Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Au__MO_468407568810_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080054295063022
cohesive_energy=3.930314242832764
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.75048867112048e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06387151295308e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.85714556964586e-19, 1.9324813688654397e-19, 7.75266036189822e-20, -6.80838551911764e-20, -2.52636018179022e-19, -4.88748788731602e-19, -7.943880143166119e-19, -1.195294264735896e-18, -1.72852428335724e-18, -2.44934355099384e-18]
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: -5.96046447753906e-08 eV

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

Energy: 0.014573326158069241
Energy: 0.206078302203937
Energy: 0.2053576199586834
Energy: 0.4935601696460924
Energy: 0.48975977363251966
Energy: 0.1782251407558763
Energy: 0.015225966754495085
Energy: 0.05868759863167566
Energy: 0.4069879428744416
Energy: 0.14006566807014614
Energy: 0.20489697127942563
Energy: 0.3619424904673454
Energy: 0.015760825737678046
Energy: 0.05973756464234502
Energy: 0.015034371814130965
Energy: 0.40721639069131815
Energy: 0.1382052131973086
Energy: 0.20515388861542935
Energy: 0.3615679249125665
Energy: 0.058460011220537726
Energy: 0.05972471112153921
Energy: 0.016528766881871444
Energy: 0.20522034632637706
Energy: 0.20581452773029252
Energy: 0.6273609567199363
Energy: 0.515401627013196
Energy: 0.05887631671447051
Energy: 0.015249515889031746
Energy: 0.059499071793074586
Energy: 0.4950852041205863
Energy: 0.14263872191741367
Energy: 0.20488997542345908
Energy: 0.3621163725074311
Energy: 0.015462100743800026
Energy: 0.05925419798140135
Energy: 0.01498009580971264
Energy: 0.3612818513764476
Energy: 0.20785496362638356
Energy: 0.20521073387594357
Energy: 0.20508460141119195
Energy: 0.05852764759684409
Energy: 0.05949075745421151

minimum gb energy = 0.014573326158069241 eV
minimum distance =  2.85699337729689 Angstroms
sigma value = 5


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

Energy: 0.7147157861576213
Energy: 0.6104629433412739
Energy: 0.6848319290942797
Energy: 0.6528317971623852
Energy: 0.6374907197467884
Energy: 0.6617190182594072
Energy: 0.6246913487428604
Energy: 0.6081304887904615
Energy: 0.629449757762081
Energy: 0.6087952933513608
Energy: 0.6499525861485399
Energy: 0.609360074880708
Energy: 0.6148240006079061
Energy: 0.6589991419838482
Energy: 0.6039760083730904
Energy: 0.6649190084262316
Energy: 0.6211907790905217
Energy: 0.6337684026527848
Energy: 0.6373676167319609
Energy: 0.6504371367530224
Energy: 0.6622430528924834
Energy: 0.6116534646919751
Energy: 0.6493273664518303
Energy: 0.6180979640341473
Energy: 0.6310601328600228
Energy: 0.6397715743333944
Energy: 0.6126118905136687
Energy: 0.649675804256749
Energy: 0.6478282293527061
Energy: 0.6444062424585251
Energy: 0.6329176918057506
Energy: 0.6240788909742612
Energy: 0.6476596936590693
Energy: 0.618240243884576
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Energy: 0.6356172680789219
Energy: 0.6490446190456803
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Energy: 0.6199594040117956
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Energy: 0.6474896063658522
Energy: 0.6136250436262566
Energy: 0.658259430139977
Energy: 0.699275648931939
Energy: 0.6290419083101761
Energy: 0.6377153788009161
Energy: 0.6642855609857865
Energy: 0.6260838693135304
Energy: 0.6199409985697079
Energy: 0.625567293566043
Energy: 0.6640895079869739
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Energy: 0.6216840597318599
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Energy: 0.616129070302656
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Energy: 0.668398316997464
Energy: 0.6676881778906423
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Energy: 0.6278446422432766
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Energy: 0.675351753211828
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Energy: 0.6459930590854001
Energy: 0.6242458488676336
Energy: 0.6160981289391211
Energy: 0.6670596902149967
Energy: 0.658514667408723
Energy: 0.6387004819950598
Energy: 0.6217764324617421
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Energy: 0.646189315067161
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Energy: 0.6281740516883614
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Energy: 0.6537285867577831
Energy: 0.6317649934803125
Energy: 0.6500460980036176
Energy: 0.6526982344952488
Energy: 0.6484632945476346
Energy: 0.6434046465530365
Energy: 0.6784865403402589
Energy: 0.6081975035467496
Energy: 0.6343787969603172
Energy: 0.6348674056391004
Energy: 0.6316782444306281
Energy: 0.6322501463212674
Energy: 0.6946230498737591
Energy: 0.6391332066222986
Energy: 0.6054263736224492
Energy: 0.6412720153833741
Energy: 0.6096508637879299
Energy: 0.6329117535361196
Energy: 0.6247998760141213
Energy: 0.6169404172967403
Energy: 0.6566748774154196
Energy: 0.707279021644029
Energy: 0.6324740552031649
Energy: 0.6509739741030001
Energy: 0.6544168999075947
Energy: 0.6666575167735384
Energy: 0.6513236523061664
Energy: 0.6269512687377731
Energy: 0.6061011584653574
Energy: 0.6358324718869356
Energy: 0.6284958632956629
Energy: 0.6366375804317181
Energy: 0.6341173623447016
Energy: 0.6283510388082922
Energy: 0.6696111620412016
Energy: 0.7430005845840745
Energy: 0.6263999712765744
Energy: 0.6560614885536963
Energy: 0.6316155072653269
Energy: 0.6334319996017901
Energy: 0.6336399041535359
Energy: 0.6148212492196955
Energy: 0.6223389663417866
Energy: 0.6419918689545213
Energy: 0.620273578427177
Energy: 0.6476339350005271
Energy: 0.6716349234830492
Energy: 0.6085441778015119
Energy: 0.6140105038956175
Energy: 0.6124867331879811
Energy: 0.6423698520340378
Energy: 0.6524051126706213
Energy: 0.6408413942804798
Energy: 0.6537963740379843
Energy: 0.6444222921282752
Energy: 0.6583922277675381

minimum gb energy = 0.6039760083730904 eV
minimum distance =  2.5983584474439 Angstroms
sigma value = 401


