Model name: model_name=EAM_Dynamo_GolaPastewka_2018_CuAu__MO_426403318662_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=3.613580609858036
cohesive_energy=3.5410050524536607
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: 4.99999999981074e-06 eV

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

Energy: 0.013706628643318496
Energy: 0.014432063316859242
Energy: 0.014432063316859242
Energy: 0.014432063317486952
Energy: 0.014432063316859242
Energy: 0.7738351850549237
Energy: 0.014432063317486952
Energy: 0.7738351850549237
Energy: 0.7738351850549237
Energy: 0.014432063316859242
Energy: 0.013706628643318496
Energy: 0.014432063317486952
Energy: 0.014432063317486952
Energy: 0.7738351850549237
Energy: 0.014432063316859242
Energy: 0.7738351850549237

minimum gb energy = 0.013706628643318496 eV
minimum distance =  2.46748076473258 Angstroms
sigma value = 1


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

Energy: 0.9717336234816691
Energy: 0.9336693959877078
Energy: 0.8975596133359721
Energy: 0.9336693959877078
Energy: 0.8873398897108588
Energy: 0.9565429445382319
Energy: 0.8779525681527365
Energy: 0.9565429445427994
Energy: 0.8221881963877505
Energy: 0.9202106780157936
Energy: 0.8774769145894191
Energy: 0.9202106780150322
Energy: 0.8697407797805738
Energy: 0.9364973973213898
Energy: 0.8591316024253172
Energy: 0.9364973973191061
Energy: 0.8720043184218398
Energy: 0.9275115747930652
Energy: 0.8717121056960994
Energy: 0.9275115747907815
Energy: 0.8359328708026972
Energy: 0.9117883585583743
Energy: 0.8436562719546232
Energy: 0.9117883585598968
Energy: 0.8844918725226584
Energy: 0.9139315596784202
Energy: 0.8540668297226939
Energy: 0.9139315596768975
Energy: 0.8002485052737367
Energy: 0.9267691006803442
Energy: 0.8399381904575713
Energy: 0.926769100682628
Energy: 0.8569308603450023
Energy: 0.9269648796687304
Energy: 0.8703933912116385
Energy: 0.9269648796649239
Energy: 0.8475650494565452
Energy: 0.9140659546526309
Energy: 0.7930258056885245
Energy: 0.9140659546556759
Energy: 0.8704473945451888
Energy: 0.9183698471535159
Energy: 0.8569715431246403
Energy: 0.9183698471542772
Energy: 0.8439428048919194
Energy: 0.9266431330188009
Energy: 0.8595570544913762
Energy: 0.9266431330157558
Energy: 0.8771896712230174
Energy: 0.9197147289639342
Energy: 0.8847468965810957
Energy: 0.919714728957844
Energy: 0.8773160375557785
Energy: 0.9212132425346554
Energy: 0.8426558846224692
Energy: 0.9212132425384617
Energy: 0.8701424074234806
Energy: 0.9274986963970026
Energy: 0.8701417320226794
Energy: 0.9274986963977637
Energy: 0.8733961171913087
Energy: 0.9330537545857926
Energy: 0.8703854851767283
Energy: 0.9330537545842702
Energy: 0.8769255301614811
Energy: 0.9206549647915753
Energy: 0.8261375213123712
Energy: 0.9206549647915753
Energy: 0.8823291821553004
Energy: 0.9203159288400377
Energy: 0.8816311855484016
Energy: 0.9203159288369925
Energy: 0.78180653412615
Energy: 0.9262180879491674
Energy: 0.8598123027023026
Energy: 0.9262180879506898
Energy: 0.8772773128640883
Energy: 0.9096639412649679
Energy: 0.870429659610646
Energy: 0.9096639412604348
Energy: 0.8463596913343109
Energy: 0.9141845160292501
Energy: 0.7924026688015177
Energy: 0.9141845160300114
Energy: 0.8557177901329596
Energy: 0.9258204162521705
Energy: 0.8666427923811801
Energy: 0.9258204162506479
Energy: 0.8713466196422421
Energy: 0.9271664469898836
Energy: 0.8461318553442689
Energy: 0.927166446988361
Energy: 0.8413478689603142
Energy: 0.9160183499391423
Energy: 0.8357297072263341
Energy: 0.9160183499383812
Energy: 0.8371088099067351
Energy: 0.9218768470875075
Energy: 0.8845206072340613
Energy: 0.9218768470867463
Energy: 0.8679685823066636
Energy: 0.9267939507139125
Energy: 0.8074155483451373
Energy: 0.9267939507131512
Energy: 0.868015420409277
Energy: 0.9259648710649301
Energy: 0.8566545395013014
Energy: 0.9259648710656913
Energy: 0.8028453626914287
Energy: 0.9203688005216817
Energy: 0.876937981467522
Energy: 0.9203688005239655
Energy: 0.8830139218821178
Energy: 0.9145730665267192
Energy: 0.8757035747336976
Energy: 0.9145730665267192
Energy: 0.8921678038057311
Energy: 0.9336775515634458
Energy: 0.8659774063176676
Energy: 0.9336775515596393
Energy: 0.8843393707073433
Energy: 0.9266105634248523
Energy: 0.8771288537044409
Energy: 0.9266105634339876
Energy: 0.8551030992986685
Energy: 0.9205576871721616
Energy: 0.8774552457893197
Energy: 0.9205576871721616
Energy: 0.8722894192013435
Energy: 0.9354236193032298
Energy: 0.8563836066326818
Energy: 0.9354236193024684

minimum gb energy = 0.78180653412615 eV
minimum distance =  2.29543101092289 Angstroms
sigma value = 1


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

Energy: 1.0467733450340926
Energy: 0.9996380965150535
Energy: 0.9486697563574916
Energy: 0.9996380965124495
Energy: 0.9174384746510279
Energy: 0.9707864623569292
Energy: 0.9139557331586843
Energy: 0.9707864623551934
Energy: 0.8651083311306719
Energy: 0.9893106735826468
Energy: 0.9201938713355226
Energy: 0.9893106735817789
Energy: 0.8985002139969246
Energy: 0.9376595710125131
Energy: 0.8788309480230095
Energy: 0.9376595710116451
Energy: 0.8985427746081796
Energy: 0.9720734078692618
Energy: 0.8936995246182634
Energy: 0.9720734078683938
Energy: 0.927798193815302
Energy: 0.9742167173549352
Energy: 0.8918752331513663
Energy: 0.9742167173566711
Energy: 0.9080605033598806
Energy: 0.9690431729196314
Energy: 0.8874350957271543
Energy: 0.9690431729204992
Energy: 0.8327521826308563
Energy: 0.9903589232859588
Energy: 0.862551272507996
Energy: 0.9903589232850908
Energy: 0.8823154538704971
Energy: 0.925813282207975
Energy: 0.9115881427508854
Energy: 0.9258132822071071
Energy: 0.9062383117513733
Energy: 0.9906551889081948
Energy: 0.8651158250187283
Energy: 0.9906551889090627
Energy: 0.9078706850444108
Energy: 0.9957123588701324
Energy: 0.9075952423873436
Energy: 0.9957123588718684
Energy: 0.8904882311449993
Energy: 0.9804054964520997
Energy: 0.9203867905302008
Energy: 0.9804054964503637
Energy: 0.9268576286308012
Energy: 0.9716727569816792
Energy: 0.8938531901199579
Energy: 0.9716727569860192
Energy: 0.9266594189069515
Energy: 0.9663515039317163
Energy: 0.9059850291304109
Energy: 0.9663515039343203
Energy: 0.865302413862424
Energy: 0.9887116715991445
Energy: 0.9196270677491046
Energy: 0.9887116715991445
Energy: 0.9082290469757806
Energy: 0.962698082694946
Energy: 0.9170000029261116
Energy: 0.962698082694078
Energy: 0.9061938079316875
Energy: 0.9906930581712837
Energy: 0.8337304597814416
Energy: 0.9906930581695477
Energy: 0.8967669296589942
Energy: 1.0143029767955474
Energy: 0.911891260291091
Energy: 1.0143029767946794
Energy: 0.8327103152990964
Energy: 0.9897010065391842
Energy: 0.8626114543176749
Energy: 0.9897010065409201
Energy: 0.895683338890743
Energy: 0.9379910248784238
Energy: 0.8690494870862917
Energy: 0.9379910248801598
Energy: 0.904480722410682
Energy: 0.973746367187045
Energy: 0.8625160914384778
Energy: 0.973746367187045
Energy: 0.8983642615580616
Energy: 0.9735619593606993
Energy: 0.8811341217569156
Energy: 0.9735619593589633
Energy: 0.8983679099907104
Energy: 0.9381445085401638
Energy: 0.8872419769231918
Energy: 0.9381445085427679
Energy: 0.8461330726586573
Energy: 0.9898963115575347
Energy: 0.9204895292256124
Energy: 0.9898963115610067
Energy: 0.9058128644335813
Energy: 0.9785951226335885
Energy: 0.9137670665508365
Energy: 0.9785951226379284
Energy: 1.0467733450332248
Energy: 0.9996380965133175
Energy: 0.9486604389551948
Energy: 0.9996380965098455
Energy: 0.91743847465016
Energy: 0.9707864623569292
Energy: 0.9139557331560805
Energy: 0.9707864623551934
Energy: 0.8651083311306719
Energy: 0.9893106735835149
Energy: 0.9201938713329186
Energy: 0.9893106735817789
Energy: 0.8985002139977927
Energy: 0.9376595710133812
Energy: 0.8742794701373092
Energy: 0.9376595710133812

minimum gb energy = 0.8327103152990964 eV
minimum distance =  2.28203052836107 Angstroms
sigma value = 25


