Model name: model_name=EAM_Dynamo_PanBorovikovMendelev_2108_AgNi__MO_222110751402_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ag
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.160539835691452
cohesive_energy=2.971621318316131
mass=107.8682
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5713940143309577e-19, 2.10155906905146e-19, 2.47699711969668e-19, 2.78764314726294e-19, 3.0514895953500597e-19, 3.27814952376204e-19, 3.4757299462669197e-19, 3.64817221738434e-19, 3.7982320809247797e-19, 3.9289536724928396e-19, 4.0436534977208996e-19, 4.1455839751759798e-19, 4.23766106633196e-19, 4.3220957749437592e-19, 4.40028199468296e-19, 4.47270037853976e-19, 4.538934360589319e-19, 4.5979265042532e-19, 4.64866743825198e-19, 4.6901317695399e-19, 4.72183884512676e-19, 4.74383673031158e-19, 4.7565900563182195e-19, 4.76069162850126e-19, 4.75634972982312e-19, 4.742426814873659e-19, 4.71727264171986e-19, 4.67866018484046e-19, 4.62365746099524e-19, 4.54843526802894e-19, 4.44825116310492e-19, 4.3173853756398e-19, 4.14912478553712e-19, 3.9356988361219797e-19, 3.6682955559073794e-19, 3.33730188508932e-19, 2.9309418254079e-19, 2.4281307323596797e-19, 1.7848888573413597e-19, 9.737084297237939e-20, -4.28615895304314e-21, -1.3267208140229158e-19, -2.9739602680308e-19, -5.1270453376317e-19, -7.99441279420248e-19, -1.190971592177364e-18, -1.7456515515747e-18, -2.5754508738559797e-18, -3.9212311811169594e-18, -6.38364849344424e-18, -1.16231506090164e-17, -2.5185415598162997e-17, -7.056610745023259e-17, -2.84248565344476e-16]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.008652811745527109
Energy: 0.06899885260005514
Energy: 0.4621187316477308
Energy: 0.0689988525982137
Energy: 0.06899885259867407
Energy: 0.5411703771782662
Energy: 0.06899885260144939
Energy: 0.5411703773198738
Energy: 0.4621187307892595
Energy: 0.06899885260005514
Energy: 0.008652811745527109
Energy: 0.06899885260052867
Energy: 0.06899885260098904
Energy: 0.5411703771893674
Energy: 0.06899885259913442
Energy: 0.541170377198167

minimum gb energy = 0.008652811745527109 eV
minimum distance =  2.84685232571321 Angstroms
sigma value = 1


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

Energy: 0.862981460563024
Energy: 0.5798392597535524
Energy: 0.5802138696222037
Energy: 0.5798392597524038
Energy: 0.5589678606814638
Energy: 0.5985465224965528
Energy: 0.558437394217629
Energy: 0.598546522497127
Energy: 0.5799167404672032
Energy: 0.580228021376977
Energy: 0.558735602245785
Energy: 0.580228021376977
Energy: 0.5609954203791395
Energy: 0.5588191668911459
Energy: 0.5583823627295259
Energy: 0.5588191668905717
Energy: 0.5993433519972436
Energy: 0.559092267339213
Energy: 0.5600545920217906
Energy: 0.5590922673380645
Energy: 0.5614143375175249
Energy: 0.6311769991600471
Energy: 0.5583804006309316
Energy: 0.6311769991594729
Energy: 0.5898889800449385
Energy: 0.6081882047160488
Energy: 0.5997220857147076
Energy: 0.6081882047149002
Energy: 0.5912317369899979
Energy: 0.620579707773996
Energy: 0.5779827196126274
Energy: 0.6205797077745703
Energy: 0.5968723737182372
Energy: 0.6333996437483068
Energy: 0.5995728321673053
Energy: 0.6333996437494552
Energy: 0.602093342622636
Energy: 0.6235656843423643
Energy: 0.5981239964178086
Energy: 0.6235656843406415
Energy: 0.5961856554452355
Energy: 0.633436336592698
Energy: 0.597571571167358
Energy: 0.633436336592698
Energy: 0.5924501803508222
Energy: 0.6326722641464202
Energy: 0.5758162528579102
Energy: 0.6326722641464202
Energy: 0.591031759472974
Energy: 0.6075834324767899
Energy: 0.6003022975690092
Energy: 0.6075834324767899
Energy: 0.5618893105606179
Energy: 0.6085118082359574
Energy: 0.5892053016722769
Energy: 0.6085118082365317
Energy: 0.6008184328961822
Energy: 0.5588514092640212
Energy: 0.5587217302838177
Energy: 0.5588514092645955
Energy: 0.5425587019793252
Energy: 0.5601262211332696
Energy: 0.5587208084142944
Energy: 0.5601262211338439
Energy: 0.5799259806816586
Energy: 0.5796915301453222
Energy: 0.5430235609611012
Energy: 0.579691530144748
Energy: 0.5581131919260932
Energy: 0.5589501932487034
Energy: 0.5747523562831263
Energy: 0.558950193249852
Energy: 0.5738570682373503
Energy: 0.5799790573278851
Energy: 0.5804590130705148
Energy: 0.5799790573290339
Energy: 0.5612658687694343
Energy: 0.5592976786372434
Energy: 0.5607302503979104
Energy: 0.5592976786355206
Energy: 0.5601557579111536
Energy: 0.5603908991755929
Energy: 0.5901756307146314
Energy: 0.5603908991755929
Energy: 0.5586844329385422
Energy: 0.559051171029035
Energy: 0.5619815595458241
Energy: 0.5590511710307577
Energy: 0.5992729878120294
Energy: 0.6084822993633642
Energy: 0.5886993498323541
Energy: 0.60848229936279
Energy: 0.5735721721571686
Energy: 0.6084675803591542
Energy: 0.5896796293738343
Energy: 0.6084675803591542
Energy: 0.5998521747114243
Energy: 0.6335328527609899
Energy: 0.5969425606344163
Energy: 0.6335328527609899
Energy: 0.597993657324159
Energy: 0.6322853734325772
Energy: 0.6029188013964129
Energy: 0.632285373432003
Energy: 0.5972812134841482
Energy: 0.6334937331340256
Energy: 0.5987889292081378
Energy: 0.6334937331345999
Energy: 0.6041695078372351
Energy: 0.6323674259071002
Energy: 0.5995801944312833
Energy: 0.6323674259071002
Energy: 0.6003819720932405
Energy: 0.6075897087624763
Energy: 0.6084833298456191
Energy: 0.6075897087613278
Energy: 0.5894472025200194
Energy: 0.608339849893987
Energy: 0.5627118058912515
Energy: 0.6083398498945614
Energy: 0.5583848704296452
Energy: 0.5584011529724408
Energy: 0.590979843828773
Energy: 0.5584011529712922
Energy: 0.558160718645717
Energy: 0.5597006199838499
Energy: 0.5424884945460292
Energy: 0.5597006199821272
Energy: 0.5420560614271286
Energy: 0.5607058085974329
Energy: 0.5808728460190221
Energy: 0.5607058085985814

minimum gb energy = 0.5420560614271286 eV
minimum distance =  2.60499416364536 Angstroms
sigma value = 1


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

Energy: 0.976504878618512
Energy: 0.6093562039341237
Energy: 0.6095218061386803
Energy: 0.6093562039315046
Energy: 0.58826256743002
Energy: 0.6279200098297233
Energy: 0.5881324104287935
Energy: 0.6279200098323423
Energy: 0.6093230279794725
Energy: 0.609521828086057
Energy: 0.5874968060030745
Energy: 0.6095218280926047
Energy: 0.5909363474610355
Energy: 0.5881881164335552
Energy: 0.588432203247179
Energy: 0.58818811643421
Energy: 0.5879135386104958
Energy: 0.5879416368988393
Energy: 0.58863649867006
Energy: 0.587941636896875
Energy: 0.5908659063836101
Energy: 0.5881612682700165
Energy: 0.5874646241988938
Energy: 0.5881612682621593
Energy: 0.6248497633519039
Energy: 0.6460730315793812
Energy: 0.6231418407818916
Energy: 0.6460730315846195
Energy: 0.6239610642864833
Energy: 0.6478471850684325
Energy: 0.604414842607426
Energy: 0.6478471850677777
Energy: 0.6235441986535022
Energy: 0.6697380968404946
Energy: 0.6284272756054522
Energy: 0.6697380968385303
Energy: 0.6053651795922078
Energy: 0.6701156831184858
Energy: 0.625715567930658
Energy: 0.6701156831224144
Energy: 0.624450124163119
Energy: 0.645296171742423
Energy: 0.6255671919302047
Energy: 0.6452961717476611
Energy: 0.6237332959858902
Energy: 0.6464536024012851
Energy: 0.5899097635463826
Energy: 0.6464536024025946
Energy: 0.5883164630766391
Energy: 0.5883470203807708
Energy: 0.6134725378709854
Energy: 0.5883470203827351
Energy: 0.5879572006764722
Energy: 0.5880952865750338
Energy: 0.5667822151348773
Energy: 0.5880952865730695
Energy: 0.5673130497695827
Energy: 0.6098361767462234
Energy: 0.6088809439430196
Energy: 0.6098361767488425
Energy: 0.6081018030065235
Energy: 0.5884787026110014
Energy: 0.5881181957377796
Energy: 0.5884787026083823
Energy: 0.6097774541738038
Energy: 0.6095617616463634
Energy: 0.5877569678708174
Energy: 0.6095617616450539
Energy: 0.5907181854229205
Energy: 0.5879495279789508
Energy: 0.5912409481935729
Energy: 0.5879495279782961
Energy: 0.5877274497182949
Energy: 0.5903231739321815
Energy: 0.5907367078100069
Energy: 0.5903231739354553
Energy: 0.5906257170361199
Energy: 0.5883848827677554
Energy: 0.587343738767003
Energy: 0.5883848827703745
Energy: 0.6239489289720669
Energy: 0.672736761105099
Energy: 0.6232472216633904
Energy: 0.6727367611044442
Energy: 0.622952315857702
Energy: 0.6467134696145409
Energy: 0.6037655898089718
Energy: 0.6467134696138862
Energy: 0.6240283310663985
Energy: 0.6693456477168571
Energy: 0.6277551105832546
Energy: 0.669345647713613
Energy: 0.6045173030265509
Energy: 0.6698607255469211
Energy: 0.6328114899440862
Energy: 0.6698607255449568
Energy: 0.6251169036817085
Energy: 0.6446531221742592
Energy: 0.6512093139092703
Energy: 0.6446531221775034
Energy: 0.6240781365570828
Energy: 0.6459074965697128
Energy: 0.5931811871325695
Energy: 0.6459074965729866
Energy: 0.5876588261612903
Energy: 0.5879931560783855
Energy: 0.6120104073425013
Energy: 0.5879931560803499
Energy: 0.5874997418031445
Energy: 0.5882224566487411
Energy: 0.5677298433968906
Energy: 0.5882224566487411
Energy: 0.566754975547004
Energy: 0.5899536255651244
Energy: 0.6091837894747144
Energy: 0.5899536255677434

minimum gb energy = 0.566754975547004 eV
minimum distance =  2.60482423207275 Angstroms
sigma value = 25