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

Energy: 0.6843933225077018
Energy: 0.7269855139949138
Energy: 0.6492115977392141
Energy: 0.6398157169809942
Energy: 0.6293636502026574
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Energy: 0.6534255034804707
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Energy: 0.606325266395085
Energy: 0.5982332605980132
Energy: 0.619090658017002
Energy: 0.6648806635887157
Energy: 0.6301419144859004
Energy: 0.6692510874505245
Energy: 0.6184334047475554
Energy: 0.6205057036848419
Energy: 0.6147985272466189
Energy: 0.6488919367653417
Energy: 0.6538881755267146
Energy: 0.6109214798514303
Energy: 0.6305820206134201
Energy: 0.6440680755877779
Energy: 0.6412994533484343
Energy: 0.6308593397432637
Energy: 0.6999144654724883
Energy: 0.6476074157454552
Energy: 0.6514303813684659
Energy: 0.648489432324716
Energy: 0.6416322747402672
Energy: 0.6191691370770456
Energy: 0.6807506202079358
Energy: 0.6183955058584333
Energy: 0.6312043650803318
Energy: 0.611870125899923
Energy: 0.6270154752650653
Energy: 0.6473169423085362
Energy: 0.6267511870560487
Energy: 0.6178871965768757
Energy: 0.6230253389673021
Energy: 0.6254832305231804
Energy: 0.6106018525301684
Energy: 0.6210072138660364
Energy: 0.6401860995869698
Energy: 0.6283048201361022
Energy: 0.6373038586943354
Energy: 0.6271637801033657
Energy: 0.6249862416186158
Energy: 0.6307547317513713
Energy: 0.628103648039592
Energy: 0.6375767857336152
Energy: 0.6090254719815937
Energy: 0.6030242759163374
Energy: 0.6621892405749719
Energy: 0.6364751200093405
Energy: 0.7395776922664695
Energy: 0.6400765890710455
Energy: 0.6160758730449338
Energy: 0.6369871617548004
Energy: 0.6307141179342319
Energy: 0.61923634454068
Energy: 0.6661946401267308
Energy: 0.6203542955893715
Energy: 0.6382524933784383
Energy: 0.6357867921736566
Energy: 0.617719119394089
Energy: 0.6192237162867967
Energy: 0.6353953592410805
Energy: 0.6631154025133712
Energy: 0.7165803254175848
Energy: 0.6560064018307941
Energy: 0.6330865175466991
Energy: 0.6269549004870071
Energy: 0.6000407273712317
Energy: 0.6098213144616664
Energy: 0.6500170956862287
Energy: 0.6573560655985254
Energy: 0.6671756604165202
Energy: 0.6225293478382389
Energy: 0.6175281861885525
Energy: 0.5981132443544519
Energy: 0.6201994830718017
Energy: 0.6836811865391673
Energy: 0.621379071228779
Energy: 0.649902979839134
Energy: 0.6172875801923043
Energy: 0.625918849039714
Energy: 0.616789159711799
Energy: 0.6191618038401501
Energy: 0.6669774605681212
Energy: 0.6093822814758104
Energy: 0.6227663019676042
Energy: 0.6205123034517914
Energy: 0.6162730476852792
Energy: 0.6353086639866354
Energy: 0.6814375839001616
Energy: 0.6422968558134122
Energy: 0.6131371583532426
Energy: 0.63411806536222
Energy: 0.6415068367323864
Energy: 0.6118974632856004
Energy: 0.6484006478779859
Energy: 0.6310705860889998
Energy: 0.620529795006131
Energy: 0.6179398394809451
Energy: 0.6302307841641919
Energy: 0.6264782585438943
Energy: 0.6160743480491799
Energy: 0.6236099961488408
Energy: 0.6161645612085643
Energy: 0.6234201172798889

minimum gb energy = 0.5950654722974286 eV
minimum distance =  2.57892565617912 Angstroms
sigma value = 311