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

Energy: 1.0023218927750344
Energy: 1.0450349935735241
Energy: 1.007195681993687
Energy: 1.045034993574533
Energy: 0.9789672350953907
Energy: 0.9827922825090741
Energy: 0.9590310404352244
Energy: 0.9827922825110921
Energy: 0.9232475569512578
Energy: 1.0659612939372085
Energy: 0.9604085451076724
Energy: 1.0659612939372085
Energy: 0.9507655078237899
Energy: 1.0101485370895853
Energy: 0.9098056299438648
Energy: 1.0101485370936212
Energy: 0.9361697689102783
Energy: 1.0380039912478156
Energy: 0.9601676892212546
Energy: 1.0380039912478156
Energy: 0.9876292068943632
Energy: 1.066414651698298
Energy: 0.9567914438425221
Energy: 1.066414651699307
Energy: 0.9356475185642548
Energy: 0.986167543269349
Energy: 0.9320208103754357
Energy: 0.9861675432723761
Energy: 0.9864143532313219
Energy: 1.0390894519391742
Energy: 0.8945652978742461
Energy: 1.0390894519401832
Energy: 0.9319785583668455
Energy: 1.0145629396296618
Energy: 0.9357183649379858
Energy: 1.0145629396306708
Energy: 0.961232041780825
Energy: 1.0662340304221734
Energy: 0.9448043252323466
Energy: 1.0662340304231823
Energy: 0.9220011331694997
Energy: 1.0377049773413924
Energy: 0.935091378557205
Energy: 1.0377049773413924
Energy: 0.9102701923811846
Energy: 1.0428548257299706
Energy: 0.9352767033381271
Energy: 1.0428548257269434
Energy: 0.9603782220982399
Energy: 1.0561149520795938
Energy: 0.9160524231009481
Energy: 1.0561149520806028
Energy: 0.9576901178117426
Energy: 0.9345872680958264
Energy: 0.9698018876165956
Energy: 0.9345872680968353
Energy: 0.8997701034646445
Energy: 1.0384208432035078
Energy: 0.8931508953642274
Energy: 1.0384208432024986
Energy: 0.9352663216539678
Energy: 0.988966336617631
Energy: 0.909238628456961
Energy: 0.988966336617631
Energy: 0.8787544052735559
Energy: 1.0660637932093975
Energy: 0.8773866930549687
Energy: 1.0660637932073795
Energy: 0.9094168647897433
Energy: 1.040020866332502
Energy: 0.9467370989019671
Energy: 1.040020866332502
Energy: 0.9519220252881829
Energy: 1.0421019096246478
Energy: 0.9105731089978946
Energy: 1.0421019096256567
Energy: 0.9100426711718201
Energy: 1.0659313600088773
Energy: 0.9584210723061488
Energy: 1.0659313600088773
Energy: 0.9421871745561362
Energy: 0.9849670666981312
Energy: 0.9580562940643113
Energy: 0.984967066697122
Energy: 0.9831625682289855
Energy: 1.0470891067188643
Energy: 0.9989828609222865
Energy: 1.0470891067188643
Energy: 0.9538910743281527
Energy: 1.0302449321129494
Energy: 0.9586628707864483
Energy: 1.0302449321129494
Energy: 0.9008003206594435
Energy: 1.0662741638652045
Energy: 0.9612704983896636
Energy: 1.0662741638652045
Energy: 0.935535177463846
Energy: 1.0105960633801272
Energy: 0.9087796546473234
Energy: 1.0105960633801272

minimum gb energy = 0.8773866930549687 eV
minimum distance =  2.28022104527338 Angstroms
sigma value = 9


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

Energy: 1.0769982875580701
Energy: 1.0845679084037545
Energy: 1.0730695519476143
Energy: 1.0845679084037545
Energy: 0.9750595312707154
Energy: 1.0678315651838286
Energy: 0.9837372022492092
Energy: 1.067831565182625
Energy: 0.9042724116571812
Energy: 1.007092372846273
Energy: 1.0114527086293295
Energy: 1.007092372846273
Energy: 1.0074066572542475
Energy: 1.0881648716033792
Energy: 0.923803022149448
Energy: 1.0881648716021755
Energy: 1.0345920587339652
Energy: 1.067946945623555
Energy: 0.9999901874112118
Energy: 1.0679469456247588
Energy: 0.9264011579251978
Energy: 1.0072825867819688
Energy: 0.9156031413775408
Energy: 1.0072825867831727
Energy: 1.0037609536644847
Energy: 0.9237770560301939
Energy: 0.9248716414785154
Energy: 0.9237770560301939
Energy: 0.9465711281126317
Energy: 1.0069995997502006
Energy: 0.9519708477487223
Energy: 1.0069995997514043
Energy: 1.003096270499924
Energy: 1.0681297440873814
Energy: 0.9844787498496629
Energy: 1.068129744088585
Energy: 1.008713830413073
Energy: 1.0843633259279
Energy: 0.9235211929048408
Energy: 1.0843633259279
Energy: 0.9337227220828249
Energy: 1.0759628306230324
Energy: 1.0154787261318563
Energy: 1.0759628306218287
Energy: 1.0053547650779622
Energy: 1.033355777399055
Energy: 0.92401008063222
Energy: 1.0333557773966475
Energy: 0.9268438715347774
Energy: 1.0117237130905348
Energy: 0.8945465117163731
Energy: 1.0117237130893313
Energy: 0.971439946406677
Energy: 0.9946026959370492
Energy: 0.9967529380879804
Energy: 0.9946026959454749
Energy: 0.926916797354219
Energy: 1.0119173424284245
Energy: 0.9681053697652393
Energy: 1.0119173424260173
Energy: 1.0058769533656162
Energy: 1.011840899039054
Energy: 0.9237008277312533
Energy: 1.0118408990366468
Energy: 1.0098118072155133
Energy: 1.0669022932361585
Energy: 0.9840319413105854
Energy: 1.0669022932373624
Energy: 0.9990758080298964
Energy: 1.0847456993838354
Energy: 0.9238077571261435
Energy: 1.0847456993838354
Energy: 1.002462459647291
Energy: 1.058720251104925
Energy: 0.9846041784248476
Energy: 1.058720251104925
Energy: 0.9883436358125446
Energy: 1.007055757596944
Energy: 0.9517166261254493
Energy: 1.007055757596944
Energy: 1.0033776145377022
Energy: 1.0325711974750682
Energy: 0.9247440794748358
Energy: 1.0325711974738647

minimum gb energy = 0.8945465117163731 eV
minimum distance =  2.2820469378754 Angstroms
sigma value = 25


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

Energy: 1.015684930263208
Energy: 1.1260091062187334
Energy: 1.1149306641278751
Energy: 1.1260091062187334
Energy: 0.944090632238696
Energy: 1.1300554351189285
Energy: 0.983561921849608
Energy: 1.130055435120417
Energy: 0.9334094190120479
Energy: 1.0237055131265265
Energy: 0.9881790321854551
Energy: 1.0237055074917512
Energy: 0.9582238745150593
Energy: 1.07787996158658
Energy: 1.0601698843382998
Energy: 1.0778799615850914
Energy: 1.0391242829363838
Energy: 0.9931663167373311
Energy: 0.9829347198904
Energy: 0.9931663167492397
Energy: 0.9861142035786765
Energy: 1.160965956012617
Energy: 0.9361683993609056
Energy: 1.1609659560111287
Energy: 0.9830836345125875
Energy: 1.077931921274613
Energy: 0.9329025427898503
Energy: 1.0779319212731246
Energy: 1.0588511527183815
Energy: 0.9341096903902504
Energy: 0.95775131501347
Energy: 0.9341096903932274
Energy: 0.9890417701838735
Energy: 1.1272723055527438
Energy: 1.0122262059961693
Energy: 1.1272723055512552
Energy: 1.065976452131805
Energy: 1.0232306495148806
Energy: 0.9349323864007804
Energy: 1.023230649513392
Energy: 0.9927101769113857
Energy: 1.1519832287674812
Energy: 1.1259800744836006
Energy: 1.1519832287659926
Energy: 0.9328752994510909
Energy: 0.9970026386111652
Energy: 1.0916550364504585
Energy: 0.9970026386111652
Energy: 0.9985118765019803
Energy: 1.0229932718502006
Energy: 0.9839175453909826
Energy: 1.0229932718502006
Energy: 1.0077012501848954
Energy: 0.9876420955102577
Energy: 0.9582808105019113
Energy: 0.9876420955147235
Energy: 1.002513653174491
Energy: 1.1234804201954809
Energy: 1.062725381497982
Energy: 1.1234804201954809
Energy: 0.9436815294305436
Energy: 0.9998114230399094
Energy: 0.9860696058290213
Energy: 0.9998114230399094
Energy: 0.9329486516311393
Energy: 1.0162281168619534
Energy: 1.0653371530389906
Energy: 1.0162281168589764

minimum gb energy = 0.9328752994510909 eV
minimum distance =  2.35062998381268 Angstroms
sigma value = 17