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

Energy: 0.9318766144108918
Energy: 0.6423498247475006
Energy: 0.6426869592196301
Energy: 0.6423498247475006
Energy: 0.6227144211583192
Energy: 0.6599886777620253
Energy: 0.6223549201005548
Energy: 0.6599886777620253
Energy: 0.6422294433460414
Energy: 0.6423542718611209
Energy: 0.6218570073203888
Energy: 0.6423542718618821
Energy: 0.6250375575460174
Energy: 0.6224271477986854
Energy: 0.6225747893743525
Energy: 0.6224271477971629
Energy: 0.6218849193924102
Energy: 0.622411107267688
Energy: 0.6239102084036148
Energy: 0.622411107267688
Energy: 0.6245290041313503
Energy: 0.6263240320832718
Energy: 0.6228325687182307
Energy: 0.6263240320840331
Energy: 0.6638772491501441
Energy: 0.6927871416029409
Energy: 0.6590348004092127
Energy: 0.6927871416029409
Energy: 0.6591364144379523
Energy: 0.6939543285842475
Energy: 0.6037169707218164
Energy: 0.6939543285834864
Energy: 0.6604874820344132
Energy: 0.6916640413938749
Energy: 0.6537322667134069
Energy: 0.69166404139538
Energy: 0.6263557094709198
Energy: 0.6927346719472796
Energy: 0.6220318628299226
Energy: 0.6927346719472796
Energy: 0.593605272580058
Energy: 0.6219737324949923
Energy: 0.6228501683101774
Energy: 0.6219737324957536
Energy: 0.5932413352929338
Energy: 0.6226383911638621
Energy: 0.6229590735364173
Energy: 0.6226383911653843
Energy: 0.6418195500483456
Energy: 0.6420936745450773
Energy: 0.5945828276166151
Energy: 0.6420936745435549
Energy: 0.6224524545850139
Energy: 0.6258072144622259
Energy: 0.6537401999690433
Energy: 0.6258072144637481
Energy: 0.6219918951665293
Energy: 0.6428545128951594
Energy: 0.6436509427817462
Energy: 0.6428545128959205
Energy: 0.623826407575003
Energy: 0.6223737207548578
Energy: 0.6248770269840125
Energy: 0.6223737207533354
Energy: 0.626337178429393
Energy: 0.6251845169094141
Energy: 0.6215800531139404
Energy: 0.6251845169094141
Energy: 0.6230229391899651
Energy: 0.6224206416948053
Energy: 0.6255338141300792
Energy: 0.6224206416955663
Energy: 0.6589289999472155
Energy: 0.7159162377303135
Energy: 0.6628498223964692
Energy: 0.7159162377303135
Energy: 0.6039542636140514
Energy: 0.6934298901582614
Energy: 0.6605352186189848
Energy: 0.6934298901582614
Energy: 0.6539429658582533
Energy: 0.6911952908775186
Energy: 0.6603733370175134
Energy: 0.6911952908767575
Energy: 0.6541149827478515
Energy: 0.6915405890374283
Energy: 0.6254389730778499
Energy: 0.6915405890374283
Energy: 0.6219951594667098
Energy: 0.6217532652185871
Energy: 0.593531068091272
Energy: 0.6217532652185871
Energy: 0.622336163353078
Energy: 0.6220143478866358
Energy: 0.5934427169413097
Energy: 0.6220143478851136
Energy: 0.5931272106983463
Energy: 0.6248350726286154
Energy: 0.6426822577468784
Energy: 0.6248350726286154

minimum gb energy = 0.5931272106983463 eV
minimum distance =  2.60476149179427 Angstroms
sigma value = 9


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

Energy: 0.867159086630869
Energy: 0.6789050506144492
Energy: 0.6796245099564646
Energy: 0.6789050506144492
Energy: 0.6657573489786378
Energy: 0.6935369009465874
Energy: 0.6650951364161547
Energy: 0.6935369009484036
Energy: 0.6791946899304578
Energy: 0.679050759589538
Energy: 0.6782052220509035
Energy: 0.6790507595886299
Energy: 0.6593661927490577
Energy: 0.6940190514338318
Energy: 0.6652141573017564
Energy: 0.6940190514329239
Energy: 0.6629139922946818
Energy: 0.6642404239620837
Energy: 0.6648351959111677
Energy: 0.6642404239629918
Energy: 0.7067733674204618
Energy: 0.6671247823062345
Energy: 0.665231322949284
Energy: 0.6671247823071426
Energy: 0.7037721183941484
Energy: 0.747702530162449
Energy: 0.6651031971901855
Energy: 0.747702530162449
Energy: 0.6654130011245188
Energy: 0.7468979013400435
Energy: 0.6657832260897603
Energy: 0.7468979013418594
Energy: 0.6630266268744869
Energy: 0.6638272685983955
Energy: 0.6205252827020836
Energy: 0.6638272685974874
Energy: 0.6652940046751621
Energy: 0.6644394914968513
Energy: 0.6205562278842933
Energy: 0.6644394914959434
Energy: 0.6199111333506996
Energy: 0.6786982267306944
Energy: 0.6784077481690801
Energy: 0.6786982267288784
Energy: 0.6960584078633706
Energy: 0.6603399579410008
Energy: 0.6652234807847255
Energy: 0.6603399579400928
Energy: 0.6787390699167767
Energy: 0.679196342401637
Energy: 0.6782028567403092
Energy: 0.679196342400729
Energy: 0.6804975352211258
Energy: 0.6639919143057406
Energy: 0.6792788012249881
Energy: 0.6639919143039246
Energy: 0.663203760768734
Energy: 0.6584240366026961
Energy: 0.6650566291325593
Energy: 0.6584240366063281
Energy: 0.6588868226095593
Energy: 0.6641134007583535
Energy: 0.6646746295445837
Energy: 0.6641134007592614
Energy: 0.6943709395259234
Energy: 0.7588712446760876
Energy: 0.6651361352223253
Energy: 0.7588712446751796
Energy: 0.6944393028334757
Energy: 0.7483095916302538
Energy: 0.6652308753655477
Energy: 0.7483095916284586
Energy: 0.6623449793881181
Energy: 0.6638378933098049
Energy: 0.6204569705315229
Energy: 0.6638378933079889
Energy: 0.6651165467540296
Energy: 0.6639129088898618
Energy: 0.6204759713450183
Energy: 0.6639129088916779
Energy: 0.6200013491959727
Energy: 0.6588779725297929
Energy: 0.6800029807702198
Energy: 0.6588779725297929

minimum gb energy = 0.6199111333506996 eV
minimum distance =  2.63958842573811 Angstroms
sigma value = 25


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

Energy: 0.7756210880665482
Energy: 0.7207322119874119
Energy: 0.7214693001496245
Energy: 0.7207322119874119
Energy: 0.7353709286344029
Energy: 0.7041654669800993
Energy: 0.670100733744385
Energy: 0.7041654669800993
Energy: 0.7206335152689696
Energy: 0.720445085251834
Energy: 0.7188547472223151
Energy: 0.7204450852529569
Energy: 0.7207306931741156
Energy: 0.704393824780706
Energy: 0.6701525406439518
Energy: 0.704393824780706
Energy: 0.7124345907834851
Energy: 0.7184479824370664
Energy: 0.6705114155354673
Energy: 0.7184479824393122
Energy: 0.6525934311856173
Energy: 0.717969329913908
Energy: 0.6689203338008523
Energy: 0.7179693300396246
Energy: 0.649473985293124
Energy: 0.7178020513510595
Energy: 0.6704474256522746
Energy: 0.7178020513521823
Energy: 0.6499656639321604
Energy: 0.7050663823110852
Energy: 0.6703734113149922
Energy: 0.7050663823122082
Energy: 0.7196607706127395
Energy: 0.7202730123881078
Energy: 0.7817061839241353
Energy: 0.7202730123881078
Energy: 0.7351619092478141
Energy: 0.6542527347040299
Energy: 0.7177514033868589
Energy: 0.6542527347029069
Energy: 0.7188751519583946
Energy: 0.7203693513038765
Energy: 0.7204825332013993
Energy: 0.7203693513038765
Energy: 0.7190266339564733
Energy: 0.7063178504385131
Energy: 0.7210236525842298
Energy: 0.7063178504385131
Energy: 0.6696706183261812
Energy: 0.655253733231674
Energy: 0.7124967576873327
Energy: 0.6552537332440262
Energy: 0.6703642627534399
Energy: 0.719310271529986
Energy: 0.6541795346223982
Energy: 0.7193102715322317
Energy: 0.7137651016122569
Energy: 0.717054467109588
Energy: 0.6495476401198005
Energy: 0.717054467109588
Energy: 0.6696901344414572
Energy: 0.66971738073068
Energy: 0.6498771267606614
Energy: 0.6697173807261884
Energy: 0.7834963181761416
Energy: 0.6532446147734472
Energy: 0.7233798462013763
Energy: 0.6532446147745701

minimum gb energy = 0.649473985293124 eV
minimum distance =  2.68212281668123 Angstroms
sigma value = 17