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

Energy: 0.6275194260047555
Energy: 0.6127332574932215
Energy: 0.6411805879898321
Energy: 0.6090123995955141
Energy: 0.6374933941227915
Energy: 0.6234822747564029
Energy: 0.613268209759199
Energy: 0.6291353138035479
Energy: 0.6232229605118396
Energy: 0.6267573963693042
Energy: 0.6218324008222232
Energy: 0.613341495081009
Energy: 0.6173848193744554
Energy: 0.6415500752688018
Energy: 0.6091427709133084
Energy: 0.6105141399653982
Energy: 0.6260401968642574
Energy: 0.6174571095724
Energy: 0.6283328817651902
Energy: 0.6038920213417028
Energy: 0.6144885480620605
Energy: 0.6312331064745142
Energy: 0.6311357667620211
Energy: 0.623729532040609
Energy: 0.6318432147584806
Energy: 0.6478249367686416
Energy: 0.6305153406734483
Energy: 0.6315117293997538
Energy: 0.6346677804174372
Energy: 0.6192625656765542
Energy: 0.6203697469744649
Energy: 0.6361955138995615
Energy: 0.6488014393643464
Energy: 0.6120160370806429
Energy: 0.6322255042361281
Energy: 0.6240219965368693
Energy: 0.6235028392417196
Energy: 0.6082950818234321
Energy: 0.6064620565564557
Energy: 0.6317309089111912
Energy: 0.6130229485450632
Energy: 0.6241932266127779
Energy: 0.6440896979529876
Energy: 0.6041981537624836
Energy: 0.6378836371569885
Energy: 0.6223173992653328
Energy: 0.584227988168559
Energy: 0.6390670078551701
Energy: 0.6355438729979859
Energy: 0.6278839591605566
Energy: 0.6496256044450014
Energy: 0.616844319616852
Energy: 0.6383606131934706
Energy: 0.6266498302669963
Energy: 0.631342019049321
Energy: 0.6176285285399395
Energy: 0.6254247129858257
Energy: 0.6185314189533848
Energy: 0.6277312027792076
Energy: 0.6339940444839735
Energy: 0.6295475797954317
Energy: 0.5958207635452274
Energy: 0.620200919323087
Energy: 0.6343331556286376
Energy: 0.6321837083256503
Energy: 0.6249451094740814
Energy: 0.6088259026567077
Energy: 0.6630788723087635
Energy: 0.6160562440554375
Energy: 0.617234768608451
Energy: 0.618950090680869
Energy: 0.6434222038108642
Energy: 0.6494354504270657
Energy: 0.6401575664840179
Energy: 0.6528898766077462
Energy: 0.6330254865923988
Energy: 0.6357577762896598
Energy: 0.6090665334619391
Energy: 0.638164170123348
Energy: 0.6184559310044327
Energy: 0.6071086711398922
Energy: 0.6223915973983
Energy: 0.6112857054697085
Energy: 0.6242779176365003
Energy: 0.6467783886118428
Energy: 0.6276677247856106
Energy: 0.6211526882536736
Energy: 0.6022273717309846
Energy: 0.6120615401373193
Energy: 0.6146070817264281
Energy: 0.6445016789270385
Energy: 0.6211792358093047
Energy: 0.6873271287809329
Energy: 0.6283360973999158
Energy: 0.6668249874801492
Energy: 0.683574017322413
Energy: 0.6676552869318979
Energy: 0.6983480528025242
Energy: 0.6260545258136097
Energy: 0.626269664394285
Energy: 0.6076916702869083
Energy: 0.619702792334771
Energy: 0.6471461998721248
Energy: 0.60615570252723
Energy: 0.6179414613066762
Energy: 0.618759875477723
Energy: 0.6043047031359587
Energy: 0.6199647557989023
Energy: 0.6316696024875079
Energy: 0.6433262454303754
Energy: 0.6187747817578328
Energy: 0.641025816424998
Energy: 0.6287721583017915
Energy: 0.6193191363008771
Energy: 0.6385117400518481
Energy: 0.6327145788878352
Energy: 0.6201343744602728
Energy: 0.6277924043276147
Energy: 0.6440586746715196
Energy: 0.6055695783198437
Energy: 0.6444954575901086
Energy: 0.6220975222265385
Energy: 0.6078445100196225
Energy: 0.6223035096661313
Energy: 0.6196663678070785
Energy: 0.6455314680670018
Energy: 0.6265961124600185
Energy: 0.6240441028842321
Energy: 0.6413824489996562
Energy: 0.5961418273598079
Energy: 0.6313657929325563
Energy: 0.6257261896864492
Energy: 0.6387190265613227
Energy: 0.673662210227579
Energy: 0.6772957097041797
Energy: 0.6388319983514008
Energy: 0.6803029774369661
Energy: 0.672389928889028
Energy: 0.6551986260296682
Energy: 0.6800958899966297
Energy: 0.6237026088924461
Energy: 0.6198863555426876
Energy: 0.6135322667775931
Energy: 0.6297551166481786
Energy: 0.634186589169288
Energy: 0.6420084292289261
Energy: 0.6391835738459914
Energy: 0.6171691316498813
Energy: 0.6432231380725952
Energy: 0.6217442782205924
Energy: 0.608312995626672
Energy: 0.6407282041544032
Energy: 0.6232394110647489
Energy: 0.6309466694457977
Energy: 0.6540596304761759
Energy: 0.6092313411722019
Energy: 0.6199141233555168
Energy: 0.6547124421626863
Energy: 0.6459041126478314
Energy: 0.6189641979837516
Energy: 0.6208766893781761
Energy: 0.6169894576673801
Energy: 0.6441594158944814
Energy: 0.6246617700732774
Energy: 0.6126405234063778
Energy: 0.6250745429546084
Energy: 0.6101133961167868
Energy: 0.6152865538426103
Energy: 0.6426117638242779
Energy: 0.617990693649412
Energy: 0.6206043014292015
Energy: 0.6535578880038574
Energy: 0.613809169017509
Energy: 0.6147111729578905
Energy: 0.6386647597100431
Energy: 0.6526105638071424
Energy: 0.6647537039740684
Energy: 0.6283232084973409
Energy: 0.6853893589100555
Energy: 0.6731886328047301
Energy: 0.6488866716012415
Energy: 0.6781947411146098
Energy: 0.6348083821773883
Energy: 0.6514801028761686
Energy: 0.6359121025460982
Energy: 0.6061236792654834
Energy: 0.6810220915489387
Energy: 0.614859885291676
Energy: 0.6355158153402944
Energy: 0.6081383072183774
Energy: 0.6591439252240975
Energy: 0.6262610071423255
Energy: 0.6053620205337286
Energy: 0.6352264048484315
Energy: 0.6165126388442008
Energy: 0.6180131942912582
Energy: 0.619144755868796
Energy: 0.6383663622204946
Energy: 0.6459827962716782
Energy: 0.6193816628355537
Energy: 0.6514981635620752
Energy: 0.6296397597869444
Energy: 0.631225190860453
Energy: 0.643830779414145
Energy: 0.6590808615950554
Energy: 0.6225557415513782
Energy: 0.6458356741344344
Energy: 0.6217278148496715
Energy: 0.6343981074016223
Energy: 0.6149303924372002
Energy: 0.6457635176952876
Energy: 0.6206070908973577
Energy: 0.6482586858632023
Energy: 0.6324729453789903
Energy: 0.6180690936700103
Energy: 0.6021048835554103
Energy: 0.6243580607976683
Energy: 0.6428121165854418
Energy: 0.6590697957315996
Energy: 0.6168015304557369
Energy: 0.6486534402521641
Energy: 0.6870736828879698
Energy: 0.6399791751750812
Energy: 0.6268358777069281
Energy: 0.6369318940575555
Energy: 0.6077741718278151
Energy: 0.6176816305671614
Energy: 0.5937789517325807
Energy: 0.6301888465014592
Energy: 0.610877500148824
Energy: 0.6492920325901708
Energy: 0.6253689424975557
Energy: 0.6299185510843704
Energy: 0.6272050491684263
Energy: 0.6087415862831376
Energy: 0.6239909753763196
Energy: 0.6266252581656844
Energy: 0.6456222934832768
Energy: 0.6247632241666929
Energy: 0.624873489198251
Energy: 0.6519587318689835
Energy: 0.6338509306103766
Energy: 0.6201761958608255
Energy: 0.6213661654687328
Energy: 0.6464921967682478
Energy: 0.6440455838831692
Energy: 0.6389309236246178
Energy: 0.6371792394030773
Energy: 0.6546871142535398
Energy: 0.6285825448565582
Energy: 0.6229006721255793
Energy: 0.6188862786297253

minimum gb energy = 0.584227988168559 eV
minimum distance =  2.61509471276237 Angstroms
sigma value = 39