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

Energy: 1.1151954993403854
Energy: 1.114232179959845
Energy: 1.2130147843165817
Energy: 1.1142321799547863
Energy: 1.096960772258139
Energy: 1.0475084209824121
Energy: 0.9958617015724803
Energy: 1.0475084209807262
Energy: 1.077802435347131
Energy: 1.0588255028752325
Energy: 0.992763709370169
Energy: 1.0588255028752325
Energy: 0.9622864666560693
Energy: 1.0621535580163226
Energy: 1.0351177228621786
Energy: 1.062153558018852
Energy: 1.1555224392877723
Energy: 1.1940294011935202
Energy: 0.9608952684727011
Energy: 1.1940294011952064
Energy: 0.9999244551291586
Energy: 0.9958869089995201
Energy: 1.074574171735485
Energy: 0.9958869090012062
Energy: 0.9967173608386609
Energy: 1.1021826719440027
Energy: 0.9934631622167156
Energy: 1.1021826719456889
Energy: 1.0718251187335104
Energy: 1.0613079666170995
Energy: 1.0024340915941798
Energy: 1.0613079665774754
Energy: 0.975178226209939
Energy: 1.1070145105235738
Energy: 1.1070489619128265
Energy: 1.107014510526946
Energy: 1.170178005981211
Energy: 1.104472031350447
Energy: 0.9608322126731561
Energy: 1.104472031352133
Energy: 0.9905178207209236
Energy: 0.9752725792830945
Energy: 1.0810123265567038
Energy: 0.9752725792889959
Energy: 0.969929158356611
Energy: 1.0658131364659786
Energy: 0.9700275331681382
Energy: 1.065813136459234
Energy: 1.0930913092294907
Energy: 1.0593658293612764
Energy: 1.0591404254347665
Energy: 1.0593658293621198
Energy: 0.9932947432358114
Energy: 1.1329592086711704
Energy: 1.0899492327014828
Energy: 1.1329592086770717
Energy: 1.0289721317983571
Energy: 1.0701807457550383
Energy: 0.9744768806789564
Energy: 1.0701807457567243
Energy: 1.055124505768547
Energy: 1.0621019314934093
Energy: 1.0469026552142968
Energy: 1.0621019314942526
Energy: 0.9606663800075603
Energy: 1.09028757524967
Energy: 1.183229899299613
Energy: 1.0902875752505132
Energy: 1.1090416751023648
Energy: 1.1292696928689951
Energy: 0.9998886008757977
Energy: 1.129269692867309
Energy: 1.0009535617532574
Energy: 1.1460922220097731
Energy: 1.0404785276930755
Energy: 1.1460922220123022
Energy: 0.992917344399378
Energy: 1.0619727040545275
Energy: 0.9629329821424328
Energy: 1.0619727040503122
Energy: 1.0176685477935241
Energy: 1.0584116062921407
Energy: 1.0521263415580608
Energy: 1.058411606295513
Energy: 0.9607692222276165
Energy: 1.1675276068411256
Energy: 1.1806138730223918
Energy: 1.167527606841969
Energy: 1.0571825010144749
Energy: 1.0632615074205323
Energy: 0.9871277975580139
Energy: 1.06326150741716
Energy: 1.0058561099938503
Energy: 1.1005333992656243
Energy: 1.0842289395435167
Energy: 1.1005333992622524
Energy: 1.0055432453563817
Energy: 1.0363335676131844
Energy: 1.0889249611803944
Energy: 1.0363335676131844
Energy: 1.0990755011249387
Energy: 1.0626083352555624
Energy: 0.9878898918601132
Energy: 1.0626083352580917
Energy: 0.9606179659700819
Energy: 1.1314320969142193
Energy: 1.2041902057179232
Energy: 1.13143209691169
Energy: 1.0487753101778594
Energy: 1.0291335778921538
Energy: 1.0528289050795951
Energy: 1.0291335778929969
Energy: 1.14474985515864
Energy: 1.102180611609394
Energy: 0.9649036917433226
Energy: 1.1021806116068649
Energy: 1.0026788379150058
Energy: 1.0884398679143137
Energy: 1.1113079139366924
Energy: 1.0884398679134706

minimum gb energy = 0.9606179659700819 eV
minimum distance =  2.25761113451789 Angstroms
sigma value = 53


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

Energy: 1.051681059001366
Energy: 1.048399750794447
Energy: 1.2183011775631334
Energy: 1.048399750794447
Energy: 1.1028518979975703
Energy: 1.0715021200846395
Energy: 1.025370999732284
Energy: 1.0715021200846395
Energy: 0.9226210010116962
Energy: 0.9207005381211454
Energy: 1.0433905228363596
Energy: 0.9207005381192044
Energy: 0.9224207864040188
Energy: 0.9212001306478506
Energy: 1.0435665073124885
Energy: 0.9212001306478506
Energy: 1.2085320144818255
Energy: 1.0255408852915648
Energy: 1.026995045045559
Energy: 1.025540885289624
Energy: 0.92185271985059
Energy: 0.920851957940685
Energy: 1.1684490202540478
Energy: 0.920851957940685
Energy: 1.0282399392375958
Energy: 1.0715021200846395
Energy: 1.02871255955292
Energy: 1.0715021200846395
Energy: 0.9226210010097554
Energy: 0.9207005381211454
Energy: 1.043390522834419
Energy: 0.9207005381192044
Energy: 0.9224207864040188
Energy: 0.9212001306497914
Energy: 1.0112591507547168
Energy: 0.9212001306497914
Energy: 1.2085320144837663
Energy: 0.9966302078706979
Energy: 1.0937158663510076
Energy: 0.9966302078706979
Energy: 1.0516810590033072
Energy: 1.0483997507963876
Energy: 1.218301257511287
Energy: 1.0483997507963876
Energy: 1.1028518979975703
Energy: 1.0715021200846395
Energy: 1.0117394782754496
Energy: 1.0715021200846395
Energy: 0.9226210010097554
Energy: 0.9207005381211454
Energy: 1.0433905228363596
Energy: 0.9207005381211454

minimum gb energy = 0.9207005381192044 eV
minimum distance =  2.32771557351534 Angstroms
sigma value = 9


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

Energy: 1.0179962866814578
Energy: 1.1526095380413401
Energy: 1.2804778669002697
Energy: 1.1526095380406218
Energy: 1.1376697800507007
Energy: 1.055513285269783
Energy: 1.014728898092735
Energy: 1.0555132852705016
Energy: 0.9968574101980726
Energy: 1.0070134109149682
Energy: 1.0140305866702364
Energy: 1.0070134109149682
Energy: 1.1044178591760192
Energy: 1.1795678537485634
Energy: 1.014453346664281
Energy: 1.1795678537507184
Energy: 1.125250390468833
Energy: 1.0593771014593654
Energy: 1.0106434708718157
Energy: 1.0593771014593654
Energy: 1.0073892466385752
Energy: 1.0065616802064934
Energy: 1.110291163778179
Energy: 1.0065616802064934
Energy: 1.2861605284709983
Energy: 1.0556273904667253
Energy: 1.0124547322730897
Energy: 1.0556273904660067
Energy: 1.0030683186752996
Energy: 1.220529057418967
Energy: 1.1149011267518651
Energy: 1.220529057418967
Energy: 0.9994187805331887
Energy: 1.1956234158232983
Energy: 1.0132805854260947
Energy: 1.1956234158240169
Energy: 0.9986611893744451
Energy: 1.0529060361829061
Energy: 1.0112699799790885
Energy: 1.0529060361836244
Energy: 1.00410621425727
Energy: 1.0712732137039527
Energy: 1.2702478314884298
Energy: 1.071273213702516
Energy: 1.130682123587748
Energy: 1.144513001226517
Energy: 1.0037717974509102
Energy: 1.144513001226517
Energy: 0.9989102841507831
Energy: 1.081471606602522
Energy: 1.197946084605932
Energy: 1.0814716066010852
Energy: 1.108501159799729
Energy: 1.1150266421743036
Energy: 1.0212976164592462
Energy: 1.1150266421183048
Energy: 1.0072095735120845
Energy: 1.1280025042601594
Energy: 1.1133010416363858
Energy: 1.1280025042615962
Energy: 1.0023682434060608
Energy: 1.184735932247233
Energy: 1.1071840196933724
Energy: 1.184735932246515
Energy: 1.0650614566679606
Energy: 1.128100351128477
Energy: 1.0062407860213813
Energy: 1.1281003511277587
Energy: 1.00708673397826
Energy: 1.055783852841424
Energy: 1.123825934115874
Energy: 1.0557838528407057
Energy: 1.1234032078196843
Energy: 1.0811935624766498
Energy: 1.0086998282135065
Energy: 1.0811935624766498
Energy: 1.0051798076004927
Energy: 1.0633933312905945
Energy: 1.0740750399830177
Energy: 1.063393331289158
Energy: 1.1093582422464823
Energy: 1.1728671841882914
Energy: 1.1059914417780665
Energy: 1.1728671841868548
Energy: 1.078496790310921
Energy: 1.115897528019614
Energy: 0.998387056096296
Energy: 1.1158975280203325
Energy: 1.0131910540774778
Energy: 1.1341137763940798
Energy: 0.998685148835035
Energy: 1.1341137763955165
Energy: 1.288867724856422
Energy: 1.0743679860634814
Energy: 1.0021912525955068
Energy: 1.0743679860634814
Energy: 1.012722602082889
Energy: 1.1577656560519298
Energy: 1.2157587539703993
Energy: 1.1577656560526484
Energy: 1.0621868163081283
Energy: 1.0073038627769033
Energy: 0.9974498881718631
Energy: 1.007303862776185
Energy: 1.070254233605746
Energy: 1.1315143162631736
Energy: 1.1036862929944944
Energy: 1.1315143162638917
Energy: 1.0253452335549327
Energy: 1.173409750181752
Energy: 1.1042325369481145
Energy: 1.1734097501774419
Energy: 1.059829105313444
Energy: 1.0068273213015406
Energy: 0.996807063222623
Energy: 1.0068273213015406
Energy: 1.0143977788136704
Energy: 1.156865416545159
Energy: 1.2164668596603923
Energy: 1.156865416545159
Energy: 1.2201571767049744
Energy: 1.0733951235812869
Energy: 1.0016679023612798
Energy: 1.0733951235812869
Energy: 1.014964746286624
Energy: 1.0569121343425656
Energy: 0.9975472023006486
Energy: 1.0569121343425656
Energy: 1.01504205957474
Energy: 1.1198510588800097
Energy: 0.9973606858755011
Energy: 1.1198510588800097
Energy: 1.1132297434034473
Energy: 1.175558754286455
Energy: 1.1042151175027437
Energy: 1.1755587542842996
Energy: 1.0114643423000438
Energy: 1.157334719927089
Energy: 1.2853900258645747
Energy: 1.1573347199278075

minimum gb energy = 0.996807063222623 eV
minimum distance =  2.28266522055446 Angstroms
sigma value = 73