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

Energy: 1.0495535222952286
Energy: 0.7822055042129614
Energy: 0.7814579350462892
Energy: 0.7822055042129614
Energy: 0.6854047521267616
Energy: 0.7105837432420782
Energy: 0.7630223274218002
Energy: 0.7105837432369904
Energy: 0.7056581079431204
Energy: 0.7052299128598036
Energy: 0.7480546282576221
Energy: 0.7052299128591678
Energy: 0.7057092969645447
Energy: 0.7483314462913977
Energy: 0.7041504489955
Energy: 0.748331446288854
Energy: 0.7063710238821646
Energy: 0.776417511584244
Energy: 0.6706020979514767
Energy: 0.7764175115817002
Energy: 0.7056405986764552
Energy: 0.7516044507545889
Energy: 0.7050997555944203
Energy: 0.7516044507545889
Energy: 0.7358445651408204
Energy: 0.7047379578254436
Energy: 0.7057561865966785
Energy: 0.7047379578273515
Energy: 0.8228889006723283
Energy: 0.7055328217533164
Energy: 0.6864716804349263
Energy: 0.7055328217526805
Energy: 0.785607531546142
Energy: 0.7820856939717219
Energy: 0.7817478344338459
Energy: 0.7820856939723578
Energy: 0.7857247098935166
Energy: 0.7522652819783104
Energy: 0.7632373594664643
Energy: 0.7522652819808545
Energy: 0.7038176756814504
Energy: 0.6858602171327314
Energy: 0.6843964139346768
Energy: 0.6858602171320954
Energy: 0.7954396639586849
Energy: 0.7093394457483063
Energy: 0.6868452980840544
Energy: 0.7093394457425826
Energy: 0.7364004905786107
Energy: 0.7092877140152575
Energy: 0.7072784498077579
Energy: 0.7092877140139855
Energy: 0.7359427694816314
Energy: 0.7088125325677923
Energy: 0.6848689065173309
Energy: 0.7088125325671564
Energy: 0.7832231311465824
Energy: 0.7943490367687089
Energy: 0.8313835762888779
Energy: 0.7943490367693449
Energy: 0.7826601122867318
Energy: 0.7824761678388803
Energy: 0.8226589528307209
Energy: 0.7824761678395163
Energy: 0.7821153671112555
Energy: 0.7049248764012168
Energy: 0.7050390849554435
Energy: 0.7049248764005807
Energy: 0.7824674177002248
Energy: 0.7053251835129487
Energy: 0.7033723702602869
Energy: 0.7053251835135846
Energy: 0.705671303784543
Energy: 0.7762239750769238
Energy: 0.7054742807282213
Energy: 0.7762239750769238
Energy: 0.7411883670291792
Energy: 0.7512176403261777
Energy: 0.7050771479295481
Energy: 0.7512176403306294
Energy: 0.7053186187014316
Energy: 0.7047917708174961
Energy: 0.7943787490775983
Energy: 0.7047917708168602
Energy: 0.7056450499989454
Energy: 0.7055326120525599
Energy: 0.8706469490752123
Energy: 0.7055326120544677
Energy: 0.7486348444329943
Energy: 0.7493106274339129
Energy: 0.75512450951319
Energy: 0.7493106274326408
Energy: 0.7827157737679878
Energy: 0.7817824494228608
Energy: 0.7815958751694109
Energy: 0.7817824494228608
Energy: 0.6851372822760974
Energy: 0.7091193615908365
Energy: 0.7819305918379317
Energy: 0.7091193616270869
Energy: 0.6868524632227848
Energy: 0.7094082234439999
Energy: 0.7048548488148793
Energy: 0.709408223443364
Energy: 0.6840990557059815
Energy: 0.6852561070585662
Energy: 0.7378755772272204
Energy: 0.6852561070585662
Energy: 0.6898564762589459
Energy: 0.6859677064858928
Energy: 0.7362919758772597
Energy: 0.6859677064852567
Energy: 0.6857589130656949
Energy: 0.7088639963786761
Energy: 0.7364141300031048
Energy: 0.7088639575197029
Energy: 0.8222376194951518
Energy: 0.7815036262698966
Energy: 0.7804777852023593
Energy: 0.7815036262692606

minimum gb energy = 0.6706020979514767 eV
minimum distance =  2.63775750839065 Angstroms
sigma value = 53


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

Energy: 0.9575902736241777
Energy: 0.7433246835912305
Energy: 0.744115704915836
Energy: 0.7433246835906482
Energy: 0.7418001688901833
Energy: 0.694508822981185
Energy: 0.740590769747958
Energy: 0.694508822982649
Energy: 0.7429564776942971
Energy: 0.7419038293894844
Energy: 0.7425764561232266
Energy: 0.7419038293910983
Energy: 0.7411444964832187
Energy: 0.6950075248800278
Energy: 0.7431996447583633
Energy: 0.6950075248803106
Energy: 0.7432485671434875
Energy: 0.6946424959965877
Energy: 0.6483441482356102
Energy: 0.6946424959935096
Energy: 0.7430608033914062
Energy: 0.6972718618977972
Energy: 0.6489942839514125
Energy: 0.697271861897664
Energy: 0.8231898576844945
Energy: 0.7409027852148412
Energy: 0.7406470455712575
Energy: 0.7409027852151407
Energy: 0.8231710346154018
Energy: 0.6962503893603028
Energy: 0.7422827612569761
Energy: 0.6962503893610349
Energy: 0.7423841956828751
Energy: 0.741714537473137
Energy: 0.7408699238579768
Energy: 0.7417145374753331
Energy: 0.7431540860856181
Energy: 0.696662113737974
Energy: 0.7413737906158971
Energy: 0.6966621137365099
Energy: 0.7433085477923488
Energy: 0.697567611203379
Energy: 0.6673094876494692
Energy: 0.6975676112044105
Energy: 0.7416813411925804
Energy: 0.6945452219437931
Energy: 0.6490732745634782
Energy: 0.6945452219477528
Energy: 0.823165567775789
Energy: 0.7424451963350184
Energy: 0.7421493781064513
Energy: 0.742445196337514

minimum gb energy = 0.6483441482356102 eV
minimum distance =  2.65825227051068 Angstroms
sigma value = 9


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

Energy: 0.9300568921805834
Energy: 0.819082464966884
Energy: 0.8204247188074831
Energy: 0.8190824649679679
Energy: 0.7012314784214675
Energy: 0.7011450684764893
Energy: 0.8230110772657524
Energy: 0.7011450684775731
Energy: 0.7108302740779915
Energy: 0.7028551676846267
Energy: 0.8122851833632322
Energy: 0.702855167684085
Energy: 0.7028191318903876
Energy: 0.7007652007359371
Energy: 0.86258157244042
Energy: 0.700765200734336
Energy: 0.7013300709720824
Energy: 0.7011519810727537
Energy: 0.8628737145388559
Energy: 0.7011519810629998
Energy: 0.6998952177170988
Energy: 0.7014710657658171
Energy: 0.863030026479537
Energy: 0.7014710657685266
Energy: 0.8202612054232088
Energy: 0.8125141567350784
Energy: 0.8207788471542439
Energy: 0.8125141567356203
Energy: 0.8191313752137686
Energy: 0.8120630459340584
Energy: 0.8122120430659683
Energy: 0.8120630459340584
Energy: 0.7306735585786643
Energy: 0.7870361452049579
Energy: 0.7527953643898162
Energy: 0.7870361482441637
Energy: 0.7003937051237347
Energy: 0.7573888778872585
Energy: 0.8159111422920863
Energy: 0.7573887504522039
Energy: 0.7290697387615778
Energy: 0.7294484640206023
Energy: 0.7617277490927866
Energy: 0.7294484640206023
Energy: 0.7379446752309079
Energy: 0.7771663946290261
Energy: 0.8624041217515167
Energy: 0.7771663946279422
Energy: 0.8207602826103864
Energy: 0.7296391889119027
Energy: 0.7414612666424399
Energy: 0.7296391889124445
Energy: 0.8211983064691998
Energy: 0.7299870779025087
Energy: 0.732278562277395
Energy: 0.7299870779030507
Energy: 0.8124527788852536
Energy: 0.7406496224340948
Energy: 0.7403448873416836
Energy: 0.7406496223349777
Energy: 0.760253266995856
Energy: 0.7864196470427287
Energy: 0.7382064652618353
Energy: 0.786419647046522
Energy: 0.8153096919066531
Energy: 0.7674959387174235
Energy: 0.7312271116642948
Energy: 0.767495938719591
Energy: 0.8161996490512843
Energy: 0.813833421468622
Energy: 0.9291407000352946
Energy: 0.8138334214702231
Energy: 0.8230635945576574
Energy: 0.699776814371586
Energy: 0.7015078102587483
Energy: 0.6997768143748374
Energy: 0.870549780261213
Energy: 0.7047059826039795
Energy: 0.7048598321097966
Energy: 0.7047059826034378
Energy: 0.8258663172318452
Energy: 0.7003856955985094
Energy: 0.7027619399466404
Energy: 0.7003856955985094
Energy: 0.8633314476024243
Energy: 0.7001118934864669
Energy: 0.700511215003786
Energy: 0.7001118934859497
Energy: 0.8630956935599351
Energy: 0.7002631802808248
Energy: 0.6997192082632216
Energy: 0.7002631802819086
Energy: 0.8216904631969776
Energy: 0.8121529334941473
Energy: 0.8201714792137169
Energy: 0.8121529334941473
Energy: 0.8120861479653143
Energy: 0.8120652801139759
Energy: 0.819692579031622
Energy: 0.8120652801150597
Energy: 0.7385406078809525
Energy: 0.7829685895133627
Energy: 0.7300676424490632
Energy: 0.7829685894348128
Energy: 0.8150058975276063
Energy: 0.7629595307076161
Energy: 0.7003094608662092
Energy: 0.762959529359978
Energy: 0.7612530972129403
Energy: 0.729253093696885
Energy: 0.7297200056950413
Energy: 0.7292530936958012
Energy: 0.8621426630784711
Energy: 0.7352419612619124
Energy: 0.7383771341506927
Energy: 0.7352419612559516
Energy: 0.740055259555257
Energy: 0.7290264308153331
Energy: 0.8206048359959306
Energy: 0.7290264308147911
Energy: 0.7318739505259347
Energy: 0.730437034324622
Energy: 0.8132913236646377
Energy: 0.7304370343240801
Energy: 0.7353962674948229
Energy: 0.732615205667606
Energy: 0.8124091551221687
Energy: 0.7326152056703154
Energy: 0.7383885131800926
Energy: 0.7875442004406876
Energy: 0.7603517769152842
Energy: 0.7875442004379782
Energy: 0.7305151730682647
Energy: 0.7697581249195187
Energy: 0.7642654596572535
Energy: 0.769758124917893
Energy: 0.8636446549450699
Energy: 0.8130875964560889
Energy: 0.8154343689772056
Energy: 0.8130875964560889

minimum gb energy = 0.6997192082632216 eV
minimum distance =  2.62914231414562 Angstroms
sigma value = 73