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

Energy: 0.5756039369284883
Energy: 0.6795618687699229
Energy: 0.7931450106343073
Energy: 0.7077654682307151
Energy: 0.6464133018273053
Energy: 0.6716911369038024
Energy: 0.5626327409107259
Energy: 0.6221295997283073
Energy: 0.6278325286305139
Energy: 0.6730839707973367
Energy: 0.6508061595175096
Energy: 0.610599219345617
Energy: 0.6201505906482085
Energy: 0.6138652813977121
Energy: 0.6197445243553846
Energy: 0.6009810437964309
Energy: 0.6079455255853785
Energy: 0.6460362194378529
Energy: 0.6108673445311373
Energy: 0.619367673217412
Energy: 0.6170947096157755
Energy: 0.6174768750513404
Energy: 0.5991550108320133
Energy: 0.6099293290656408
Energy: 0.6093396561040002
Energy: 0.6517590721888541
Energy: 0.6088037780741713
Energy: 0.6622927749801432
Energy: 0.6370728314881773
Energy: 0.6092503189329012
Energy: 0.6648939746181216
Energy: 0.6093896300171573
Energy: 0.6454608700663291
Energy: 0.6123593320787903
Energy: 0.6176597220486452
Energy: 0.562157940667273
Energy: 0.6102740690230268
Energy: 0.6076738732261523
Energy: 0.6014393683825544
Energy: 0.6289672063258401
Energy: 0.6207584727591731
Energy: 0.6276698633947424
Energy: 0.6182659896442932
Energy: 0.6175445096891927
Energy: 0.6053177364050998
Energy: 0.7796989353893317
Energy: 0.5638101231669972
Energy: 0.5646398018422116
Energy: 0.6127404317729556
Energy: 0.5636665043996536
Energy: 0.6302144728512333
Energy: 0.6743262178542986
Energy: 0.6013128866340781
Energy: 0.674216073050698
Energy: 0.6084954460790928
Energy: 0.6673748689100476
Energy: 0.5638151731857223
Energy: 0.6296551314871489
Energy: 0.6745508119192807
Energy: 0.6007475284528426
Energy: 0.6090883430739227
Energy: 0.6077483762059152
Energy: 0.625274299572135
Energy: 0.6179377566590198
Energy: 0.6184961876324364
Energy: 0.6093620983209442
Energy: 0.6438604361553389
Energy: 0.6100644322449811
Energy: 0.6176537448111691
Energy: 0.617011996775633
Energy: 0.6196195577898813
Energy: 0.5992876124938104
Energy: 0.6110920687377507
Energy: 0.5988408220957615
Energy: 0.6091224455540235
Energy: 0.6267420187304744
Energy: 0.66480140688211
Energy: 0.6278312096254091
Energy: 0.6110337615425578
Energy: 0.5973673181870599
Energy: 0.5994580154335015
Energy: 0.6508847081394133
Energy: 0.6089951578145303
Energy: 0.6237571249278097
Energy: 0.5636934439784828
Energy: 0.6098748460887803
Energy: 0.67526274872193
Energy: 0.6103346645319021
Energy: 0.6645084847397154
Energy: 0.6088712417902936
Energy: 0.6179264340071118
Energy: 0.6185853384375357
Energy: 0.6007432309007573
Energy: 0.607501700467957
Energy: 0.6645375316160312
Energy: 0.5630606074399404
Energy: 0.5648524853384052
Energy: 0.6145353881327895
Energy: 0.5619708365326201
Energy: 0.615480191491818
Energy: 0.6111219299071193
Energy: 0.651761021053576
Energy: 0.5624535926318617
Energy: 0.5624732969606759
Energy: 0.6144267929579399
Energy: 0.5758263533792487
Energy: 0.6480906175911314
Energy: 0.6299495629920655
Energy: 0.6081825136226163
Energy: 0.6460632887491564
Energy: 0.6718947053567276
Energy: 0.5625363813103502
Energy: 0.6229288153351563
Energy: 0.6262291462152823
Energy: 0.6733981454827219
Energy: 0.6512966349607727
Energy: 0.6102159762078736
Energy: 0.6198600595344347
Energy: 0.6142521672597188
Energy: 0.6191220748882629
Energy: 0.6010872661715073
Energy: 0.6091688438229319
Energy: 0.6459403370844427
Energy: 0.6108765117584957
Energy: 0.6196086952028065
Energy: 0.6171113181852333
Energy: 0.6174327732418758
Energy: 0.5996483567848663
Energy: 0.6097594545352772
Energy: 0.6097935032096187
Energy: 0.6517310371019668
Energy: 0.6085671072142695
Energy: 0.7015457085004635
Energy: 0.6192657093211528
Energy: 0.6096141173549494
Energy: 0.6648469241002253
Energy: 0.609435880585798
Energy: 0.646048951775683
Energy: 0.6126718231191761
Energy: 0.6175042247731798
Energy: 0.5621602693084048
Energy: 0.6103167100968205
Energy: 0.6071971217566376
Energy: 0.601294570527002
Energy: 0.6284348651213938
Energy: 0.5622128405661438
Energy: 0.6159376940096211
Energy: 0.6181827774592253
Energy: 0.6166884731074623
Energy: 0.6053084037350087
Energy: 0.7800523289143255
Energy: 0.563805031027177
Energy: 0.5648273292747625
Energy: 0.612784844103567
Energy: 0.5634039124570221
Energy: 0.6292187016768103
Energy: 0.7068260991826094
Energy: 0.6008041259507015
Energy: 0.6738749164998281
Energy: 0.6086962097751216
Energy: 0.6171538134225059
Energy: 0.5640341845229059
Energy: 0.6294537244267195
Energy: 0.663656342613598
Energy: 0.6015437779618984
Energy: 0.6089608523135384
Energy: 0.608129693814228
Energy: 0.6254468868030374
Energy: 0.6179853446174823
Energy: 0.6185970028515921
Energy: 0.6093964673324881
Energy: 0.6438444863295496
Energy: 0.6098315440856351
Energy: 0.618326632854191
Energy: 0.617456472015351
Energy: 0.6192062265072289
Energy: 0.5991985119142363
Energy: 0.6110357115162954
Energy: 0.5991527882984771
Energy: 0.6089748114553558
Energy: 0.6072617382198177
Energy: 0.6649774286319049
Energy: 0.6276406673256149
Energy: 0.6108169905801782
Energy: 0.5974509430612182
Energy: 0.5994420668797225
Energy: 0.6511548260490521
Energy: 0.6066134673437634
Energy: 0.6236137517795489
Energy: 0.564117922313409
Energy: 0.6094983530332484
Energy: 0.6750848372535893
Energy: 0.6106330498784899
Energy: 0.6642009966672533
Energy: 0.6087653690426567
Energy: 0.6181579256730744
Energy: 0.6184160037535832
Energy: 0.6004424592597093
Energy: 0.6071618759932697
Energy: 0.6441988830775728
Energy: 0.5633192735308984
Energy: 0.5645488281248641
Energy: 0.6144915486857352
Energy: 0.5617972374855457
Energy: 0.6156407308159041
Energy: 0.6116566982881351
Energy: 0.6009232451904731
Energy: 0.5625611199140035
Energy: 0.5625711064254758
Energy: 0.6143766776416236