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

Energy: 1.0881278780218624
Energy: 1.0840413879387834
Energy: 1.2368123074511819
Energy: 1.0840413879398973
Energy: 1.0797295921032957
Energy: 1.096127506147652
Energy: 1.0160691321038828
Energy: 1.0961275061499314
Energy: 1.0111089330345395
Energy: 1.014444087473917
Energy: 1.0131809373977032
Energy: 1.0144440874727771
Energy: 0.9987018582697922
Energy: 1.021120617641994
Energy: 1.0245841848123802
Energy: 1.021120617641994
Energy: 1.0561725000421318
Energy: 1.0923980783747458
Energy: 1.058786152279721
Energy: 1.0923980783747458
Energy: 1.0216080075839518
Energy: 1.01609059564779
Energy: 1.1788481672380637
Energy: 1.01609059564779
Energy: 1.2732648855002227
Energy: 1.1496719216416762
Energy: 1.0141944371528528
Energy: 1.1496719216416762
Energy: 1.004917291290612
Energy: 1.0120756283865526
Energy: 1.1919632620652167
Energy: 1.0120756283876924
Energy: 1.2347106376475803
Energy: 1.0129347095887962
Energy: 1.0151731151193122
Energy: 1.0129347095876566
Energy: 1.0119925132576688
Energy: 1.0822606984998677
Energy: 1.0121986973537755
Energy: 1.0822606985010075
Energy: 1.007910041852594
Energy: 1.0127833801251984
Energy: 1.1805316638563226
Energy: 1.0127833801240584
Energy: 1.1315372380916406
Energy: 1.0210647142340787
Energy: 0.9990368279241845
Energy: 1.0210647142340787
Energy: 1.0231088246962112
Energy: 1.078143515225691
Energy: 1.1899297611910482
Energy: 1.0781435152268306
Energy: 1.2144045601554587
Energy: 1.1421293157302561
Energy: 1.021753407011446
Energy: 1.1421293157313699
Energy: 1.0073432389115566
Energy: 1.1643644528399355
Energy: 1.1825606030374076
Energy: 1.1643644528399355
Energy: 1.1812094834899236
Energy: 1.0123331670901257
Energy: 1.0050433876793998
Energy: 1.0123331670901257
Energy: 1.078232906969128
Energy: 1.078290549171093
Energy: 1.0110511436775307
Energy: 1.0782905491699533
Energy: 1.0793221946281686
Energy: 1.021420133044231
Energy: 1.0112074544821004
Energy: 1.021420133044231
Energy: 1.009530463427153
Energy: 1.0126410185328487
Energy: 1.00384892124856
Energy: 1.0126410185317092
Energy: 1.0159744197864418
Energy: 1.101174804680478
Energy: 1.2238936708266712
Energy: 1.101174804680478
Energy: 1.2045686332657324
Energy: 1.0120853250884227
Energy: 1.0226940799837558
Energy: 1.0120853250895625
Energy: 1.024398453217952
Energy: 1.0924654719120777
Energy: 1.1347403125284288
Energy: 1.0924654719120777

minimum gb energy = 0.9987018582697922 eV
minimum distance =  2.28760393887001 Angstroms
sigma value = 7


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

Energy: 1.0416969216986205
Energy: 1.0404494797900143
Energy: 1.2799069881456195
Energy: 1.0404494797972677
Energy: 1.2470231196364052
Energy: 1.0768432382158597
Energy: 1.0186632463097134
Energy: 1.0768432382158597
Energy: 1.0124800679986938
Energy: 1.040159752078116
Energy: 1.0358007685632902
Energy: 1.040159752070863
Energy: 1.0355531228666057
Energy: 1.0988660264766192
Energy: 1.0182892465810036
Energy: 1.0988660264750074
Energy: 1.0129193637662035
Energy: 1.0801826870861686
Energy: 1.0360395355923933
Energy: 1.0801826870901983
Energy: 1.0104486384884435
Energy: 1.0410760266721069
Energy: 1.2141101649643178
Energy: 1.0410760266729129
Energy: 1.137255612215519
Energy: 1.1241601374329475
Energy: 1.033423611769418
Energy: 1.12416013743053
Energy: 1.0104708420593813
Energy: 1.0402913180922626
Energy: 1.246077258174646
Energy: 1.0402913180930686
Energy: 1.1428495836721941
Energy: 1.0876125025265388
Energy: 1.0196853450128016
Energy: 1.0876125025233152
Energy: 1.0110868951563843
Energy: 1.1029082410424174
Energy: 1.1228486968314657
Energy: 1.1029082410432232
Energy: 1.0368387281096771
Energy: 1.043102344328006
Energy: 1.036437203470678
Energy: 1.0431023443312297
Energy: 1.0460371900587695
Energy: 1.0804553568775375
Energy: 1.037070892260849
Energy: 1.0804553568743138
Energy: 1.0427191806076124
Energy: 1.0405463865471012
Energy: 1.0376902420402656
Energy: 1.0405463865471012
Energy: 1.0356271748846329
Energy: 1.0351892712890136
Energy: 1.0363721048324566
Energy: 1.0351892712833723
Energy: 1.009637491624328
Energy: 1.1840082432472203
Energy: 1.1445932158303749
Energy: 1.1840082432472203
Energy: 1.29928559716408
Energy: 1.0348174548720683
Energy: 1.0216950379488328
Energy: 1.0348174548728741
Energy: 1.0094384465923467
Energy: 1.080097121484599
Energy: 1.0690462594079966
Energy: 1.080097121482987
Energy: 1.027996499714034
Energy: 1.1765117187061096
Energy: 1.0368427346444584
Energy: 1.1765117187093335
Energy: 1.009805660227894
Energy: 1.0402781270834998
Energy: 1.037211508439414
Energy: 1.0402781270834998
Energy: 1.010828461709395
Energy: 1.081823369193758
Energy: 1.0371935823515626
Energy: 1.0818233691953698
Energy: 1.037215809402221
Energy: 1.1797527947927378
Energy: 1.0197674766205396
Energy: 1.1797527947879025
Energy: 1.0106142651628258
Energy: 1.0400822235055271
Energy: 1.12568770775835
Energy: 1.0400822235111684
Energy: 1.2281700189054179
Energy: 1.0878608133692078
Energy: 1.0330092427223123
Energy: 1.0878608133740066
Energy: 1.0414706694152542
Energy: 1.0406098804516997
Energy: 1.2135606474449856
Energy: 1.0406098804484762
Energy: 1.044708111778732
Energy: 1.0818976246558936
Energy: 1.027979273263795
Energy: 1.0818976246566994
Energy: 1.035689234936221
Energy: 1.0396970201687756
Energy: 1.0358831518244656
Energy: 1.0396970201687756
Energy: 1.0128836018635357
Energy: 1.1007209902740702
Energy: 1.0278004348337584
Energy: 1.100720990276488
Energy: 1.035551223075801
Energy: 1.0797088203924357
Energy: 1.0183494801004127
Energy: 1.079708820395659
Energy: 1.0117690456955368
Energy: 1.040928760418097
Energy: 1.1207880838226725
Energy: 1.0409287604205149
Energy: 1.0498957241224482
Energy: 1.0349427186314588
Energy: 1.0186359802137808
Energy: 1.0349427186322646
Energy: 1.0116161198212583
Energy: 1.041083153651756
Energy: 1.1910130426053072
Energy: 1.0410831536573975

minimum gb energy = 1.0094384465923467 eV
minimum distance =  2.28247741062818 Angstroms
sigma value = 29


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

Energy: 1.0553635285330263
Energy: 1.0695338325717094
Energy: 1.0834730632448444
Energy: 1.0695338325719903
Energy: 0.9697844988827493
Energy: 1.0033217211649874
Energy: 0.98560460660075
Energy: 1.0033217211669212
Energy: 1.0068996241411097
Energy: 1.0540250118350705
Energy: 1.0042762847150155
Energy: 1.054025011834821
Energy: 1.000331938406952
Energy: 1.0012831055639475
Energy: 0.9850563492452706
Energy: 1.001283105564478
Energy: 1.0145757169226477
Energy: 1.0698051114103257
Energy: 1.0048249693117337
Energy: 1.0698051114097646
Energy: 1.0007544386653797
Energy: 1.0494415382342284
Energy: 1.001142525950428
Energy: 1.0494415382342284
Energy: 1.0061734040709989
Energy: 0.9691652425027619
Energy: 0.9992656194549164
Energy: 0.9691652425022005
Energy: 1.0471065401354447
Energy: 1.0703586178896325
Energy: 1.0015444806838683
Energy: 1.070358617888541
Energy: 1.0837406755623344
Energy: 1.0545153603725592
Energy: 1.0071556934083494
Energy: 1.0545153603717483

minimum gb energy = 0.9691652425022005 eV
minimum distance =  2.32212489828761 Angstroms
sigma value = 5


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

Energy: 0.9777298991941858
Energy: 0.9750382911935614
Energy: 1.1255155165476889
Energy: 0.9750382911935614
Energy: 1.0972911116310506
Energy: 1.0204801980961582
Energy: 0.9259388820613118
Energy: 1.0204801980984421
Energy: 0.9356695908464447
Energy: 0.972634163715767
Energy: 1.106992808521373
Energy: 0.9726341637165283
Energy: 0.9386286839317237
Energy: 1.0124621244182654
Energy: 0.9544063260838231
Energy: 1.0124621244175043
Energy: 0.9448132918948589
Energy: 1.0208183462174985
Energy: 1.122872035846978
Energy: 1.0208183462129308
Energy: 0.9627152559454537
Energy: 0.9828593234907369
Energy: 0.9413973726359033
Energy: 0.9828593234869306
Energy: 0.9491459858983671
Energy: 1.0252482447687792
Energy: 0.941064154001046
Energy: 1.0252482447718243
Energy: 0.9459335203939863
Energy: 0.9846174778194189
Energy: 0.9377467547805894
Energy: 0.9846174778186576
Energy: 0.9624389245567688
Energy: 1.0159863589368596
Energy: 0.9466892639791896
Energy: 1.0159863589360982
Energy: 0.9590564422978651
Energy: 1.0135493851699633
Energy: 0.9387687262451381
Energy: 1.0135493851707245
Energy: 0.9295487368279324
Energy: 0.9841405431861467
Energy: 0.9370952777981507
Energy: 0.9841405431853855
Energy: 0.9361558944257453
Energy: 0.983538614376089
Energy: 1.076696780213152
Energy: 0.9835386143730439
Energy: 0.9743708838874606
Energy: 0.9809992216987689
Energy: 0.9834146537850516
Energy: 0.9809992216972464
Energy: 0.9437393743914647
Energy: 0.9816867875476551
Energy: 1.0143687494736262
Energy: 0.981686787546894
Energy: 1.196204328058396
Energy: 1.0142611997160997
Energy: 0.9372899022153859
Energy: 1.0142611997168611
Energy: 0.9569882601233792
Energy: 0.96468458475104
Energy: 1.1047059654941438
Energy: 0.9646845847525625
Energy: 1.1357768595332485
Energy: 1.0214919800143345
Energy: 0.9261201641440512
Energy: 1.0214919800166182
Energy: 0.9504291737292843
Energy: 0.9813380290904808
Energy: 1.0281443426544985
Energy: 0.9813380290927646
Energy: 0.9565776373522578
Energy: 1.0257216682525725
Energy: 0.9431366605932312
Energy: 1.02572166825105
Energy: 0.9329209870990639
Energy: 1.0165353178495244
Energy: 0.9812226190770152
Energy: 1.0165353178495244
Energy: 0.9245741383263317
Energy: 0.9828665357433238
Energy: 0.9560639313176836
Energy: 0.9828665357509366
Energy: 0.9504120068153141
Energy: 1.0163007554126284
Energy: 0.960915563760791
Energy: 1.0163007554126284
Energy: 0.9291902099795021
Energy: 0.9838782789768576
Energy: 0.9258706625785356
Energy: 0.9838782789776188
Energy: 1.0743330654834278
Energy: 0.9791869805222337
Energy: 0.9332093615926106
Energy: 0.979186980525279
Energy: 1.0702448405661287
Energy: 0.9630424909989997
Energy: 0.9262024391221284
Energy: 0.9630424909989997
Energy: 0.968130907965478
Energy: 0.9819017282468145
Energy: 0.9438134821111626
Energy: 0.981901728248337
Energy: 0.931564699805307
Energy: 1.0056608854157432
Energy: 1.041327222957683
Energy: 1.0056608854165046
Energy: 0.9704122200431884
Energy: 1.0012492392122154
Energy: 0.9556459905562685
Energy: 1.001249239211454
Energy: 0.936477364118366
Energy: 1.0194663321387605
Energy: 1.0275775036803112
Energy: 1.0194663321364767
Energy: 1.1185049165086962
Energy: 0.9807652559948603
Energy: 0.9492287146735077
Energy: 0.9807652559956216
Energy: 0.9343708750119818
Energy: 0.9682615636757995
Energy: 1.0320582218943453
Energy: 0.9682615636757995
Energy: 1.1240444801100016
Energy: 0.9980947544867256
Energy: 0.9353523814764997
Energy: 0.9980947544859641
Energy: 0.9543942235923938
Energy: 0.9839817257880991
Energy: 0.9274203841224724
Energy: 0.9839817257926667