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

Energy: 0.8836108275025888
Energy: 0.7751082041527804
Energy: 0.7896687005008587
Energy: 0.7751082041536401
Energy: 0.7022338430028802
Energy: 0.7016501435964173
Energy: 0.7776767223622464
Energy: 0.7016501435964173
Energy: 0.7070052232421652
Energy: 0.7078348925361598
Energy: 0.7831686957290314
Energy: 0.7078348925361598
Energy: 0.7058975916980442
Energy: 0.7032922185167368
Energy: 0.8469839233795341
Energy: 0.7032922185201759
Energy: 0.7018698488347069
Energy: 0.7019879989700211
Energy: 0.8587628963255842
Energy: 0.7019879989683016
Energy: 0.7021023817511681
Energy: 0.7019583343960079
Energy: 0.8448723394401966
Energy: 0.7019583343917091
Energy: 0.7747347384980181
Energy: 0.7743038395916797
Energy: 0.7801975091740446
Energy: 0.7743038395916797
Energy: 0.7745368463785404
Energy: 0.7730650311038809
Energy: 0.7714930612990106
Energy: 0.7730650311038809
Energy: 0.7737504518380068
Energy: 0.7545437369365737
Energy: 0.7847141325845614
Energy: 0.7545437369357139
Energy: 0.7010221546071038
Energy: 0.7549015714641887
Energy: 0.7744325726245351
Energy: 0.7549015714624693
Energy: 0.7722025911221291
Energy: 0.7731717601042355
Energy: 0.7033643522393059
Energy: 0.7731717601033757
Energy: 0.78525518407412
Energy: 0.7744213166366354
Energy: 0.8438830725740578
Energy: 0.7744213166366354
Energy: 0.7700322787844134
Energy: 0.701735680087979
Energy: 0.7019875518928201
Energy: 0.7017356800888387
Energy: 0.7811897227398454
Energy: 0.7027382122671288
Energy: 0.702915912617913
Energy: 0.7027382122671288
Energy: 0.8464980294662712
Energy: 0.7073385477305744
Energy: 0.7078568801322532
Energy: 0.7073385477305744
Energy: 0.8449311172180822
Energy: 0.7026387640743204
Energy: 0.7074495898323273
Energy: 0.7026387640743204
Energy: 0.8460649934249636
Energy: 0.7023563175609921
Energy: 0.7022178226615372
Energy: 0.7023563175601324
Energy: 0.7874150838747651
Energy: 0.787232338685023
Energy: 0.7769298261087533
Energy: 0.7872323386858827
Energy: 0.7719936336044683
Energy: 0.7534418716418801
Energy: 0.7744224906840427
Energy: 0.7534418716358618
Energy: 0.784956587423708
Energy: 0.7563013837068709
Energy: 0.7740636301055074
Energy: 0.7563013837068709
Energy: 0.7716943742810431
Energy: 0.7578851258579692
Energy: 0.7047311263385508
Energy: 0.7578851258579692
Energy: 0.8439557827847686
Energy: 0.7722280438558285
Energy: 0.7732602605628222
Energy: 0.7722280438566883

minimum gb energy = 0.7010221546071038 eV
minimum distance =  2.62475015873262 Angstroms
sigma value = 7


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

Energy: 1.1404940733256543
Energy: 0.7995703518170394
Energy: 0.8007407040336194
Energy: 0.7995703518176475
Energy: 0.7168363378143774
Energy: 0.7626991751553905
Energy: 0.7797066328232097
Energy: 0.7626991751505271
Energy: 0.7174138145846485
Energy: 0.7188093466295691
Energy: 0.7826950010224886
Energy: 0.7188093466283532
Energy: 0.7157975734006848
Energy: 0.7161870236345619
Energy: 0.8456575027622256
Energy: 0.716187023632738
Energy: 0.7145117963070119
Energy: 0.7138578156830605
Energy: 0.8355013071741927
Energy: 0.7138578156842763
Energy: 0.7126799842901202
Energy: 0.7134302282784185
Energy: 0.8338545230855205
Energy: 0.7134302282838899
Energy: 0.8274940847612856
Energy: 0.7169186664665098
Energy: 0.7125419083164625
Energy: 0.7169186664689415
Energy: 0.7788009083585902
Energy: 0.7129795055224004
Energy: 0.7130222396295455
Energy: 0.7129795055242243
Energy: 0.8467550160631363
Energy: 0.7131159423469945
Energy: 0.7121288898791998
Energy: 0.7131159423409151
Energy: 0.8489669402918829
Energy: 0.7158688286238644
Energy: 0.7135799471002092
Energy: 0.7158688286232564
Energy: 0.7790619975557186
Energy: 0.7780591918746393
Energy: 0.7135470434815655
Energy: 0.7780591918752473
Energy: 0.7836293353539991
Energy: 0.782755053446423
Energy: 0.8289171231601197
Energy: 0.7827550534452071
Energy: 0.7804451480139064
Energy: 0.7623524143636851
Energy: 0.7796955306223027
Energy: 0.7623524143655087
Energy: 0.7826632966858781
Energy: 0.757953889112518
Energy: 0.7222841111556233
Energy: 0.7579538891167736
Energy: 0.7797771747661665
Energy: 0.7596210531236998
Energy: 0.7241300464909661
Energy: 0.7596210531279552
Energy: 0.8205994857892375
Energy: 0.7815457640083913
Energy: 0.784284963774769
Energy: 0.7815457640126469
Energy: 0.7177798927178309
Energy: 0.7775292356583586
Energy: 0.7791043851298121
Energy: 0.7775292356565346
Energy: 0.7137428017982469
Energy: 0.7163827674063864
Energy: 0.7834530994788061
Energy: 0.7163827674087905
Energy: 0.7123750417943147
Energy: 0.7135153686862575
Energy: 0.7794483775389117
Energy: 0.7135153686892972
Energy: 0.712465643393224
Energy: 0.7132559663958683
Energy: 0.7721214307084642
Energy: 0.7132559663964763
Energy: 0.7127254533835377
Energy: 0.7163327826858714
Energy: 0.8397373802007021
Energy: 0.7163327826858714
Energy: 0.7805574111911165
Energy: 0.713453332150683
Energy: 0.7123683938792094
Energy: 0.7134533321561544
Energy: 0.8276424913697003
Energy: 0.7140605715430879
Energy: 0.7133473419557697
Energy: 0.7140605715443038
Energy: 0.8449133242201139
Energy: 0.7167022924114649
Energy: 0.7152601169030431
Energy: 0.7167022924108569
Energy: 0.8404163734786431
Energy: 0.7179515953272071
Energy: 0.716838762972093
Energy: 0.7179515953223435
Energy: 0.8326020062077982
Energy: 0.7858852442321634
Energy: 0.7167132658258124
Energy: 0.785885244612568
Energy: 0.8009012447399094
Energy: 0.7851330116674021
Energy: 0.993198959076313
Energy: 0.7851330116680102
Energy: 0.7777476960190315
Energy: 0.7844876451046816
Energy: 0.7785063854674225
Energy: 0.7844877913490154
Energy: 0.7800651517642249
Energy: 0.7583934377680713
Energy: 0.7808872609289587
Energy: 0.7583934377668554
Energy: 0.7780528675730776
Energy: 0.7591302418190108
Energy: 0.7221850392264818
Energy: 0.759130241880385
Energy: 0.7709222985481909
Energy: 0.7784949062557674
Energy: 0.7790042239269216
Energy: 0.7784949062521199

minimum gb energy = 0.7121288898791998 eV
minimum distance =  2.61659782551717 Angstroms
sigma value = 29


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

Energy: 0.6689597282571426
Energy: 0.7866433390304634
Energy: 0.685806414803384
Energy: 0.7866433390298281
Energy: 0.6849063024164588
Energy: 0.7321622915843528
Energy: 0.6885093046097993
Energy: 0.7321622915837174
Energy: 0.6823119555750286
Energy: 0.7214700039171309
Energy: 0.6719295297426916
Energy: 0.7214700039171309
Energy: 0.6749953815937692
Energy: 0.6807788806869486
Energy: 0.6812599575577558
Energy: 0.6807788806865486
Energy: 0.6796658628899673
Energy: 0.6825129879818831
Energy: 0.6730252405593299
Energy: 0.6825129879804243
Energy: 0.6799624090185418
Energy: 0.724210193707531
Energy: 0.6741214898405367
Energy: 0.724210193707531
Energy: 0.6723604622320759
Energy: 0.7206196295703781
Energy: 0.6820821478305543
Energy: 0.7206196295703781
Energy: 0.6878836787042705
Energy: 0.6856617229967356
Energy: 0.6725644953359596
Energy: 0.6856617229961238
Energy: 0.6847899369024025
Energy: 0.6824931697819713
Energy: 0.6869746220251444
Energy: 0.6824931697815476

minimum gb energy = 0.6689597282571426 eV
minimum distance =  2.63064326410255 Angstroms
sigma value = 5