minimum gb energy = 0.5617972374855457 eV
minimum distance =  2.64379638923225 Angstroms
sigma value = 21


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

Energy: 0.7855679390840461
Energy: 0.6656381266331082
Energy: 0.6077276551071931
Energy: 0.8383209074116348
Energy: 0.624516662321469
Energy: 0.6220083399459649
Energy: 0.6950339037600076
Energy: 0.651544450423795
Energy: 0.643368298353232
Energy: 0.6291623510974433
Energy: 0.622099573950194
Energy: 0.5406938879612191
Energy: 0.6134802604327407
Energy: 0.6690254625177402
Energy: 0.6335377845835816
Energy: 0.5852500602037192
Energy: 0.6290065645423418
Energy: 0.6233641864597483
Energy: 0.5667295801817003
Energy: 0.6332968047533316
Energy: 0.6084248415364687
Energy: 0.5792045806913272
Energy: 0.5975216150941152
Energy: 0.6703395715701134
Energy: 0.6452565608432977
Energy: 0.5671211848301227
Energy: 0.6672196438465221
Energy: 0.670383449492541
Energy: 0.6080466577966358
Energy: 0.5898582100425637
Energy: 0.6047075791144674
Energy: 0.583302752896535
Energy: 0.5815482582433258
Energy: 0.6128378673691646
Energy: 0.6135989743279415
Energy: 0.5808629657071
Energy: 0.5907141660433649
Energy: 0.6150015800554671
Energy: 0.6044169761191297
Energy: 0.6220054459420016
Energy: 0.598182944027077
Energy: 0.6085759437465353
Energy: 0.6729849471177732
Energy: 0.6030368560778516
Energy: 0.5899931747300353
Energy: 0.6261383275886864
Energy: 0.5943236488829137
Energy: 0.5937405256917402
Energy: 0.6109602368222851
Energy: 0.6038828361608874
Energy: 0.6032630875022156
Energy: 0.6217210568766669
Energy: 0.6304900972454797
Energy: 0.5616298869937291
Energy: 0.6143922741520661
Energy: 0.61642261648531
Energy: 0.6283770761267945
Energy: 0.6214983434591871
Energy: 0.6563675998217652
Energy: 0.6149121552402036
Energy: 0.581329442768689
Energy: 0.6352555084524801
Energy: 0.600177685100291
Energy: 0.7195976657755376
Energy: 0.6621441510663378
Energy: 0.6021889143777773
Energy: 0.6374066392668006
Energy: 0.6315787292020225
Energy: 0.6683425536195201
Energy: 0.591689873832548
Energy: 0.6120672762874421
Energy: 0.6195305537574528
Energy: 0.5987846115628389
Energy: 0.634335894393973
Energy: 0.6038757736597034
Energy: 0.5888016161329396
Energy: 0.6311213570142993
Energy: 0.6984677763427456
Energy: 0.62351619010802
Energy: 0.6888144515129259
Energy: 0.6480851209723747
Energy: 0.665568181700358
Energy: 0.7208500493133462
Energy: 0.6241412516219437
Energy: 0.7190802484663761
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Energy: 0.5931177620574762
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Energy: 0.5655785989672528
Energy: 0.6793040920679652
Energy: 0.568433159059411
Energy: 0.7159138014417907
Energy: 0.6192855359531553
Energy: 0.6045723378619675
Energy: 0.5702011675874543
Energy: 0.6097510005830369
Energy: 0.6067576852573833
Energy: 0.6170060798469983
Energy: 0.611249039734026
Energy: 0.6045701023087059
Energy: 0.6757794385783332
Energy: 0.6208560721323517
Energy: 0.7350029670608006
Energy: 0.601660288171974
Energy: 0.6215894919061558
Energy: 0.7121610359698615
Energy: 0.6224669504845217
Energy: 0.5962923955763167
Energy: 0.6324452249486082
Energy: 0.5676734893993094
Energy: 0.6263093556337684
Energy: 0.6221598267160932
Energy: 0.5853894400833788
Energy: 0.6333905225102713
Energy: 0.596302890203002
Energy: 0.5374583355430711
Energy: 0.5751746686598482
Energy: 0.6225649256390917
Energy: 0.6401598830990453
Energy: 0.6024541545318935
Energy: 0.588344332149011
Energy: 0.6489622897584113
Energy: 0.5790807741913852
Energy: 0.5620255451693558
Energy: 0.6184937672321511
Energy: 0.6093574671338826
Energy: 0.5839176909774485
Energy: 0.601365502691122
Energy: 0.6011684765196995
Energy: 0.5964604618823924
Energy: 0.5930929772577358
Energy: 0.6102300339642766
Energy: 0.6064301093954126
Energy: 0.5998291922182708
Energy: 0.6143606606889226
Energy: 0.6177052000938303
Energy: 0.6266754977374945
Energy: 0.6227493504718253
Energy: 0.6454219439722707
Energy: 0.6008678657640093
Energy: 0.6675669245085578
Energy: 0.6065211225217312
Energy: 0.6370888439886537
Energy: 0.5820298596382931
Energy: 0.6223768982818482
Energy: 0.6129266311959024
Energy: 0.626430544105272
Energy: 0.5791562302906261
Energy: 0.5903072689159164
Energy: 0.6138611334654915
Energy: 0.6206166631386933
Energy: 0.6127722082983323
Energy: 0.6012360570901085
Energy: 0.6132105514580101
Energy: 0.7585881559220148
Energy: 0.6137080831299617
Energy: 0.6096464473825791
Energy: 0.6151411881092123
Energy: 0.6151302126370722
Energy: 0.6324228204645889
Energy: 0.6017266259635313
Energy: 0.6034378886824775
Energy: 0.6060710327822196
Energy: 0.5720054500050327
Energy: 0.62270747737794
Energy: 0.738029774673249
Energy: 0.7417287984079726
Energy: 0.6563601010293171
Energy: 0.5795848714862649
Energy: 0.6038455186573329
Energy: 0.5885359655110518
Energy: 0.6312879474289488
Energy: 0.6098335839388508
Energy: 0.6582381955502595
Energy: 0.6118598324554271