minimum gb energy = 0.9245741383263317 eV
minimum distance =  2.28195473046407 Angstroms
sigma value = 1


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

Energy: 1.058752127698064
Energy: 0.9344671750560286
Energy: 0.9382065015358553
Energy: 0.9344671750570813
Energy: 0.9664497102222503
Energy: 0.9860849676823997
Energy: 0.887639363839505
Energy: 0.9860849676802944
Energy: 0.8944219804271706
Energy: 0.9360108711701779
Energy: 1.0582737688570878
Energy: 0.9360108711701779
Energy: 0.8981132029489962
Energy: 0.9844214697085394
Energy: 0.9108514392861685
Energy: 0.9844214697074869
Energy: 0.8789792103167974
Energy: 1.0207996659039489
Energy: 1.1075211575732826
Energy: 1.0207996659039489
Energy: 0.8770017625251925
Energy: 0.9392460997204828
Energy: 0.9108534417922212
Energy: 0.9392460997204828
Energy: 0.8938826791642345
Energy: 1.0238421612403068
Energy: 0.9219031462537586
Energy: 1.0238421612403068
Energy: 0.8947311182674097
Energy: 0.9389734400972244
Energy: 0.9249740169770367
Energy: 0.9389734400961717
Energy: 0.9349604046988985
Energy: 0.9371993522687148
Energy: 0.9104181795410005
Energy: 0.9371993522687148
Energy: 0.935002040642962
Energy: 0.9290587649049631
Energy: 0.9616407367757764
Energy: 0.9290587649060157
Energy: 0.8909505844733113
Energy: 0.9389972537353775
Energy: 0.9114485587062502
Energy: 0.9389972537353775
Energy: 0.8947016667607358
Energy: 1.02049274475562
Energy: 1.0406301350542657
Energy: 1.0204927447566725
Energy: 0.876731865013155
Energy: 0.939476679339731
Energy: 0.911013697427207
Energy: 0.9394766793407836
Energy: 0.8777042138303224
Energy: 0.934892407950571
Energy: 0.9373483203065059
Energy: 0.9348924079474132
Energy: 0.9228442092652779
Energy: 0.9874437706299948
Energy: 0.9106270007888122
Energy: 0.9874437706299948
Energy: 0.8944460478394002
Energy: 0.9360657525404997
Energy: 1.0586120735126308
Energy: 0.9360657525384185
Energy: 1.0423904841882292
Energy: 0.9490019476003986
Energy: 0.8881153990744506
Energy: 0.9490019476014512
Energy: 1.0587521276991165
Energy: 0.9344671750570813
Energy: 0.9382064945771114
Energy: 0.9344671750570813
Energy: 0.9664497102516989
Energy: 0.9860849676823997
Energy: 0.8876393638405576
Energy: 0.9860849676802944
Energy: 0.8944219804261179
Energy: 0.9360108711712303
Energy: 1.0582737688570878
Energy: 0.9360108711701779
Energy: 0.8981132029689953
Energy: 0.9844214697085394
Energy: 0.9108514392851159
Energy: 0.9844214697074869
Energy: 0.8789792103178499
Energy: 1.0207996659039489
Energy: 1.1075211575732826
Energy: 1.0207996659039489
Energy: 0.8770017625251925
Energy: 0.9392460997183776
Energy: 0.9108534417911684
Energy: 0.9392460997194303
Energy: 0.8938826791642345
Energy: 1.0238421612392543
Energy: 0.9219031462558637
Energy: 1.0238421612403068

minimum gb energy = 0.876731865013155 eV
minimum distance =  2.29328279453014 Angstroms
sigma value = 17


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

Energy: 0.9240929102813966
Energy: 0.9224824844522581
Energy: 1.0956900503917288
Energy: 0.9224824844535593
Energy: 1.043453997828043
Energy: 0.908562135194765
Energy: 0.8894929879113288
Energy: 0.908562135198018
Energy: 0.8854245891757816
Energy: 0.9117609355215412
Energy: 1.1089243094504309
Energy: 0.9117609355202402
Energy: 0.9219704400271918
Energy: 0.8830486007909538
Energy: 0.880510935593851
Energy: 0.8830486007870503
Energy: 0.8785244384438751
Energy: 0.9779372753521025
Energy: 0.8994636457734817
Energy: 0.977937275351452
Energy: 0.875372698032427
Energy: 0.8926397106432716
Energy: 0.8973500407791668
Energy: 0.892639710658235
Energy: 0.8906987696788022
Energy: 0.962372106838583
Energy: 0.9144500333964642
Energy: 0.9623721068379324
Energy: 0.8763095209467255
Energy: 0.9531824470304192
Energy: 0.8804905222970494
Energy: 0.9531824470258653
Energy: 0.9257496607252758
Energy: 1.0742959164615382
Energy: 0.9172552096999478
Energy: 1.0742959164595864
Energy: 0.9228062216188692
Energy: 0.9484152946380042
Energy: 0.8883765198231921
Energy: 0.948415294636703
Energy: 0.8855499636057801
Energy: 0.92698755142828
Energy: 0.8854190234091681
Energy: 0.9269875514263283
Energy: 0.8884508242341509
Energy: 0.9539720323223615
Energy: 0.8791345020857848
Energy: 0.953972032323012
Energy: 0.87339926816515
Energy: 0.9407832154231238
Energy: 0.8885165707381057
Energy: 0.940783215421172
Energy: 0.8851625985324485
Energy: 0.9767365662771997
Energy: 0.9416550248521597
Energy: 0.9767365662758987
Energy: 0.8742614848968494
Energy: 0.886259507004834
Energy: 0.9305456554286539
Energy: 0.886259506993774
Energy: 0.8853687733930247
Energy: 0.9132115905255314
Energy: 0.8984673686944251
Energy: 0.9132115905242301
Energy: 0.9036757993610792
Energy: 0.8857304527415285
Energy: 0.8883775344690052
Energy: 0.8857304527408778
Energy: 0.8813232388815776
Energy: 0.9233587516049019
Energy: 0.8907475674781041
Energy: 0.9233587516042513
Energy: 1.0298498253530606
Energy: 0.9562747705775992
Energy: 0.88720104878278
Energy: 0.9562747705769488
Energy: 0.8943013922205321
Energy: 0.9116269068289615
Energy: 0.9321175564331764
Energy: 0.9116269068289615
Energy: 0.8847846569375485
Energy: 0.9011527921046325
Energy: 0.883706385916034
Energy: 0.9011527921013797
Energy: 0.881962236207379
Energy: 0.9247425577341999
Energy: 1.0381484242275496
Energy: 0.9247425577355011
Energy: 0.9088965669277901
Energy: 0.8907913321060068
Energy: 0.8955684351542365
Energy: 0.8907913321053561
Energy: 0.8857601981001848
Energy: 0.964189867697548
Energy: 1.0445417129448913
Energy: 0.9641898676962467
Energy: 0.9081114505290444
Energy: 0.9236511673599878
Energy: 0.8826299739804225
Energy: 0.923651167359337
Energy: 0.8807095440801003
Energy: 0.978834239203286
Energy: 0.9028481970474407
Energy: 0.9788342392019849
Energy: 1.0367508014790792
Energy: 0.9402423176252662
Energy: 0.8863477527497549
Energy: 0.9402423176226639
Energy: 0.9341697523276441
Energy: 1.0572881538592889
Energy: 0.8738302225346466
Energy: 1.0572881538300127
Energy: 0.9375324502135528
Energy: 0.9766187321058859
Energy: 0.8796510864770857
Energy: 0.9766187321065365
Energy: 0.8805330102719291
Energy: 0.9397920778057046
Energy: 0.924984898056885
Energy: 0.9397920777978978
Energy: 0.8885954454079297
Energy: 0.9765567760578676
Energy: 0.8916786678290842
Energy: 0.976556776057217
Energy: 0.8737131141699415
Energy: 1.0544369033252283
Energy: 0.8825293686886007
Energy: 1.0544369033265295
Energy: 0.886732903697582
Energy: 0.9481636968573424
Energy: 1.0623355862779102
Energy: 0.9481636968573424
Energy: 0.9252804642177314
Energy: 1.0733762166538263
Energy: 0.8953076197716427
Energy: 1.0733762166544771
Energy: 0.8824718621525726
Energy: 0.9241256047320402
Energy: 0.9139178356503264
Energy: 0.9241256047307389
Energy: 0.9446809001633577
Energy: 0.9637712043209181
Energy: 0.888919824183576
Energy: 0.9637712043209181
Energy: 0.8956187656708006
Energy: 0.8930590198050972
Energy: 0.8776742908621956
Energy: 0.8930590197894832
Energy: 0.8982913830353451
Energy: 0.9792770116778816
Energy: 0.882048231410154
Energy: 0.9792770116752794

minimum gb energy = 0.87339926816515 eV
minimum distance =  2.28665832393871 Angstroms
sigma value = 89