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

Energy: 0.9782041532828739
Energy: 0.6629408189414092
Energy: 0.7560749354640306
Energy: 0.6629408189207615
Energy: 0.7657828299492209
Energy: 0.6647886670398484
Energy: 0.7816815555585158
Energy: 0.6647886670358285
Energy: 0.7740019734998752
Energy: 0.716441890586166
Energy: 0.7833643672345113
Energy: 0.7164418905878889
Energy: 0.73239545748358
Energy: 0.7208012870209193
Energy: 0.7654087714303027
Energy: 0.7208012870191964
Energy: 0.7212322384461268
Energy: 0.6633794066287548
Energy: 0.7330938393350174
Energy: 0.6633794066287548
Energy: 0.6635203401099994
Energy: 0.6650439996485445
Energy: 0.7340596964167304
Energy: 0.6650439996542873
Energy: 0.6619680170575454
Energy: 0.6620668773245844
Energy: 0.7720937377998288
Energy: 0.6620668773297528
Energy: 0.6685173592166952
Energy: 0.665224866241375
Energy: 0.8377539414470309
Energy: 0.6652248662436719
Energy: 0.7489895927010675
Energy: 0.6848015250109499
Energy: 0.8232015597279638
Energy: 0.6848015250126728
Energy: 0.8501399674604377
Energy: 0.6534509789745053
Energy: 0.6575354876263158
Energy: 0.6534509789727825
Energy: 0.749596348360802
Energy: 0.6512464565489346
Energy: 0.6523403141740161
Energy: 0.651246456549509
Energy: 0.83155308312366
Energy: 0.6512687440760145
Energy: 0.6548174783185429
Energy: 0.6512687440777374
Energy: 0.8378386733726529
Energy: 0.650641642049344
Energy: 0.6599101160939453
Energy: 0.6506416420510669
Energy: 0.6926344989396686
Energy: 0.6428786054194937
Energy: 0.8350388066617656
Energy: 0.6428786054217909
Energy: 0.7041167363056443
Energy: 0.6423397951593031
Energy: 0.8309990205436185
Energy: 0.6423397951593031
Energy: 0.7045791516944252
Energy: 0.6426568216203213
Energy: 0.6753670427015948
Energy: 0.6426568216185985
Energy: 0.6937488702021382
Energy: 0.643172713595837
Energy: 0.6749681811893276
Energy: 0.6431727135918173
Energy: 0.8167368544979697
Energy: 0.6446519784853602
Energy: 0.675780241542514
Energy: 0.6446519784853602
Energy: 0.8284868761673093
Energy: 0.6980035783334541
Energy: 0.6759439534800167
Energy: 0.6980035783363254
Energy: 0.7873287493460005
Energy: 0.7511469059857588
Energy: 0.7329552387974564
Energy: 0.7511469059840361
Energy: 0.7355029856797263
Energy: 0.6796958905960615
Energy: 0.6777982095093568
Energy: 0.6796958905949129
Energy: 0.7347562379696145
Energy: 0.6674813744246931
Energy: 0.6673502882367239
Energy: 0.6674813744269902
Energy: 0.782567641660931
Energy: 0.6668155171190623
Energy: 0.6670442229284441
Energy: 0.6668155171213593
Energy: 0.8395988468472994
Energy: 0.6688783589409295
Energy: 0.6716527865112459
Energy: 0.6688783589380581
Energy: 0.8261004645538704
Energy: 0.7322539192544095
Energy: 0.691614031201198
Energy: 0.7322539192498154
Energy: 0.6533937504309203
Energy: 0.6486599235091691
Energy: 0.8504066860380177
Energy: 0.6486599235062979
Energy: 0.6511785330831595
Energy: 0.6480575836152798
Energy: 0.6913532487992603
Energy: 0.6480575836129826
Energy: 0.650129563389778
Energy: 0.6483683835372658
Energy: 0.6873218630734991
Energy: 0.6483683835401371
Energy: 0.6466715438360158
Energy: 0.6469648473756346
Energy: 0.8395389792589336
Energy: 0.6469648473739119
Energy: 0.8331423953222138
Energy: 0.681734448757021
Energy: 0.6803665992493894
Energy: 0.6817344487575954
Energy: 0.8335532183723156
Energy: 0.6627508215642799
Energy: 0.664905109852181
Energy: 0.6627508215619828
Energy: 0.7674380070615072
Energy: 0.6623892145735688
Energy: 0.6645144596325694
Energy: 0.6623892145735688
Energy: 0.6681412345274338
Energy: 0.6620738487278788
Energy: 0.6630538740484175
Energy: 0.6620738487301759

minimum gb energy = 0.6423397951593031 eV
minimum distance =  2.59445533993316 Angstroms
sigma value = 1


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

Energy: 0.968828454209125
Energy: 0.6273417282142288
Energy: 0.6283699464946241
Energy: 0.627341537410087
Energy: 0.6385663689459085
Energy: 0.6284654859415061
Energy: 0.7670806252912787
Energy: 0.6284654859423002
Energy: 0.7672217090051674
Energy: 0.6953932143102334
Energy: 0.7709579700413025
Energy: 0.6953932143094395
Energy: 0.643605854273651
Energy: 0.6957575044562545
Energy: 0.7600456654907836
Energy: 0.6957575044554605
Energy: 0.6280842628740535
Energy: 0.6265504476675264
Energy: 0.7653857279301234
Energy: 0.6265504476691145
Energy: 0.6265481356386571
Energy: 0.6277794318703844
Energy: 0.7665656722015978
Energy: 0.6277794318703844
Energy: 0.6251456823908862
Energy: 0.6259641338701102
Energy: 0.7612426714827941
Energy: 0.6259641338693162
Energy: 0.6309738423190726
Energy: 0.6300156526567958
Energy: 0.8762212589484015
Energy: 0.6300156526560018
Energy: 0.774348063675848
Energy: 0.660693591004692
Energy: 0.8790694384030945
Energy: 0.6606935910054862
Energy: 0.771382942325523
Energy: 0.6312328823650041
Energy: 0.6310641931888893
Energy: 0.6312328823626221
Energy: 0.775707768413468
Energy: 0.6262104015963803
Energy: 0.6257506169492746
Energy: 0.6262104015948102
Energy: 0.8714443628233121
Energy: 0.6333281003320003
Energy: 0.6264716846405558
Energy: 0.6333281003304122
Energy: 0.8703939824963598
Energy: 0.6264674457721271
Energy: 0.6269671219111331
Energy: 0.6264674457729211
Energy: 0.7600627488334002
Energy: 0.6952128553277137
Energy: 0.7682808477774
Energy: 0.6952128553277137
Energy: 0.645029999812596
Energy: 0.6947394614588601
Energy: 0.767131537213733
Energy: 0.6947394614596543
Energy: 0.6429215953817795
Energy: 0.6273924746388717
Energy: 0.7613075922945427
Energy: 0.627392474649176
Energy: 0.6267061733873031
Energy: 0.6273620244365448
Energy: 0.7674372993592661
Energy: 0.6273620244365448
Energy: 0.6316255097063002
Energy: 0.6301700287194302
Energy: 0.770920447204244
Energy: 0.6301700287202242
Energy: 0.6254543641719741
Energy: 0.626102579779477
Energy: 0.8779209690646849
Energy: 0.6261025797802712
Energy: 0.6393009288895559
Energy: 0.630875875306509
Energy: 0.8755566336724637
Energy: 0.630875875307303
Energy: 0.7655663929932466
Energy: 0.6567855336325829
Energy: 0.6278829167556241
Energy: 0.6567855336317888
Energy: 0.7671725591058446
Energy: 0.6278995026714095
Energy: 0.6296728042833395
Energy: 0.6278995026706156
Energy: 0.7608313868135734
Energy: 0.6262258354815908
Energy: 0.6264988708489323
Energy: 0.6262258354807968
Energy: 0.8746047325802306
Energy: 0.6267598200878378
Energy: 0.6267174736477249
Energy: 0.6267598200878378

minimum gb energy = 0.6251456823908862 eV
minimum distance =  2.61564007756055 Angstroms
sigma value = 17


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

Energy: 1.03304126799024
Energy: 0.620290660385811
Energy: 0.7276577398462393
Energy: 0.620290658380918
Energy: 0.630267837494294
Energy: 0.6209190165643795
Energy: 0.7070633319450641
Energy: 0.6209190165624165
Energy: 0.7908293618252693
Energy: 0.6205397360777092
Energy: 0.7235172695411598
Energy: 0.6205397360737831
Energy: 0.8162492530146773
Energy: 0.6518931737107168
Energy: 0.7023586519056187
Energy: 0.6518931737107168
Energy: 0.6918915814069289
Energy: 0.6060286163586364
Energy: 0.7112057645251567
Energy: 0.6060286163591272
Energy: 0.606267407865256
Energy: 0.6059115671302947
Energy: 0.8030014382071909
Energy: 0.6059115671288224
Energy: 0.6062662902445853
Energy: 0.6056551023083089
Energy: 0.6304612491513926
Energy: 0.6056551023073274
Energy: 0.6107126324714454
Energy: 0.6069032896126836
Energy: 0.8056899338853905
Energy: 0.6069032896126836
Energy: 0.7963775014259237
Energy: 0.6074619676531218
Energy: 0.7772078367507778
Energy: 0.6074619676536125
Energy: 0.7269371773007095
Energy: 0.6544058075090692
Energy: 0.7096437606609832
Energy: 0.6544058075110323
Energy: 0.7942971966380403
Energy: 0.6179993015863063
Energy: 0.6276975988943908
Energy: 0.6179993015990219
Energy: 0.8011429302851361
Energy: 0.6226751317252046
Energy: 0.7024345380259402
Energy: 0.6226751317261863
Energy: 0.8006905211986698
Energy: 0.617629268661125
Energy: 0.6185442732523736
Energy: 0.6176292686601434
Energy: 0.6187985621312616
Energy: 0.6175925030481273
Energy: 0.6187819132930776
Energy: 0.6175925030451828
Energy: 0.8135583432648164
Energy: 0.6192657901756639
Energy: 0.6231185166460372
Energy: 0.6192657901737008
Energy: 0.8057610966936576
Energy: 0.6184990568427406
Energy: 0.6210091087311109
Energy: 0.6184990568388146
Energy: 0.6184049229122683
Energy: 0.6242131799507901
Energy: 0.7139392817695811
Energy: 0.6242131799449008
Energy: 0.6176633214479816
Energy: 0.6180530652286526
Energy: 0.7982479636388367
Energy: 0.6180530652281617
Energy: 0.6279229723034482
Energy: 0.6191153724624114
Energy: 0.7752489650986999
Energy: 0.6191153724624114
Energy: 0.6186596827829246
Energy: 0.6188355372844603
Energy: 0.8063385765359147
Energy: 0.6188355375395724
Energy: 0.7156947830889563
Energy: 0.6194735780803373
Energy: 0.6289429682642039
Energy: 0.6194735780798466
Energy: 0.723854518238206
Energy: 0.6192017727623859
Energy: 0.7920745358199449
Energy: 0.6192017727589505
Energy: 0.7049539335331796
Energy: 0.6504855891261404
Energy: 0.8137096392511873
Energy: 0.6504855891256496
Energy: 0.711763437861662
Energy: 0.6067722245488538
Energy: 0.6913038165445007
Energy: 0.6067722245488538
Energy: 0.801884140119149
Energy: 0.6055294700098318
Energy: 0.6057649070822735
Energy: 0.6055294700098318
Energy: 0.7130306900166178
Energy: 0.6063788532047856
Energy: 0.6084186299727349
Energy: 0.6063788532033132
Energy: 0.6113293421828346
Energy: 0.6078717460270019
Energy: 0.6120070330989156
Energy: 0.6078717460211126
Energy: 0.7041834985580792
Energy: 0.6074217586361175
Energy: 0.7993901063878309
Energy: 0.6074217586380806
Energy: 0.709816035903938
Energy: 0.6530510096842367
Energy: 0.7253041056753281
Energy: 0.6530510096808012
Energy: 0.6286116025511481
Energy: 0.6173671371348989
Energy: 0.7922159307663088
Energy: 0.6173671370318813
Energy: 0.7026140143126575
Energy: 0.6180388639710175
Energy: 0.8023961458748397
Energy: 0.618038863971999
Energy: 0.6178133506781922
Energy: 0.6179450683418801
Energy: 0.8051757496196859
Energy: 0.6179450683433524
Energy: 0.6175562931809508
Energy: 0.6179428236696852
Energy: 0.6201539054797587
Energy: 0.6179428236706668
Energy: 0.6231747757121999
Energy: 0.6203629027225412
Energy: 0.8162944900455245
Energy: 0.6203629027205781
Energy: 0.6226893893582681
Energy: 0.6373724375466293
Energy: 0.8059781981295735
Energy: 0.6373724375466293
Energy: 0.9309543492428034
Energy: 0.6223873308385186
Energy: 0.6285978900842886
Energy: 0.6223873308385186
Energy: 0.7946249642737281
Energy: 0.6180573671126746
Energy: 0.6187913495693029
Energy: 0.6180573671126746
Energy: 0.7903635744635537
Energy: 0.6210543979026486
Energy: 0.6185996865237733
Energy: 0.6210543979026486