minimum gb energy = 0.5374583355430711 eV
minimum distance =  2.6194910074556 Angstroms
sigma value = 113


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

Energy: 0.7290195192069616
Energy: 0.8218420773559355
Energy: 0.7961430369749894
Energy: 0.6594349869891267
Energy: 0.7326625719500803
Energy: 0.7295695183128512
Energy: 0.6074412923178238
Energy: 0.6240239915199479
Energy: 0.7146356044942047
Energy: 0.665106649705722
Energy: 0.6160400109028297
Energy: 0.7113571021106586
Energy: 0.5858136032021571
Energy: 0.7316947035278235
Energy: 0.7348517965024961
Energy: 0.6660908813205864
Energy: 0.6993958130945963
Energy: 0.6600083715904209
Energy: 0.7145393400340615
Energy: 0.6080499955483778
Energy: 0.7024762724793824
Energy: 0.7222813324587479
Energy: 0.6679851273546316
Energy: 0.6943195231104747
Energy: 0.7496881175136485
Energy: 0.738765558484909
Energy: 0.6913714735155841
Energy: 0.7023571839148482
Energy: 0.5779618274865119
Energy: 0.6146877279137056
Energy: 0.6365133680529284
Energy: 0.6630914301951123
Energy: 0.6415624205038546
Energy: 0.6849950824135728
Energy: 0.7182077393823333
Energy: 0.6383466832303916
Energy: 0.6688228372634294
Energy: 0.6771629962057998
Energy: 0.6687911421200312
Energy: 0.6686428747157058
Energy: 0.6774384007574129
Energy: 0.6774833632426902
Energy: 0.6626612584466697
Energy: 0.5909315211846224
Energy: 0.7001300138312323
Energy: 0.6192798967560589
Energy: 0.6960165202214362
Energy: 0.6690516093931329
Energy: 0.6707174188783853
Energy: 0.6447629135668722
Energy: 0.6190398122229664
Energy: 0.5964236938397425
Energy: 0.6178658456273117
Energy: 0.6530705362887484
Energy: 0.5941114556677635
Energy: 0.5816164521428164
Energy: 0.5820444992807742
Energy: 0.6580851730606948
Energy: 0.6471522229160985
Energy: 0.5900553682408402
Energy: 0.6842243325858929
Energy: 0.7550290400425773
Energy: 0.6421468496131667
Energy: 0.714386830844191
Energy: 0.6288824168561613
Energy: 0.592237383262617
Energy: 0.6235543062599296
Energy: 0.606408463853465
Energy: 0.609500255523537
Energy: 0.6067527263509783
Energy: 0.6370643277311798
Energy: 0.607616275432613
Energy: 0.614229877446667
Energy: 0.5727665966988547
Energy: 0.629575512523222
Energy: 0.6696500712049078
Energy: 0.641216042698682
Energy: 0.6096419751297526
Energy: 0.5924763853273137
Energy: 0.6784361947459338
Energy: 0.6808638528793588
Energy: 0.650704740521299
Energy: 0.7064811524136545
Energy: 0.5973175892815255
Energy: 0.6832618059591943
Energy: 0.6062284410020929
Energy: 0.6281828259428639
Energy: 0.6271674824964943
Energy: 0.6358238413275437
Energy: 0.6294800774719501
Energy: 0.5954978348905215
Energy: 0.680430522708461
Energy: 0.5954583942764434
Energy: 0.6679694485766131
Energy: 0.6218857872272169
Energy: 0.6033295880554163
Energy: 0.6715769631580534
Energy: 0.6133327792995003
Energy: 0.5979822327111435
Energy: 0.7475118192252348
Energy: 0.6477238409353845
Energy: 0.6231192886174626
Energy: 0.633807481871454
Energy: 0.6524288345616
Energy: 0.6348136015905945
Energy: 0.5750395299423097
Energy: 0.619850107710774
Energy: 0.6561724255261874
Energy: 0.6460046173973645
Energy: 0.6096791957748762
Energy: 0.681456497218095
Energy: 0.6817780670740835
Energy: 0.6650659952199096
Energy: 0.6924341586020831
Energy: 0.655871132726974
Energy: 0.7205154652850788
Energy: 0.7029607807989813
Energy: 0.7244861726011352
Energy: 0.5907679718753299
Energy: 0.6494487126928785
Energy: 0.7102278746896851
Energy: 0.6960325905097395
Energy: 0.7387706886160874
Energy: 0.7184436562783673
Energy: 0.6802512827459297
Energy: 0.7233802470575229
Energy: 0.6696882461835091
Energy: 0.6528928453713678
Energy: 0.6221477560117811
Energy: 0.6690006320924088
Energy: 0.6488036156191322
Energy: 0.6346342180064787
Energy: 0.6749028963993214
Energy: 0.6087477570103039
Energy: 0.6675810337714795
Energy: 0.7446418072418162
Energy: 0.6717800264266804
Energy: 0.7334749223849334
Energy: 0.6915271203707187
Energy: 0.7229295393243753
Energy: 0.6981893625780732
Energy: 0.6136352919379134
Energy: 0.6208389570426966
Energy: 0.6614358317491148
Energy: 0.7339586376073277
Energy: 0.7173394838166436
Energy: 0.7290873376719325
Energy: 0.6995147043142514
Energy: 0.6750054257368392
Energy: 0.6994724383113997
Energy: 0.6986229081997644
Energy: 0.7412030880445143
Energy: 0.7174862604411709
Energy: 0.7233164750731158