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

Energy: 1.0119873904272096
Energy: 0.8374370236767956
Energy: 0.8418643718117861
Energy: 0.8374370236767956
Energy: 0.9849717266753771
Energy: 0.8377661606609135
Energy: 0.8333775759598561
Energy: 0.8377661606592112
Energy: 0.843875628335058
Energy: 0.9578918562713444
Energy: 1.1840701788459729
Energy: 0.9578918562713444
Energy: 0.8569994678270052
Energy: 0.8724491770797741
Energy: 0.8441595415627344
Energy: 0.8724491770797741
Energy: 0.8230613649309229
Energy: 0.8923620624659443
Energy: 0.8554197466484301
Energy: 0.8923620624693102
Energy: 0.8147116745597902
Energy: 0.8145026591444138
Energy: 0.8175929818350295
Energy: 0.8145026591444138
Energy: 0.8338023477642766
Energy: 0.9580762909334043
Energy: 0.8140901131503071
Energy: 0.9580762909351065
Energy: 0.8239897268747606
Energy: 0.9571892409558886
Energy: 0.8439881297725449
Energy: 0.9571892409558886
Energy: 0.8418832460691513
Energy: 0.8924191621447244
Energy: 0.8764948762385726
Energy: 0.8924191621447244
Energy: 0.8725038547223557
Energy: 1.025229434488766
Energy: 0.8153525304842484
Energy: 1.0252294344870638
Energy: 1.0127821718217276
Energy: 0.8414629961523821
Energy: 0.8223131148817355
Energy: 0.84146299615068
Energy: 1.0118831026752466
Energy: 0.9596117114050818
Energy: 0.832160556596382
Energy: 0.9596117114050818
Energy: 0.8443354196563834
Energy: 0.8159834733075154
Energy: 0.8085224609781115
Energy: 0.8159834733058132
Energy: 0.8432469836815647
Energy: 0.8905704012937061
Energy: 0.8397949717318045
Energy: 0.890570401292004
Energy: 0.8197203425944073
Energy: 0.8159396440037265
Energy: 0.8397510785380504
Energy: 0.8159396440037265

minimum gb energy = 0.8085224609781115 eV
minimum distance =  2.31148128819088 Angstroms
sigma value = 13


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

Energy: 0.8056695066944309
Energy: 0.7740558052848682
Energy: 0.9892327067966568
Energy: 0.7740558052848682
Energy: 0.9399653737531394
Energy: 0.793234098559141
Energy: 0.7687287175905726
Energy: 0.7932340985612814
Energy: 0.7755381046376579
Energy: 0.774490410829999
Energy: 0.9344931777315225
Energy: 0.7744904108307126
Energy: 0.7792719549041828
Energy: 0.7934093401197209
Energy: 0.7645271883096556
Energy: 0.7934093401197209
Energy: 0.7842471857990119
Energy: 0.8335015451867334
Energy: 0.7795593383722491
Energy: 0.8335015451824526
Energy: 0.7761897868841172
Energy: 0.7941579729932405
Energy: 0.7863901392840822
Energy: 0.7941579729868191
Energy: 0.7839981050816511
Energy: 0.8345702737197201
Energy: 0.8042286355620043
Energy: 0.834570273713299
Energy: 0.7708609001266136
Energy: 0.7935605591815031
Energy: 0.7865768545901868
Energy: 0.7935605591765088
Energy: 0.784278962466837
Energy: 0.8347737786168641
Energy: 0.920344433688616
Energy: 0.8347737786133616
Energy: 0.9320390703391677
Energy: 0.850525663550282
Energy: 0.7648535899340246
Energy: 0.8505256635559899
Energy: 0.7843057184666936
Energy: 0.8519446632265624
Energy: 0.7675647762512565
Energy: 0.8519446632265624
Energy: 1.04253686921288
Energy: 0.8507608959546783
Energy: 0.7639160182517193
Energy: 0.8507608959618131
Energy: 0.8140620268314925
Energy: 0.7891917105000424
Energy: 0.7689659834880138
Energy: 0.7891917104993289
Energy: 1.082800640329511
Energy: 0.8510606080939727
Energy: 0.7641496450153211
Energy: 0.8510606080911187
Energy: 0.7798753961518512
Energy: 0.7745741081749579
Energy: 0.7691505986055209
Energy: 0.7745741081728175
Energy: 0.7956220459345299
Energy: 0.8514390016141772
Energy: 0.768115619818696
Energy: 0.8514390016113232
Energy: 0.7874572029651451
Energy: 0.8296192157386602
Energy: 0.7684517011124887
Energy: 0.8296192157372332
Energy: 0.7814080971501949
Energy: 0.8322062248643393
Energy: 0.7948264086370469
Energy: 0.832206224872901
Energy: 0.7874946326786099
Energy: 0.7896135249984576
Energy: 0.7953402819658819
Energy: 0.7896135250048789
Energy: 0.7879980609872811
Energy: 0.789553008458629
Energy: 0.794739846868117
Energy: 0.7895530084607695
Energy: 0.7815963136512916
Energy: 0.8320327927778972
Energy: 0.7943820083055344
Energy: 0.8320327927828917
Energy: 0.7875682781241465
Energy: 0.8295991788040092
Energy: 0.7684426452904793
Energy: 0.8295991788068632
Energy: 0.7956504720717179
Energy: 0.8514547743455101
Energy: 0.7681374681315728
Energy: 0.851454774344083
Energy: 0.7820282920484966
Energy: 0.7745285490193378
Energy: 0.7684079310270524
Energy: 0.7745285490164838
Energy: 1.0829347253979211
Energy: 0.8512192826150478
Energy: 0.7641604872847557
Energy: 0.8512192826164747
Energy: 0.8139105878103191
Energy: 0.789069563760546
Energy: 0.7674730987780172
Energy: 0.7890695637519843
Energy: 1.04277850936611
Energy: 0.8508068485042387
Energy: 0.7639619252692801
Energy: 0.8508068485078062
Energy: 0.7841751213594342
Energy: 0.8518420735993973
Energy: 0.7669383922245668
Energy: 0.8518420735951163
Energy: 0.9322307313261234
Energy: 0.8506449878340959
Energy: 0.7648506106049348
Energy: 0.8506449878269611
Energy: 0.7841019709680126
Energy: 0.8346226774690826
Energy: 0.9258786041488464
Energy: 0.8346226774648017
Energy: 0.7648876699166004
Energy: 0.7934800969578906
Energy: 0.7865999343526927
Energy: 0.7934800969571771
Energy: 0.7840996665161021
Energy: 0.8347405757754109
Energy: 1.0422326826792188
Energy: 0.8347405757768378
Energy: 0.7756954062909416
Energy: 0.7940181447837104
Energy: 0.7864433194546312
Energy: 0.7940181447844237
Energy: 0.7842395236088616
Energy: 0.8337476334356555
Energy: 1.050266954980964
Energy: 0.8337476334335151
Energy: 0.7790652009675465
Energy: 0.7934017219461353
Energy: 0.7646620535255721
Energy: 0.7934017219475624

minimum gb energy = 0.7639160182517193 eV
minimum distance =  2.32662189446763 Angstroms
sigma value = 37


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

Energy: 0.7376065015302481
Energy: 0.7365615718933674
Energy: 0.7129862390921384
Energy: 0.7365615718933674
Energy: 0.7244971455820653
Energy: 0.7363939613688304
Energy: 0.7019188343490199
Energy: 0.7363939613676028
Energy: 0.6955189274517872
Energy: 0.8323373131600118
Energy: 1.2216149069578957
Energy: 0.8323373131600118
Energy: 0.6958794900248831
Energy: 0.7363416203949243
Energy: 0.7007576635995285
Energy: 0.7363416203949243
Energy: 0.700441654974764
Energy: 0.7361673998920385
Energy: 0.7138883633619063
Energy: 0.7361673998932383
Energy: 0.6914383567379643
Energy: 0.73655406097281
Energy: 0.697928872624767
Energy: 0.7365540609715826
Energy: 0.702499339864826
Energy: 0.7721917786405239
Energy: 0.9381594726841601
Energy: 0.7721917786417515
Energy: 0.6961864109198317
Energy: 0.7371863521028384
Energy: 0.7396147922839996
Energy: 0.7371863521028384
Energy: 0.7006864864717327
Energy: 0.7364811691875175
Energy: 1.0607915999924091
Energy: 0.7364811691875175
Energy: 0.999195234010979
Energy: 0.8210618434927546
Energy: 0.6980127492522182
Energy: 0.8210618434927546
Energy: 0.7024763567173207
Energy: 0.7719512664768869
Energy: 0.6978802016259451
Energy: 0.7719512664768869
Energy: 0.9886889492851374
Energy: 0.7365334998928815
Energy: 0.7008337828389614
Energy: 0.7365334998928815
Energy: 0.7006247073635076
Energy: 0.7363927042970756
Energy: 0.6992864103532539
Energy: 0.7363927042970756
Energy: 0.9467746429271084
Energy: 0.7723043851443601
Energy: 0.7018251877591731
Energy: 0.7723043851443601
Energy: 0.7360680060677693
Energy: 0.7725745754215515
Energy: 0.6961164289211651
Energy: 0.7725745754227789
Energy: 0.7365015755642665
Energy: 0.7367484124357597
Energy: 0.7010886368724488
Energy: 0.7367484124357597
Energy: 0.7007306751507368
Energy: 0.8219747908187376
Energy: 0.6995455251700349
Energy: 0.82197479081751
Energy: 0.7019343811858771
Energy: 0.8536866077769752
Energy: 0.702293522692157
Energy: 0.8536866077769752
Energy: 0.7027242072740717
Energy: 0.7379681690878489
Energy: 0.696300075837086
Energy: 0.7379681690878489
Energy: 0.6962866163281071
Energy: 0.7371625881831178
Energy: 0.6951448656586506
Energy: 0.7371625881831178

minimum gb energy = 0.6914383567379643 eV
minimum distance =  2.32873363771422 Angstroms
sigma value = 25