minimum gb energy = 0.6055294700098318 eV
minimum distance =  2.61527698081823 Angstroms
sigma value = 89


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

Energy: 1.095674444846439
Energy: 0.5650413332617736
Energy: 0.5652642315796343
Energy: 0.565041333264342
Energy: 0.5661452219062352
Energy: 0.6182009357353945
Energy: 0.5645504455540067
Energy: 0.6182009357357738
Energy: 0.5589000483832348
Energy: 0.6186613556746726
Energy: 0.5761945571758513
Energy: 0.6186613556745413
Energy: 0.5596215186871631
Energy: 0.6189323153391108
Energy: 0.563600422481847
Energy: 0.6189323153389941
Energy: 0.5630906040801632
Energy: 0.5633035449040146
Energy: 0.5723369005162277
Energy: 0.5633035449041458
Energy: 0.5636931406311125
Energy: 0.5626852498680552
Energy: 0.571705220388228
Energy: 0.5626852498675445
Energy: 0.562962090683336
Energy: 0.5618487782952619
Energy: 0.5647027554060031
Energy: 0.5618487782952619
Energy: 0.5652979740530191
Energy: 0.565677193538053
Energy: 0.558783520499937
Energy: 0.5656771935379217
Energy: 0.5660607936057664
Energy: 0.5627497864860554
Energy: 0.5586583058085675
Energy: 0.5627497864856614
Energy: 0.5739148018487094
Energy: 0.6197418301921334
Energy: 0.5737421906054234
Energy: 0.6197418301926441
Energy: 0.5644063683102017
Energy: 0.6130919680205604
Energy: 0.5580340789260925
Energy: 0.6130919680200497
Energy: 0.5711311352902193
Energy: 0.5660717113157586
Energy: 0.5650241154256107
Energy: 0.5660717113151166
Energy: 0.5721049714206725
Energy: 0.5642085887347996
Energy: 0.5629056220460977
Energy: 0.5642085887346682
Energy: 0.5644996719736995
Energy: 0.561498648674758
Energy: 0.5618739817667852
Energy: 0.5614986486752687
Energy: 0.5586866708263387
Energy: 0.5636500408004624
Energy: 0.5654214711840104
Energy: 0.5636500408001996

minimum gb energy = 0.5580340789260925 eV
minimum distance =  2.63827675557207 Angstroms
sigma value = 13


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

Energy: 1.0229270847313958
Energy: 0.5351889296897518
Energy: 0.6710238993606225
Energy: 0.5351888275499707
Energy: 0.6269360285597984
Energy: 0.5349901307246284
Energy: 0.6335267059562679
Energy: 0.5349901307240901
Energy: 0.6380441784884985
Energy: 0.5327984635991203
Energy: 0.6406185131573277
Energy: 0.5327984636012733
Energy: 0.793745098190525
Energy: 0.5353900934624376
Energy: 0.6297976305670608
Energy: 0.5353900934613611
Energy: 0.631966677962383
Energy: 0.6367818668770783
Energy: 0.5822532689253018
Energy: 0.6367818668829742
Energy: 0.6423614097104836
Energy: 0.535417958068842
Energy: 0.5816259059412071
Energy: 0.5354179580677656
Energy: 0.6398089175025341
Energy: 0.5346666223710478
Energy: 0.6277451815894645
Energy: 0.534666622368895
Energy: 0.615494876118037
Energy: 0.5372094289802422
Energy: 0.6699690897713204
Energy: 0.5372094289775512
Energy: 0.5346077385773225
Energy: 0.5384592608061276
Energy: 0.6011557040306569
Energy: 0.5384592608028983
Energy: 0.5364924086174716
Energy: 0.5347981490692822
Energy: 0.7327756044946654
Energy: 0.5347981490741262
Energy: 0.5364658492440206
Energy: 0.5352935193144107
Energy: 1.023560172903633
Energy: 0.5352935192078924
Energy: 0.5349762972214491
Energy: 0.5347347845180974
Energy: 0.7324601287227783
Energy: 0.5347347845207885
Energy: 0.5375927746969852
Energy: 0.6371683357529557
Energy: 0.6268665259469589
Energy: 0.6371683357545704
Energy: 0.5377425776593902
Energy: 0.6370431565380086
Energy: 0.690111584541572
Energy: 0.6370431565358557
Energy: 0.6700475190269226
Energy: 0.5270238144529061
Energy: 0.6274411826818894
Energy: 0.5270238144486004
Energy: 0.6705502061516159
Energy: 0.5258594610668615
Energy: 0.581183050007333
Energy: 0.5258594610717056
Energy: 0.5361149557941848
Energy: 0.5251244718271283
Energy: 0.5800679663864055
Energy: 0.5251244718303333
Energy: 0.5359668029169182
Energy: 0.5249854549885937
Energy: 0.5745001429719933
Energy: 0.5249854549875174
Energy: 0.7120341732340634
Energy: 0.5268642569302485
Energy: 0.6666254437851731
Energy: 0.5268642569280956
Energy: 0.5352061052356843
Energy: 0.5263551649052965
Energy: 0.688829759375065
Energy: 0.5263551649026054
Energy: 0.7979695018742695
Energy: 0.5261384960945573
Energy: 0.6680349090136263
Energy: 0.5261384960940191
Energy: 0.534942945697948
Energy: 0.5362002597902359
Energy: 0.59791262270375
Energy: 0.5362002597913123
Energy: 0.5381076546958581
Energy: 0.5357526751483809
Energy: 0.5980222569921161
Energy: 0.535752675146228
Energy: 0.5870150184103391
Energy: 0.5351449027538112
Energy: 0.6292864231194458
Energy: 0.5351449027570406
Energy: 0.5355287016917437
Energy: 0.5350550463063879
Energy: 0.6708313524457996
Energy: 0.5350550463085408
Energy: 0.534792949395255
Energy: 0.5343087646487836
Energy: 0.6706248165641502
Energy: 0.5343087646471689
Energy: 0.5338438004401702
Energy: 0.5336090429486368
Energy: 0.629686457758284
Energy: 0.5336090429507897
Energy: 0.5467851522602033
Energy: 0.5385134639672473
Energy: 0.5890296905176376
Energy: 0.5385134639683238
Energy: 0.6266353606819659
Energy: 0.536823654766098
Energy: 0.6951677690640542
Energy: 0.536823654763945
Energy: 0.6895487002563913
Energy: 0.5681063716641336
Energy: 0.7276001780329561
Energy: 0.5681063716641336
Energy: 0.7337870838808019
Energy: 0.5652060046757887
Energy: 0.7984453755044824
Energy: 0.5652060046725595
Energy: 0.6706885306685929
Energy: 0.5340737948095663
Energy: 0.7271501774555085
Energy: 0.5340737948095663
Energy: 0.6702794745645413
Energy: 0.5349444195477866
Energy: 0.5423258785126026
Energy: 0.5349444195424045
Energy: 0.7348618259612983
Energy: 0.5320011242151145
Energy: 0.532330705689176
Energy: 0.532001124214038
Energy: 0.6998965473727734
Energy: 0.5334107953941042
Energy: 0.5360485831475544
Energy: 0.5334107953946423

minimum gb energy = 0.5249854549875174 eV
minimum distance =  2.62967138883725 Angstroms
sigma value = 37