Energy: 0.7278634265822853
Energy: 0.6600916944458541
Energy: 0.7916437713820587
Energy: 0.7593784726437505
Energy: 0.7320646125445603
Energy: 0.6909745919164112
Energy: 0.6694555696577772
Energy: 0.6908727658449302
Energy: 0.7191021903508423
Energy: 0.6361225002865666
Energy: 0.6617627684766719
Energy: 0.651484023791291
Energy: 0.5800906277246746
Energy: 0.7327237119027193
Energy: 0.6528529411756148
Energy: 0.666534400525945
Energy: 0.6878672764864365
Energy: 0.6610863698124093
Energy: 0.7412671629673546
Energy: 0.679586904957972
Energy: 0.7448994591172173
Energy: 0.7009112728514912
Energy: 0.6654805274206238
Energy: 0.6945010246635467
Energy: 0.7503219927034669
Energy: 0.7157673275135717
Energy: 0.6912236049739686
Energy: 0.597432700871263
Energy: 0.6206841633535546
Energy: 0.6292245735776619
Energy: 0.7107859460985706
Energy: 0.6637583900671136
Energy: 0.6200034939002602
Energy: 0.6887444297200704
Energy: 0.6530885770373027
Energy: 0.6378701926117688
Energy: 0.6394745783011793
Energy: 0.6562445275878983
Energy: 0.6359884396518831
Energy: 0.6540807840188764
Energy: 0.6783240986681
Energy: 0.708452404268751
Energy: 0.6650612253725658
Energy: 0.5890282834759047
Energy: 0.6640485809374579
Energy: 0.6765415357049197
Energy: 0.6806358896856116
Energy: 0.6693855781589266
Energy: 0.6468948242863075
Energy: 0.682417580103156
Energy: 0.6160374228690281
Energy: 0.6275839311341496
Energy: 0.6300256565687723
Energy: 0.6433500116646056
Energy: 0.6252439036367304
Energy: 0.5820551129156649
Energy: 0.5831355980277166
Energy: 0.6385817166973556
Energy: 0.6479855481674631
Energy: 0.6232062821520734
Energy: 0.6695342065801282
Energy: 0.6771337327969918
Energy: 0.676265746426254
Energy: 0.608351005986898
Energy: 0.640577857433309
Energy: 0.5912715826705645
Energy: 0.6070794562279989
Energy: 0.5939972996095539
Energy: 0.6116830864036895
Energy: 0.6057664049136982
Energy: 0.6353627565858283
Energy: 0.6016377717879702
Energy: 0.6118120688367991
Energy: 0.6362636248061007
Energy: 0.6393606054805594
Energy: 0.6246693631413923
Energy: 0.6399232781505614
Energy: 0.5866784199409097
Energy: 0.5935952131303639
Energy: 0.6779132818981157
Energy: 0.7010663657234918
Energy: 0.6985949418876067
Energy: 0.7072904815335364
Energy: 0.6427257254990945
Energy: 0.6107472653326701
Energy: 0.6057553647716274
Energy: 0.6285384276672535
Energy: 0.6276448587534242
Energy: 0.6120237857071849
Energy: 0.6383592297913832
Energy: 0.5952897041898244
Energy: 0.6790938630006411
Energy: 0.6170500764241702
Energy: 0.6675479519644069
Energy: 0.6286490167784784
Energy: 0.6045085213552701
Energy: 0.6637531831303155
Energy: 0.6002887041307942
Energy: 0.6099851921597453
Energy: 0.6462000434676872
Energy: 0.6470862139225948
Energy: 0.5903486004010269
Energy: 0.633118867229744
Energy: 0.6521178257366054
Energy: 0.6282218668338542
Energy: 0.5763819331977833
Energy: 0.6159470850499541
Energy: 0.6544644690689355
Energy: 0.646287063900412
Energy: 0.6208878590071918
Energy: 0.6563202613800281
Energy: 0.6781147133921117
Energy: 0.6606978636073502
Energy: 0.6657480232522903
Energy: 0.656079292701982
Energy: 0.6994376957203525
Energy: 0.702632364827161
Energy: 0.6822080013937969
Energy: 0.62027495234952
Energy: 0.6508436156384316
Energy: 0.6894279139462803
Energy: 0.696890652633201
Energy: 0.6626465953201668
Energy: 0.676305259640971
Energy: 0.611043935308699
Energy: 0.6848856019359528
Energy: 0.715451684540102
Energy: 0.7535885477135452
Energy: 0.6893524649270962
Energy: 0.6951943844520561
Energy: 0.5913982010529765
Energy: 0.602707037204604
Energy: 0.7018938967341285
Energy: 0.6818239272088265
Energy: 0.6672942154311525
Energy: 0.7446779808028932
Energy: 0.628075756900514
Energy: 0.7325353848752919
Energy: 0.7227110688424729
Energy: 0.6765843793877668
Energy: 0.6992279875009072
Energy: 0.6070054114124139
Energy: 0.6229319244892245
Energy: 0.6597334937195821
Energy: 0.7483834072262474
Energy: 0.7166971251003007
Energy: 0.701945993563605
Energy: 0.6983185050802445
Energy: 0.6813106489981151
Energy: 0.6995900849419868
Energy: 0.6998208735496729
Energy: 0.7459496021067705
Energy: 0.7175686011311061
Energy: 0.6948458725784177
Energy: 0.7194057613206261
Energy: 0.683664721515989
Energy: 0.7916392558830218
Energy: 0.762242733135935
Energy: 0.705349281523477
Energy: 0.6916189038893344
Energy: 0.6690640938696893