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

Energy: 0.7810667834233469
Energy: 0.6519591936024821
Energy: 0.6260448454312942
Energy: 0.6519591936043992
Energy: 0.9159046964060114
Energy: 0.655086895325824
Energy: 0.6421539993646683
Energy: 0.655086895324909
Energy: 0.7397999339821406
Energy: 0.6488363844612944
Energy: 0.8612595277531941
Energy: 0.6488363844612944
Energy: 0.7397688467174267
Energy: 0.6690579383001067
Energy: 0.6436707291514983
Energy: 0.6690579382991483
Energy: 0.6524099192339609
Energy: 0.6553324857826949
Energy: 0.6409180700822499
Energy: 0.6553324857836534
Energy: 0.7160340399678439
Energy: 0.6490707305144087
Energy: 0.6524152202496856
Energy: 0.6490707305134502
Energy: 0.642006230614571
Energy: 0.6367653293063567
Energy: 0.7405486893608942
Energy: 0.6367653293073152
Energy: 0.6225527119509476
Energy: 0.6770848289355899
Energy: 0.7408004274092063
Energy: 0.6770848289346314
Energy: 0.6415247325678708
Energy: 0.6600387849356784
Energy: 0.9371523481961842
Energy: 0.6600387849347199
Energy: 0.6157791804399437
Energy: 0.6427099038252125
Energy: 0.6787910593869868
Energy: 0.6427099038261711
Energy: 0.6422489629432203
Energy: 0.6367436304463893
Energy: 1.0164343570429446
Energy: 0.6367436304463893
Energy: 0.8673644353836395
Energy: 0.7484905799225126
Energy: 0.7407366734212981
Energy: 0.7484905799177198
Energy: 0.6450183612570687
Energy: 0.6694424490015215
Energy: 0.9185837377727163
Energy: 0.66944244900248
Energy: 0.865353248193365
Energy: 0.7033929948043561
Energy: 0.6518813127899021
Energy: 0.7033929948053146
Energy: 0.6547654195775132
Energy: 0.6369731810009849
Energy: 0.7247827822865203
Energy: 0.6369731810000263
Energy: 0.9457851585595941
Energy: 0.7464961612042305
Energy: 0.645105006171729
Energy: 0.7464961612032719
Energy: 0.7439878696203317
Energy: 0.6773575267926886
Energy: 0.619501259000458
Energy: 0.6773575267907715
Energy: 0.9466024114262712
Energy: 0.6552105809769897
Energy: 0.6427189077098088
Energy: 0.6552105809789068
Energy: 0.7852957544390888
Energy: 0.648716455447956
Energy: 0.6164493157331239
Energy: 0.648716455447956
Energy: 1.0938771526656474
Energy: 0.74684681279251
Energy: 0.6453381709175399
Energy: 0.7468468127915514
Energy: 0.7439076405887749
Energy: 0.7435936715486906
Energy: 0.6139080173569439
Energy: 0.7435936715506077
Energy: 0.7403569925636598
Energy: 0.6693791873847235
Energy: 0.6477079766673439
Energy: 0.6693791873847235
Energy: 0.6546179321591256
Energy: 0.7034502254718078
Energy: 0.865005966239597
Energy: 0.7034502254718078
Energy: 0.7205810829527657
Energy: 0.7469044951038192
Energy: 0.650852057730027
Energy: 0.7469044951009435
Energy: 0.6402703405352725
Energy: 0.745355141947862
Energy: 0.9562120147680866
Energy: 0.745355141947862
Energy: 0.6228326825249477
Energy: 0.6779939538075052
Energy: 0.7452500667026754
Energy: 0.6779939538075052

minimum gb energy = 0.6139080173569439 eV
minimum distance =  2.33699543144292 Angstroms
sigma value = 41


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

Energy: 0.8981593297134132
Energy: 0.5932240474589483
Energy: 1.0261963207099656
Energy: 0.5932240474589483
Energy: 0.9049213441118276
Energy: 0.579628723101084
Energy: 0.5719631424089195
Energy: 0.579628723101084
Energy: 0.5919031677654174
Energy: 0.5697177469492533
Energy: 0.556516770810057
Energy: 0.5697177469484676
Energy: 0.7424336130731178
Energy: 0.5800663382327216
Energy: 0.5719032750460895
Energy: 0.5800663382311501
Energy: 0.568289637514135
Energy: 0.608599013250948
Energy: 0.5618642496398567
Energy: 0.608599013250948
Energy: 0.5784032471401741
Energy: 0.5802829607939296
Energy: 0.5718882345090756
Energy: 0.580282960792358
Energy: 0.5712136401106258
Energy: 0.5800029128299726
Energy: 0.5777685376482131
Energy: 0.5800029128252575
Energy: 0.5572700170874266
Energy: 0.5932445735783297
Energy: 0.5692759480575289
Energy: 0.5932445735783297
Energy: 0.5741087156984663
Energy: 0.5930963719795546
Energy: 0.7420252585793226
Energy: 0.5930963719811263
Energy: 0.5556337969260221
Energy: 0.5701342310734063
Energy: 0.5927757769956146
Energy: 0.570134231074978
Energy: 0.5712528539726635
Energy: 0.5797508440414239
Energy: 1.0296131121987857
Energy: 0.5797508440429956
Energy: 0.5571960131590599
Energy: 0.5935579516639259
Energy: 0.8982736273481716
Energy: 0.5935579516647117
Energy: 0.5740018151779053
Energy: 0.5956696583127875
Energy: 1.0281003711898313
Energy: 0.5956696583143593
Energy: 0.7696820816418537
Energy: 0.6495527123679956
Energy: 0.5929870533212342
Energy: 0.6495527123687813
Energy: 0.5712084735166922
Energy: 0.5798428692183272
Energy: 0.8939363953483949
Energy: 0.5798428692191129
Energy: 0.7721322659545004
Energy: 0.5941554535707185
Energy: 0.5690364090054555
Energy: 0.5941554535715045
Energy: 0.5740127227800267
Energy: 0.5934521069312837
Energy: 0.7313029652143785
Energy: 0.5934521069312837
Energy: 0.7575825605418786
Energy: 0.6496153148446628
Energy: 0.5718468840463253
Energy: 0.649615314843877
Energy: 0.5713294663961492
Energy: 0.5923972193304056
Energy: 0.5571857775495047
Energy: 0.5923972193304056
Energy: 0.759619444451089
Energy: 0.5942066647496589
Energy: 0.5744366837707808
Energy: 0.5942066647488732
Energy: 0.5950446067210314
Energy: 0.5934529372394329
Energy: 0.5554118952658367
Energy: 0.5934529372402185
Energy: 1.0269523649543875
Energy: 0.662469372623757
Energy: 0.5720415377676665
Energy: 0.662469372623757
Energy: 0.8990590565146042
Energy: 0.5924556129749253
Energy: 0.5574365224371167
Energy: 0.592455612972568
Energy: 0.9109644499138281
Energy: 0.5933093939468942
Energy: 0.5772065109449073
Energy: 0.59330939395711
Energy: 0.594907459464226
Energy: 0.6506851686554784
Energy: 0.5677366593163212
Energy: 0.6506851686570501
Energy: 0.893247490977924
Energy: 0.6078706972845844
Energy: 0.5720442847902915
Energy: 0.6078706973380215
Energy: 0.5712423781161674
Energy: 0.5928304184214974
Energy: 0.769074295389394
Energy: 0.592830418474113
Energy: 0.572484202752877
Energy: 0.5924406538351843
Energy: 0.5772175856098607
Energy: 0.5924406538281117
Energy: 0.5740595002425374
Energy: 0.6509413152767594
Energy: 0.7618725727274744
Energy: 0.6509413152751877
Energy: 0.5664385483743272
Energy: 0.6274153323429981
Energy: 0.5744696609911968
Energy: 0.6274153323453555
Energy: 0.5760186669881611
Energy: 0.593153319909327
Energy: 0.7669825252547069
Energy: 0.593153319909327
Energy: 0.5571005128043864
Energy: 0.5928419983350929
Energy: 0.598418490789511
Energy: 0.5928419983476664

minimum gb energy = 0.5554118952658367 eV
minimum distance =  2.32628043729454 Angstroms
sigma value = 15