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

Energy: 0.8431093533895858
Energy: 0.4845093809275437
Energy: 0.4842596318446194
Energy: 0.4845093809275437
Energy: 0.8065536770326787
Energy: 0.48337096041095173
Energy: 0.6447198454940194
Energy: 0.4833709604100257
Energy: 0.8016350308680315
Energy: 0.48239673366562386
Energy: 0.6472559379421675
Energy: 0.48239673366562386
Energy: 0.8005187327820947
Energy: 0.5391320548855911
Energy: 0.6458784292566846
Energy: 0.539132054884665
Energy: 0.8040493884470469
Energy: 0.5429886390270583
Energy: 0.6460935766964517
Energy: 0.5429886390279843
Energy: 0.6470539842047802
Energy: 0.48360906524546
Energy: 0.8052967558386492
Energy: 0.48360906524453406
Energy: 0.48340496406399763
Energy: 0.48234103244872073
Energy: 0.8045203504527367
Energy: 0.4823410324496467
Energy: 0.4892052459329972
Energy: 0.48358753423733325
Energy: 0.8027004936900082
Energy: 0.48358753423825934
Energy: 0.4826590027849876
Energy: 0.48534002797986425
Energy: 0.8009585770191301
Energy: 0.48534002797893827
Energy: 0.48262996379751877
Energy: 0.48347416492094325
Energy: 0.7364473653984678
Energy: 0.4834741649218692
Energy: 0.48425963185017534
Energy: 0.4845093810265821
Energy: 0.8431093533895858
Energy: 0.48450938102565616
Energy: 0.6447198454912414
Energy: 0.4833709604100257
Energy: 0.73582198713185
Energy: 0.4833709604100257
Energy: 0.6472559379430934
Energy: 0.48239673366562386
Energy: 0.8016350308680315
Energy: 0.48239673366562386
Energy: 0.6458784292566846
Energy: 0.5391320548855911
Energy: 0.8005187315390417
Energy: 0.5391320548855911
Energy: 0.6460935766983037
Energy: 0.5429886390270583
Energy: 0.8040493884470469
Energy: 0.5429886390270583
Energy: 0.7372402416137906
Energy: 0.48360906524546
Energy: 0.6470539842057061
Energy: 0.483609065246386
Energy: 0.8045203504518108
Energy: 0.4823410324505727
Energy: 0.48340496406399763
Energy: 0.4823410324505727
Energy: 0.8027004922451952
Energy: 0.48358753423825934
Energy: 0.4892052459329972
Energy: 0.48358753423918527
Energy: 0.800958577025612
Energy: 0.48534002797986425
Energy: 0.48265900278406165
Energy: 0.48534002797986425
Energy: 0.8065230326239933
Energy: 0.4834741649218692
Energy: 0.4826299637965928
Energy: 0.4834741649218692

minimum gb energy = 0.48234103244872073 eV
minimum distance =  2.64375306335888 Angstroms
sigma value = 25


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

Energy: 1.000274702902233
Energy: 0.43112815987272496
Energy: 0.5908335024630922
Energy: 0.4311281598589865
Energy: 0.9029977602344972
Energy: 0.4293071930974503
Energy: 0.560321610553887
Energy: 0.4293071930974503
Energy: 0.9024913110367977
Energy: 0.42887902166895325
Energy: 0.5635821338962028
Energy: 0.4288790216682302
Energy: 0.700041327025831
Energy: 0.42997729578534
Energy: 0.5627887042514642
Energy: 0.4299772957860631
Energy: 0.7972144819305524
Energy: 0.47616173754088786
Energy: 0.8028941460198109
Energy: 0.4761617375379956
Energy: 0.6922111793348784
Energy: 0.47547494889382447
Energy: 0.8000673203758535
Energy: 0.47547494889527064
Energy: 0.6960689268167397
Energy: 0.4765821510082787
Energy: 0.8022946192196975
Energy: 0.4765821510090018
Energy: 0.5610651413607838
Energy: 0.4299652202846289
Energy: 0.7999319741611747
Energy: 0.4299652202846289
Energy: 0.5629145480285894
Energy: 0.42874896236159354
Energy: 0.9053424278277962
Energy: 0.42874896236159354
Energy: 0.5641688537802085
Energy: 0.4293956798520288
Energy: 0.9035222965949593
Energy: 0.4293956798527519
Energy: 0.428996445309338
Energy: 0.4322314623434659
Energy: 0.8513977955494579
Energy: 0.4322314623384043
Energy: 0.4313353442286054
Energy: 0.4292664729265519
Energy: 0.9027387930942737
Energy: 0.429266472927998
Energy: 0.4299335465110257
Energy: 0.4288853168925265
Energy: 0.8983201514550372
Energy: 0.4288853168939727
Energy: 0.43797012238849337
Energy: 0.4302040328813572
Energy: 0.8992923710788885
Energy: 0.43020403288063414
Energy: 0.5627230952225691
Energy: 0.42859782768130344
Energy: 0.9012340310923963
Energy: 0.42859782768273313
Energy: 0.5672045884975215
Energy: 0.4298115838021332
Energy: 0.908405968452845
Energy: 0.42981158380141005
Energy: 0.6987704728590688
Energy: 0.4302684082674107
Energy: 0.9144525532843552
Energy: 0.4302684082681338
Energy: 0.5649018910619704
Energy: 0.47875973801727784
Energy: 0.7993893522548917
Energy: 0.47875973801800087
Energy: 0.7994647777435296
Energy: 0.4761761407058099
Energy: 0.6954971479040661
Energy: 0.47617614070653297
Energy: 0.9025132097595076
Energy: 0.475587986161785
Energy: 0.692333040459371
Energy: 0.475587986161785
Energy: 0.8515335161914855
Energy: 0.43166767588410865
Energy: 0.5651623466353684
Energy: 0.43166767588410865
Energy: 0.9027897347377442
Energy: 0.42818393914869657
Energy: 0.42887044768752575
Energy: 0.4281839391501427
Energy: 0.8985328715710788
Energy: 0.43076206879259205
Energy: 0.5601623016290382
Energy: 0.43076206879331513
Energy: 0.8033383663750603
Energy: 0.4309034714704582
Energy: 0.4331950148083119
Energy: 0.43090347146973507
Energy: 0.9009400601699086
Energy: 0.4284194153721824
Energy: 0.42886761512256577
Energy: 0.42841941537145933
Energy: 0.9038726503145419
Energy: 0.43006979240277027
Energy: 0.43266993315587965
Energy: 0.43006979240277027

minimum gb energy = 0.42818393914869657 eV
minimum distance =  2.65170566120372 Angstroms
sigma value = 41


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

Energy: 1.0997712611658448
Energy: 0.3901094334700437
Energy: 0.5611918503325715
Energy: 0.3901095968082036
Energy: 0.9673056518857559
Energy: 0.3893584971549556
Energy: 0.4986224015842829
Energy: 0.3893584971555484
Energy: 0.9672689949617135
Energy: 0.3890281444097426
Energy: 0.5016656354134221
Energy: 0.3890281444109282
Energy: 0.8019426313025827
Energy: 0.39085652259578024
Energy: 0.6166579994479569
Energy: 0.3908565225940019
Energy: 0.7978858193157531
Energy: 0.38779032602547225
Energy: 0.7051489753442867
Energy: 0.3877903260272507
Energy: 0.7933519183711718
Energy: 0.534947833669215
Energy: 0.701701814470412
Energy: 0.5349478336680294
Energy: 0.7991210836862621
Energy: 0.4288176894942617
Energy: 0.7979864798373418
Energy: 0.42881768949544724
Energy: 0.7076336495923112
Energy: 0.43083498941053
Energy: 0.705634834339329
Energy: 0.4308349894093444
Energy: 0.6088187943772864
Energy: 0.3907677719343927
Energy: 0.8801829110766417
Energy: 0.39076777193498546
Energy: 0.6083029557914296
Energy: 0.38795219478044185
Energy: 0.7988877587897666
Energy: 0.38795219478281306
Energy: 0.5068227460276442
Energy: 0.39224140116163486
Energy: 0.8785016979898699
Energy: 0.39224140116400613
Energy: 0.5002592359300501
Energy: 0.38825594692079535
Energy: 0.9660231713042186
Energy: 0.38825594692079535
Energy: 0.4990158732894042
Energy: 0.39013525920555175
Energy: 0.9687671153923438
Energy: 0.39013525920495895
Energy: 0.39496113830825275
Energy: 0.3914509167329243
Energy: 0.8894254489533268
Energy: 0.391450916740038
Energy: 0.38924332496768277
Energy: 0.388844592308643
Energy: 0.9643164475950835
Energy: 0.388844592308643
Energy: 0.39268012940974134
Energy: 0.38980541212197006
Energy: 0.96885003273057
Energy: 0.38980541212256287
Energy: 0.5040727272720968
Energy: 0.3914767503634274
Energy: 0.9615955480427191
Energy: 0.391476750364613
Energy: 0.4992852778974503
Energy: 0.3878232542204133
Energy: 0.9641654587825961
Energy: 0.38782325422278446
Energy: 0.4995548128652828
Energy: 0.3894886133048964
Energy: 0.7962905454983381
Energy: 0.38948861330548923
Energy: 0.7029054583574333
Energy: 0.38973082872359516
Energy: 0.7947579119395258
Energy: 0.3897308287253735
Energy: 0.7077192050718645
Energy: 0.3885016432028361
Energy: 0.8778866416271556
Energy: 0.3885016432010576
Energy: 0.7027081854591154
Energy: 0.4289844894225667
Energy: 0.7991520731062615
Energy: 0.42898448942138107
Energy: 0.8810707287124371
Energy: 0.4267254218332541
Energy: 0.7917795223998961
Energy: 0.42672542183384693
Energy: 0.7049214805671256
Energy: 0.42932665073873433
Energy: 0.7027623093956097
Energy: 0.4293266507369559
Energy: 0.8787344527095207
Energy: 0.38830677050685675
Energy: 0.6097128092469337
Energy: 0.38830677050744955
Energy: 0.8821621641651596
Energy: 0.38946267989377503
Energy: 0.7005297761682208
Energy: 0.3894626798925894
Energy: 0.885010405992356
Energy: 0.3916960027725258
Energy: 0.4996052523917614
Energy: 0.3916960027725258
Energy: 0.9635783721696176
Energy: 0.3886271040484813
Energy: 0.5004450792364916
Energy: 0.38862710405025974
Energy: 0.8828959747177829
Energy: 0.39159522983559986
Energy: 0.5032356465901803
Energy: 0.39159522983619266
Energy: 0.8826290278079438
Energy: 0.3904084665423996
Energy: 0.3897711903578719
Energy: 0.3904084665429923
Energy: 0.9643044559419608
Energy: 0.3892383142791876
Energy: 0.38893249030801436
Energy: 0.3892383142791876
Energy: 0.9619864262533111
Energy: 0.39082332456682345
Energy: 0.39393678681732336
Energy: 0.3908233245709461

minimum gb energy = 0.38779032602547225 eV
minimum distance =  2.65269004379564 Angstroms
sigma value = 15


