Energy: 0.7050394998538038
Energy: 0.8898000783998854
Energy: 0.5687833310187593
Energy: 0.889800078400542
Energy: 0.5495409564237285
Energy: 0.5571954303453902
Energy: 0.9162843235167524
Energy: 0.5571954303460467
Energy: 0.7032648714102165
Energy: 0.7735675479497608
Energy: 0.5465363524384101
Energy: 0.7735675479477908
Energy: 0.5478869778503057
Energy: 0.5465439118582139
Energy: 0.7996034585355243
Energy: 0.5465439118569008
Energy: 0.701330196073999
Energy: 0.9347816816522323
Energy: 0.5481358373236385
Energy: 0.9347816816515757
Energy: 0.5495270756595426
Energy: 0.5681807404792045
Energy: 0.687517816267629
Energy: 0.5681807404811743
Energy: 0.6973818342634315
Energy: 0.556758549407491
Energy: 0.551311048045496
Energy: 0.5567585494068344
Energy: 0.5477865068663524
Energy: 0.546657810613498
Energy: 0.5343077493575539
Energy: 0.546657810613498
Energy: 0.9513662915380623
Energy: 0.7379833196679578
Energy: 0.5484463593379753
Energy: 0.7472050094272271
Energy: 0.5701821907755653
Energy: 0.567972112620109
Energy: 0.5366855306886993
Energy: 0.5679721126148563
Energy: 0.9278670208089276
Energy: 0.5569491876822478
Energy: 0.5513708561816805
Energy: 0.5569491876842175
Energy: 0.818961111838907
Energy: 0.5467441043000398
Energy: 0.5334893312214057
Energy: 0.5467441043006964
Energy: 1.0301427456634908
Energy: 0.9319883172938979
Energy: 0.5481677854576656
Energy: 0.9319883172938979
Energy: 0.5701107142432716
Energy: 0.620920173914994
Energy: 0.5247180481285832
Energy: 0.6209201739130241
Energy: 0.8099961256187791
Energy: 0.5567573688874795
Energy: 0.551408464547306
Energy: 0.5567573688861663
Energy: 0.5478346317705172
Energy: 0.5996345178600032
Energy: 0.7012157542948694
Energy: 0.5996345178639428
Energy: 0.798042350044032
Energy: 0.5463558204516991
Energy: 0.5482702880908121
Energy: 0.5463558204530122
Energy: 0.5495175584946824
Energy: 0.6249045219345276
Energy: 0.6986173843825145
Energy: 0.624904521933871
Energy: 0.5308045616719724
Energy: 0.5682890995255614
Energy: 0.5512431044590088
Energy: 0.5682890995255614
Energy: 0.5427465174836023
Energy: 0.5997491096354498
Energy: 0.7053878147745036
Energy: 0.5997491096347932
Energy: 0.535102575538317
Energy: 0.5464269039099049
Energy: 0.5499984397192351
Energy: 0.5464269039092482
Energy: 0.5494719794947452
Energy: 0.6212221619732722
Energy: 0.9475886954052094
Energy: 0.6212221619752419

minimum gb energy = 0.5247180481285832 eV
minimum distance =  2.32551073534529 Angstroms
sigma value = 85