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

Energy: 0.8100503203894996
Energy: 0.5370119228054373
Energy: 0.7915944975938868
Energy: 0.5370119228047716
Energy: 0.9271353447509231
Energy: 0.533913549722033
Energy: 0.5351763936265393
Energy: 0.533913549722033
Energy: 0.5545392801487752
Energy: 0.533585831613918
Energy: 1.048939078661711
Energy: 0.5335858316152495
Energy: 0.810526676589755
Energy: 0.5347436932650769
Energy: 0.5350975053277891
Energy: 0.5347436932604774
Energy: 0.5328582022246147
Energy: 0.5376361849449472
Energy: 0.7934806427671567
Energy: 0.5376361849449472
Energy: 0.8071547567074484
Energy: 0.5344501364493228
Energy: 0.5351278842933166
Energy: 0.5344501364526514
Energy: 0.5347147952327965
Energy: 0.5453803046341241
Energy: 0.5292384070453725
Energy: 0.5453803046301299
Energy: 0.6676777882306676
Energy: 0.5438820519481566
Energy: 0.5351612892058614
Energy: 0.5438820519461595
Energy: 0.5365505918742455
Energy: 0.5454721095838246
Energy: 0.6734489653272906
Energy: 0.5454721095858218
Energy: 0.5277087446490002
Energy: 0.533627735696437
Energy: 0.5332865992959075
Energy: 0.5336277356951056
Energy: 0.5346502782992482
Energy: 0.5347069180941229
Energy: 0.8113469345746112
Energy: 0.5347069180921256
Energy: 0.5106429699024406
Energy: 0.5337961034690136
Energy: 0.5548763991472015
Energy: 0.5337961034676821
Energy: 0.5366139274942833
Energy: 0.5454723023801766
Energy: 1.0345938498814198
Energy: 0.5454723023808423
Energy: 0.528539522270813
Energy: 0.5368469619805916
Energy: 0.8101400772466238
Energy: 0.5368469619759315
Energy: 0.5347544895640584
Energy: 0.5340478147878882
Energy: 1.037402749355175
Energy: 0.5340478147958769
Energy: 0.6952698908493116
Energy: 0.5339532250183466
Energy: 0.5552645943375966
Energy: 0.5339532250163495
Energy: 0.5366068381452536
Energy: 0.5445798100214868
Energy: 0.9191376548898458
Energy: 0.5445798100201553
Energy: 0.7002981998322221
Energy: 0.5818917273510932
Energy: 0.5333620895356924
Energy: 0.581891727349096
Energy: 0.5347738104115123
Energy: 0.5334016479394805
Energy: 0.8037725378492441
Energy: 0.5334016479374832
Energy: 0.6906367321045762
Energy: 0.5344048340888179
Energy: 0.5351321153998642
Energy: 0.5344048340901493
Energy: 0.5365560329772973
Energy: 0.5549893764703263
Energy: 0.7367465311209849
Energy: 0.5549893764683291
Energy: 0.6981262775154934
Energy: 0.5443764335379065
Energy: 0.5386298112064026
Energy: 0.5443764335392381
Energy: 0.5347922388338447
Energy: 0.5333694302360302
Energy: 0.5240931518014434
Energy: 0.5333694302373616
Energy: 0.9551786757123895
Energy: 0.5349839094228637
Energy: 0.5352442897197901
Energy: 0.5349839094228637
Energy: 0.5564280367330702
Energy: 0.5547927651633318
Energy: 0.5254687232471625
Energy: 0.5547927651653288
Energy: 0.9325094576462897
Energy: 0.5436728052064018
Energy: 0.5383591967313197
Energy: 0.5436728052030733
Energy: 0.8112508233149911
Energy: 0.5336931320421079
Energy: 0.5246048227322725
Energy: 0.5336931320461021
Energy: 1.0349239378809738
Energy: 0.5356909698536493
Energy: 0.5352995595278256
Energy: 0.5356909700206836
Energy: 0.5563459555058565
Energy: 0.6033952829179073
Energy: 0.5252639540796289
Energy: 0.6033952828879501
Energy: 0.8156101853656196
Energy: 0.5442945566328339
Energy: 0.5387637869631965
Energy: 0.5442945566288396
Energy: 0.534660489706638
Energy: 0.5810827553563482
Energy: 0.697139710883675
Energy: 0.5810827553556825
Energy: 0.8038847545498217
Energy: 0.5332792129190776
Energy: 0.5351929982683243
Energy: 0.5332792129130862
Energy: 0.5365692950987122
Energy: 0.6085100900869043
Energy: 0.6855321975005129
Energy: 0.6085100900822443
Energy: 0.5315333700509811
Energy: 0.5545538777716528
Energy: 0.5385496428356683
Energy: 0.5545538777696555
Energy: 0.5301517388904526
Energy: 0.5814621189265055
Energy: 0.6968288426045435
Energy: 0.5814621188752453
Energy: 0.5256235346920114
Energy: 0.5329460605550456
Energy: 0.5370152030842956
Energy: 0.5329460605530485
Energy: 0.5364231425370534
Energy: 0.6085273395812902
Energy: 0.9522893047847438
Energy: 0.6085273395826216

minimum gb energy = 0.5106429699024406 eV
minimum distance =  2.33085492590828 Angstroms
sigma value = 85


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

Energy: 0.8213636997224965
Energy: 0.5321653802208636
Energy: 0.47584880290792353
Energy: 0.5321653802220183
Energy: 0.9936118465491763
Energy: 0.5224199096430926
Energy: 0.48992684889130933
Energy: 0.5224199096402058
Energy: 0.7914507829338766
Energy: 0.527819193050221
Energy: 0.48749047610194574
Energy: 0.5278191930479115
Energy: 0.969302472403294
Energy: 0.5186701158801684
Energy: 0.4898596763127523
Energy: 0.5186701158847875
Energy: 0.5774114029074255
Energy: 0.49686423557902853
Energy: 0.4903144825799385
Energy: 0.4968642355784511
Energy: 0.8643894263435475
Energy: 0.5269902053139329
Energy: 0.4897559081974206
Energy: 0.5269902053168198
Energy: 0.5477441419215303
Energy: 0.5351564479471344
Energy: 0.5519217827887709
Energy: 0.5351564479454023
Energy: 0.757712158984977
Energy: 0.517165861623312
Energy: 0.49756308157464696
Energy: 0.51716586162158
Energy: 0.4966358379383362
Energy: 0.502515136472605
Energy: 0.6741759998650141
Energy: 0.5025151364708728
Energy: 0.6427520775229768
Energy: 0.5292179436469006
Energy: 0.5481554716516873
Energy: 0.5292179436451685
Energy: 0.4910862460254652
Energy: 0.517725460040827
Energy: 0.7885945622143212
Energy: 0.517725460040827
Energy: 0.5184809668938433
Energy: 0.5233776060313722
Energy: 0.577789536656405
Energy: 0.5233776060313722
Energy: 0.48943694071974847
Energy: 0.5015286763324038
Energy: 0.8913539481153827
Energy: 0.5015286763329811
Energy: 0.4596012455868712
Energy: 0.5279671683271501
Energy: 0.7917350069939965
Energy: 0.5279671683744688
Energy: 0.49122719806296294
Energy: 0.517772209174085
Energy: 1.0724139430508732
Energy: 0.5177722091729302
Energy: 0.45622186766743894
Energy: 0.5210277947937554
Energy: 0.7580376835144035
Energy: 0.5210277947920232
Energy: 0.48946052727661554
Energy: 0.5028319698170763
Energy: 1.0202837201113915
Energy: 0.5028319698199633
Energy: 0.6054912674749459
Energy: 0.5279194415861704
Energy: 0.7916605394976284
Energy: 0.5279194415867479
Energy: 0.49094585119618367
Energy: 0.5185317830711483
Energy: 0.9688405800214533
Energy: 0.5185317830694163
Energy: 0.6114197446898101
Energy: 0.5209528542858756
Energy: 0.577721741788304
Energy: 0.5209528542841435
Energy: 0.490337533602612
Energy: 0.5098354153392757
Energy: 0.8639337941183791
Energy: 0.5098354153386984
Energy: 0.6661294362945885
Energy: 0.517836157016738
Energy: 0.5482315006731366
Energy: 0.5178361570195986
Energy: 0.49790927489495346
Energy: 0.5169342018925782
Energy: 0.7579618120757406
Energy: 0.5169342018914236
Energy: 0.6751581796961738
Energy: 0.536736574889237
Energy: 0.4976535334793638
Energy: 0.5367365748898143
Energy: 0.5495993132188617
Energy: 0.5188623002012855
Energy: 0.6423974765409044
Energy: 0.5188623002001307
Energy: 0.8985138571821433
Energy: 0.5178467862293067
Energy: 0.491745709913406
Energy: 0.5178467862241104
Energy: 0.5793006413379674
Energy: 0.5168401831030661
Energy: 0.5187696683584786
Energy: 0.5168401830990245
Energy: 0.909235599312751
Energy: 0.540036059913466
Energy: 0.4898672840622472
Energy: 0.540036059910579
Energy: 0.7920177682241474
Energy: 0.5293556770394278
Energy: 0.5176950554259828
Energy: 0.5293556770394278
Energy: 1.0724166569542661
Energy: 0.5178597873262867
Energy: 0.49099638765873044
Energy: 0.5178597873280187
Energy: 0.8222807631097109
Energy: 0.526675807714547
Energy: 0.45624509109080624
Energy: 0.5266758077180113
Energy: 0.9886071921855308
Energy: 0.5344235824197817
Energy: 0.48991407496576306
Energy: 0.5344235824180497
Energy: 0.7920369968935569
Energy: 0.5292792575964361
Energy: 0.45789471570760976
Energy: 0.5292792575848886
Energy: 0.9689340002370229
Energy: 0.5185000422996398
Energy: 0.49163258955719963
Energy: 0.5185000422973302
Energy: 0.579079102168779
Energy: 0.5169089718825446
Energy: 0.6113074273911884
Energy: 0.5169089718836993
Energy: 0.7734759538635556
Energy: 0.5440620173972741
Energy: 0.4917155362252029
Energy: 0.5440620173966968
Energy: 0.5496773298714555
Energy: 0.5181275013700504
Energy: 0.6663459743153678
Energy: 0.5181275013706277
Energy: 0.7579209308470125
Energy: 0.5168777954259489
Energy: 0.4992296118014132
Energy: 0.516877795427681
Energy: 0.4979105000481672
Energy: 0.5169859338431566
Energy: 0.6750746292480461
Energy: 0.5169859338460434
Energy: 0.5297479429586462
Energy: 0.5528670867676106
Energy: 0.5518011946324224
Energy: 0.5528670867658784
Energy: 0.4921673185987419
Energy: 0.5180791622094446
Energy: 0.8984729446065436
Energy: 0.5180791622105995
Energy: 0.5184071071585876
Energy: 0.5168903914852199
Energy: 0.5811508132090217
Energy: 0.5168903914685021
Energy: 0.49112211600730366
Energy: 0.5169770581625361
Energy: 0.909394610205402
Energy: 0.5169770581619587

minimum gb energy = 0.45622186766743894 eV
minimum distance =  2.34173617172494 Angstroms
sigma value = 113


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

Energy: 0.568051732651493
Energy: 0.5680614772317827
Energy: 0.9684770085812359
Energy: 0.5680614772317827
Energy: 0.968078844035577
Energy: 0.25189291283137044
Energy: 0.2528858467128729
Energy: 0.2518929128309266
Energy: 0.015501761686249985
Energy: 0.015875333094019322
Energy: 0.3487488433092219
Energy: 0.0158753330931316
Energy: 0.968078844035133
Energy: 0.2518929128305074
Energy: 0.25288584671242903
Energy: 0.2518929128305074
Energy: 0.568051732651493
Energy: 0.5680614772317827
Energy: 0.017024938693091785
Energy: 0.5680614772317827
Energy: 0.9680788440347139
Energy: 0.2518929128305074
Energy: 0.2528858467128729
Energy: 0.2518929128309266

minimum gb energy = 0.015501761686249985 eV
minimum distance =  2.54177422771906 Angstroms
sigma value = 1