minimum gb energy = 0.5727665966988547 eV
minimum distance =  2.60236803745286 Angstroms
sigma value = 365


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

Energy: 0.6430295520956236
Energy: 0.7967664179067672
Energy: 0.6329298046480405
Energy: 0.5748281621203871
Energy: 0.5741296225311502
Energy: 0.6296588335546185
Energy: 0.6353887406956462
Energy: 0.6185210402362008
Energy: 0.6911950412553112
Energy: 0.5744046854613394
Energy: 0.5756453455125748
Energy: 0.5753355799173112
Energy: 0.5748439685834225
Energy: 0.6909757087223781
Energy: 0.6191386608619709
Energy: 0.6895889227777278
Energy: 0.5754950820182376
Energy: 0.5747614327177731
Energy: 0.5753681661009837
Energy: 0.575216552095973
Energy: 0.5753412102561807
Energy: 0.6197698019506096
Energy: 0.6899954064466273
Energy: 0.5748918743200497
Energy: 0.5749172891957715
Energy: 0.5747137916786569
Energy: 0.5752389632506058
Energy: 0.5761228911770121
Energy: 0.6396068753080287
Energy: 0.6912245130814026
Energy: 0.6183334485994993
Energy: 0.6902532652683371
Energy: 0.574870736790741
Energy: 0.6171450859535653
Energy: 0.690829926889016
Energy: 0.6245607740501752
Energy: 0.7633264372643817
Energy: 0.5745801628777013
Energy: 0.5741854879378511
Energy: 0.5742306969621961
Energy: 0.5745030536115044
Energy: 0.6360082157827344
Energy: 0.6194891809113197
Energy: 0.6902958252301474
Energy: 0.5746411027625841
Energy: 0.5756908164696266
Energy: 0.5753627549354478
Energy: 0.5749164100166828
Energy: 0.6904827290580039
Energy: 0.6196365898251414
Energy: 0.690359987677147
Energy: 0.5753104383021681
Energy: 0.5750750446565709
Energy: 0.5755484241299075
Energy: 0.5752264664666218
Energy: 0.6905025453110809
Energy: 0.6216123934715831
Energy: 0.7623558531626731
Energy: 0.5744397771542481
Energy: 0.5744509528094681
Energy: 0.5744968743672073
Energy: 0.5747140265847627
Energy: 0.6369330907007044
Energy: 0.6393446168767121
Energy: 0.6910871584873592
Energy: 0.6184025439660158
Energy: 0.6906980991075312
Energy: 0.6916253119833454
Energy: 0.6173605835496503
Energy: 0.6911462753844123
Energy: 0.6208025263272251
Energy: 0.6911954437031631
Energy: 0.5750744179583942
Energy: 0.574331864009662
Energy: 0.5748642961927767
Energy: 0.5746883329450058
Energy: 0.6380606839089391
Energy: 0.6191209776578687
Energy: 0.6901612906545067
Energy: 0.5752978116475497
Energy: 0.5754086598711454
Energy: 0.575040515521038
Energy: 0.5754831206782706
Energy: 0.6901690970643449
Energy: 0.6198486825895286
Energy: 0.6901683478489159
Energy: 0.5744030459794173
Energy: 0.5755410972398881
Energy: 0.5756410912058169
Energy: 0.5748733470739882
Energy: 0.6907914307012802
Energy: 0.622660352497707
Energy: 0.7636564390577003
Energy: 0.5749659444682441
Energy: 0.5742233329523287
Energy: 0.5742105333682019
Energy: 0.5749099715851402
Energy: 0.6355539499731317
Energy: 0.6398679682720834
Energy: 0.6914488153525236
Energy: 0.6181501683020064
Energy: 0.5746343167315267
Energy: 0.5752015190988679
Energy: 0.5742733912608448
Energy: 0.6906549541747454
Energy: 0.6196919164026659
Energy: 0.6893830258535534
Energy: 0.5753010132655102
Energy: 0.5748528404697021
Energy: 0.5750207077080097
Energy: 0.5748545788682867
Energy: 0.5755516794239927
Energy: 0.6193820119959266
Energy: 0.6897108401930472
Energy: 0.5751271474157679
Energy: 0.5751116182921214
Energy: 0.5748233628401374
Energy: 0.5754400077940667
Energy: 0.5755048497804901
Energy: 0.6401027395166532
Energy: 0.691209099450528
Energy: 0.5740216262355564
Energy: 0.5752889569918295
Energy: 0.575297438227122
Energy: 0.5745710890203302
Energy: 0.6906174158912376
Energy: 0.6343357693562315
Energy: 0.7637614289054158
Energy: 0.5762545048139016
Energy: 0.5738995081240024
Energy: 0.575015655882734
Energy: 0.5762233412453314
Energy: 0.635400130367259
Energy: 0.619779917303892
Energy: 0.6906131298234575
Energy: 0.5744653008646612
Energy: 0.5757680460639846
Energy: 0.5755570674885966
Energy: 0.5747781601670994
Energy: 0.6909487599003793

minimum gb energy = 0.5738995081240024 eV
minimum distance =  2.69045674711707 Angstroms
sigma value = 23