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

Energy: 0.7722772436943333
Energy: 0.5357376918867398
Energy: 0.5526016035547191
Energy: 0.5357376918861704
Energy: 1.1271447012543723
Energy: 0.5331128362715176
Energy: 0.5000862469315163
Energy: 0.5331128362709482
Energy: 0.7368994834457051
Energy: 0.533246391758338
Energy: 0.4639729364856997
Energy: 0.533246391758338
Energy: 0.9087125846905348
Energy: 0.5331055539772807
Energy: 0.5001279345295156
Energy: 0.5331055539755721
Energy: 0.5328631325878584
Energy: 0.4990986762386611
Energy: 0.46538484650873807
Energy: 0.4990986762375222
Energy: 0.8040427744608638
Energy: 0.5335894253797512
Energy: 0.50025788785262
Energy: 0.5335894253786123
Energy: 0.49883593482017013
Energy: 0.6530186430563615
Energy: 0.49240277978707936
Energy: 0.6530186430575005
Energy: 0.6984167501429246
Energy: 0.875435918902287
Energy: 0.5002125639040387
Energy: 0.8754359189028564
Energy: 0.4998772892346425
Energy: 0.6181859850121402
Energy: 0.6141179064564333
Energy: 0.6181859852039494
Energy: 0.5884908047438625
Energy: 0.5522050076600901
Energy: 0.4992303030359186
Energy: 0.5522050074881868
Energy: 0.5010755985498163
Energy: 0.5331220495737495
Energy: 0.8039174531533735
Energy: 0.533122049575458
Energy: 0.4631290840646382
Energy: 0.5327293440243673
Energy: 0.5333978352344249
Energy: 0.5327293440243673
Energy: 0.4998837761727295
Energy: 0.5147537178396042
Energy: 0.9366856920261587
Energy: 0.5147537178384912
Energy: 0.46400464339005926
Energy: 0.5332726279606977
Energy: 0.737314543362315
Energy: 0.5332726279595588
Energy: 0.5010816258356243
Energy: 0.5331692872687166
Energy: 1.0161178291405757
Energy: 0.5331692872664388
Energy: 0.4632521013262249
Energy: 0.5358499803011951
Energy: 0.7728186900255825
Energy: 0.5358499803011951
Energy: 0.4998852990514955
Energy: 0.514677589121867
Energy: 1.015920121769654
Energy: 0.5146775891224364
Energy: 0.6179161581188687
Energy: 0.5332053489961945
Energy: 0.7373195710924452
Energy: 0.5332053490889929
Energy: 0.5011537122257741
Energy: 0.5331253067172079
Energy: 0.9085812919975997
Energy: 0.5331253067109438
Energy: 0.6134081497135639
Energy: 0.5357095864459799
Energy: 0.5333317594029515
Energy: 0.5357095864465493
Energy: 0.49985981291802706
Energy: 0.5147524184319334
Energy: 0.8043267477072891
Energy: 0.5147524184319334
Energy: 0.6109838144210129
Energy: 0.6344875985907863
Energy: 0.4991707065144289
Energy: 0.6344880118538226
Energy: 0.5010916198712617
Energy: 0.5324605030266991
Energy: 0.6984034501793009
Energy: 0.5324605030272686
Energy: 0.6213315746718371
Energy: 0.5536663185232329
Energy: 0.5001851551614358
Energy: 0.5536663185226633
Energy: 0.4999454744896194
Energy: 0.5322926547819218
Energy: 0.5902119061634429
Energy: 0.5322926547864775
Energy: 0.8380172699956744
Energy: 0.8573127263165178
Energy: 0.502049163201267
Energy: 0.8573127263148094
Energy: 0.5345300356708542
Energy: 0.5324019280880095
Energy: 0.46324772597297625
Energy: 0.532401928088579
Energy: 0.8508966971693683
Energy: 0.5542193723928696
Energy: 0.5001515296381939
Energy: 0.5542193723940084
Energy: 0.738286171871368
Energy: 0.841118736333979
Energy: 0.46405369888232917
Energy: 0.8411187363334095
Energy: 1.0160687426997532
Energy: 0.8747145186653265
Energy: 0.501860540521058
Energy: 0.8747145186658958
Energy: 0.7738900856173327
Energy: 0.53232502967177
Energy: 0.4633764734364873
Energy: 0.53232502967177
Energy: 0.9310385079844133
Energy: 0.5517815869392148
Energy: 0.5002692675904093
Energy: 0.5517815869375065
Energy: 0.7382991971214935
Energy: 0.8405215528691076
Energy: 0.46687088708048174
Energy: 0.840521552867399
Energy: 0.9085444286884051
Energy: 0.8698058324008408
Energy: 0.5020210425144733
Energy: 0.8698058324002713
Energy: 0.534663054503435
Energy: 0.5321772465970128
Energy: 0.6131323547068378
Energy: 0.5321772465970128
Energy: 0.7114563231091136
Energy: 0.5516367679404027
Energy: 0.5005248753212403
Energy: 0.5516367679409723
Energy: 0.5001314836372872
Energy: 0.634673375746683
Energy: 0.6110298509473249
Energy: 0.6346733757449747
Energy: 0.6971985155848002
Energy: 0.5323195405981788
Energy: 0.5016679941645263
Energy: 0.5323195405981788
Energy: 0.5012092101191539
Energy: 0.5323287414703218
Energy: 0.6216945385538614
Energy: 0.5323287414703218
Energy: 0.47523768472586964
Energy: 0.5724371158583736
Energy: 0.5015075199143794
Energy: 0.5724371158583736
Energy: 0.4998112552881576
Energy: 0.6344763787249851
Energy: 0.837975155488102
Energy: 0.634476378727263
Energy: 0.46325061177139065
Energy: 0.532250007181729
Energy: 0.5345685340818839
Energy: 0.532250007182868
Energy: 0.5010938987729759
Energy: 0.5322450955214644
Energy: 0.8503370917510483
Energy: 0.5322450955208949

minimum gb energy = 0.4631290840646382 eV
minimum distance =  2.34719935233118 Angstroms
sigma value = 113


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

Energy: 0.014713670138822937
Energy: 0.015401130382790918
Energy: 1.3062161833481296
Energy: 0.01540113038320438
Energy: 0.7240171735261405
Energy: 0.26449091629823185
Energy: 0.2640067473417961
Energy: 0.2644909162986696
Energy: 0.014713670138822937
Energy: 0.015401130382790918
Energy: 1.7574372984381164
Energy: 0.015401130382790918
Energy: 0.7240171735261405
Energy: 0.26449091629823185
Energy: 0.2640067473409448
Energy: 0.2644909162986696
Energy: 0.014713670138822937
Energy: 0.015401130382790918
Energy: 0.7239130112698691
Energy: 0.015401130382790918
Energy: 0.7240171735261405
Energy: 0.26449091629823185
Energy: 0.26400674734135826
Energy: 0.2644909162986696

minimum gb energy = 0.014713670138822937 eV
minimum distance =  2.55725171507407 Angstroms
sigma value = 1