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

Energy: 0.9488652375218843
Energy: 0.36060058892735436
Energy: 0.5370556620874598
Energy: 0.36060068760442265
Energy: 0.9346579958308017
Energy: 0.3592278764669154
Energy: 0.4511066290599704
Energy: 0.35922787646741766
Energy: 1.012591447392968
Energy: 0.3583268979121892
Energy: 0.45483030586614487
Energy: 0.3583268979086739
Energy: 0.870907163881453
Energy: 0.36111799451629706
Energy: 0.6338525615262933
Energy: 0.36111799451730137
Energy: 0.8640506478264436
Energy: 0.35687721347319146
Energy: 0.6278890629691896
Energy: 0.3568772134711827
Energy: 0.8635357684735939
Energy: 0.3574988606377638
Energy: 0.6278518021081264
Energy: 0.3574988606076327
Energy: 0.7106488629781871
Energy: 0.36046183825220374
Energy: 0.7858707389852648
Energy: 0.3604618382562212
Energy: 0.788562906053164
Energy: 0.3942088683276611
Energy: 0.6284959534647532
Energy: 0.39420886832966984
Energy: 0.7079662223213009
Energy: 0.3903262554893053
Energy: 0.7844248770951973
Energy: 0.3903262554757463
Energy: 0.7067435992156498
Energy: 0.3913169623466492
Energy: 0.9350103517925981
Energy: 0.3913169623506667
Energy: 0.632927627587092
Energy: 0.3599464157363845
Energy: 0.7938207256976803
Energy: 0.3599464156741362
Energy: 0.5434195420087266
Energy: 0.35675284913090866
Energy: 0.9353442327078131
Energy: 0.35675284912889993
Energy: 0.6273900143267931
Energy: 0.3574800364245686
Energy: 0.936996145411077
Energy: 0.3574800364245686
Energy: 0.4577365954729179
Energy: 0.3609286371546305
Energy: 0.7953371127951103
Energy: 0.3609286371551328
Energy: 0.45327560982435966
Energy: 0.3571985067779008
Energy: 1.0089449962801014
Energy: 0.35719850677538983
Energy: 0.45644184117790576
Energy: 0.3592230276156785
Energy: 0.9390809205626708
Energy: 0.35922302761517627
Energy: 0.3617848720459472
Energy: 0.35898240651284025
Energy: 0.9412408263564829
Energy: 0.3589824065138446
Energy: 0.35814738714954886
Energy: 0.35768213175447433
Energy: 1.0081131809397956
Energy: 0.3576821317534699
Energy: 0.3607493439888223
Energy: 0.36004718530153573
Energy: 0.8664788678606743
Energy: 0.36004718530304225
Energy: 0.4568950290372439
Energy: 0.35905769690382316
Energy: 1.0140156834942156
Energy: 0.35905769690281875
Energy: 0.44959042535029
Energy: 0.3573088449133132
Energy: 1.0084052667590975
Energy: 0.3573088449118066
Energy: 0.45746233773801326
Energy: 0.3606011308149291
Energy: 0.869992288052792
Energy: 0.36060113081392475
Energy: 0.6269672584982678
Energy: 0.35807527058941574
Energy: 0.8615243930569864
Energy: 0.3580752705869048
Energy: 0.6293735097926542
Energy: 0.3570332723306766
Energy: 0.9361988716947657
Energy: 0.3570332723276635
Energy: 0.6320534310312508
Energy: 0.3594309628426892
Energy: 0.7138087206828455
Energy: 0.35943096283919673
Energy: 0.7857342290603784
Energy: 0.3899579763177304
Energy: 0.8672179117237259
Energy: 0.38995797631521945
Energy: 0.6274540571212517
Energy: 0.3904243926237863
Energy: 0.7864533317376353
Energy: 0.390424392625795
Energy: 0.7882676059406992
Energy: 0.3943660369259126
Energy: 0.715955789060539
Energy: 0.3943660369259126
Energy: 0.7911419847378138
Energy: 0.3596956505320903
Energy: 0.7857560409922874
Energy: 0.35969565053259245
Energy: 0.7860414873901719
Energy: 0.3574140793880632
Energy: 0.6284213804973575
Energy: 0.3574140793840456
Energy: 0.9379322806416371
Energy: 0.35707361154404077
Energy: 0.5432928409843614
Energy: 0.3570736115450451
Energy: 0.7904538361983524
Energy: 0.3603837875336719
Energy: 0.6331222878584455
Energy: 0.36038378753417405
Energy: 0.9374160774934097
Energy: 0.35845489519205076
Energy: 0.45553004824231924
Energy: 0.3584548951925529
Energy: 0.9343172439665599
Energy: 0.35858921615882366
Energy: 0.45825784054049096
Energy: 0.35858921616183675
Energy: 0.9491335163418545
Energy: 0.36129155893483766
Energy: 0.3636615396390176
Energy: 0.36129155892881143
Energy: 0.9347367343726583
Energy: 0.35879995982213025
Energy: 0.3604040394546567
Energy: 0.3587999598196194
Energy: 1.0103143111228126
Energy: 0.35869356101602723
Energy: 0.35932537339515497
Energy: 0.3586935610165294

minimum gb energy = 0.35675284912889993 eV
minimum distance =  2.65287754437708 Angstroms
sigma value = 85


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

Energy: 1.0160465839160693
Energy: 0.32285389727049196
Energy: 0.32267128039849935
Energy: 0.32285389709112555
Energy: 0.9676800791478308
Energy: 0.32214451574870634
Energy: 0.40439386956698214
Energy: 0.32214451574914194
Energy: 0.9046211154090652
Energy: 0.3218274313673774
Energy: 0.4074533889086334
Energy: 0.3218274313660707
Energy: 0.766831009400568
Energy: 0.32439665651617045
Energy: 0.5620201355087199
Energy: 0.32439665651268607
Energy: 0.9055164127164289
Energy: 0.3207148487694719
Energy: 0.5593407779372974
Energy: 0.3207148487672942
Energy: 0.7681028845466514
Energy: 0.32120418898422726
Energy: 0.5602407171364804
Energy: 0.32120418898379177
Energy: 0.7715720987548441
Energy: 0.321667945186933
Energy: 0.7043247007180049
Energy: 0.3216679451098807
Energy: 0.8406539872938438
Energy: 0.32080827305442067
Energy: 0.5575057723545219
Energy: 0.32080827301219234
Energy: 0.7717016535771639
Energy: 0.32070614829974403
Energy: 0.7008714609080886
Energy: 0.3207061483415368
Energy: 0.7704320641177825
Energy: 0.3787405767825115
Energy: 0.8358257028143061
Energy: 0.378740576782947
Energy: 0.7049506634849044
Energy: 0.37889823592295274
Energy: 0.7000623775080665
Energy: 0.3788982359216461
Energy: 0.6324274497801202
Energy: 0.3217120358270192
Energy: 0.8363008230876596
Energy: 0.321712035829197
Energy: 0.6998795356478482
Energy: 0.3209129400554812
Energy: 0.836601638294801
Energy: 0.3209129400528679
Energy: 0.5656176641183319
Energy: 0.32227025579462176
Energy: 0.7031980141274946
Energy: 0.3222702557941862
Energy: 0.48145971512099944
Energy: 0.3208487839799493
Energy: 0.9668933683964783
Energy: 0.3208487839799493
Energy: 0.5621817085564064
Energy: 0.3225895843819153
Energy: 0.8383984784001106
Energy: 0.3225895843814798
Energy: 0.40843855635576165
Energy: 0.32278298007182515
Energy: 0.8357235825747331
Energy: 0.3227829800722607
Energy: 0.4023728918912982
Energy: 0.3209828693924253
Energy: 1.0317789316830503
Energy: 0.3209828693924253
Energy: 0.40595785122577716
Energy: 0.32260204048104624
Energy: 0.9665295282360664
Energy: 0.3226020404797396
Energy: 0.32303258486726066
Energy: 0.3221409964574034
Energy: 0.9665404609181849
Energy: 0.32214099645783895
Energy: 0.3214513781299068
Energy: 0.32111368821098335
Energy: 1.0318577607965795
Energy: 0.32111368821054787
Energy: 0.3223256301886052
Energy: 0.3222403381294984
Energy: 0.9032677420199495
Energy: 0.32224033812906294
Energy: 0.40693266472843875
Energy: 0.3225501935125529
Energy: 1.0293928492398015
Energy: 0.32255019351342396
Energy: 0.4031848579914472
Energy: 0.3208573046405615
Energy: 0.9671904505200785
Energy: 0.3208573046405615
Energy: 0.4056697622418051
Energy: 0.3217678545634883
Energy: 0.7682307762328967
Energy: 0.3217678545652305
Energy: 0.5593382907384027
Energy: 0.321308641758373
Energy: 1.03407775071122
Energy: 0.3213086417588086
Energy: 0.5589863665640842
Energy: 0.32087324706990483
Energy: 0.9035518708372499
Energy: 0.3208732470703403
Energy: 0.6393620110899736
Energy: 0.3227929518166818
Energy: 0.7697538364169213
Energy: 0.3227929518149396
Energy: 0.70215831029308
Energy: 0.32072890252485403
Energy: 0.9070424191866824
Energy: 0.3207289025222408
Energy: 0.7003422373957288
Energy: 0.32142471272158474
Energy: 0.7684753145060585
Energy: 0.32142471272811796
Energy: 0.837585435375159
Energy: 0.379311637381509
Energy: 0.6316085880003985
Energy: 0.3793116373849934
Energy: 0.7043445071797858
Energy: 0.37909772550739695
Energy: 0.7733556151123848
Energy: 0.3790977255091391
Energy: 0.8370221465130729
Energy: 0.32138459466664054
Energy: 0.6294851456913959
Energy: 0.3213845946718671
Energy: 0.9076006279844105
Energy: 0.3209109639963474
Energy: 0.6302764006444387
Energy: 0.3209109639954763
Energy: 0.6993753649366569
Energy: 0.3219543096781579
Energy: 0.5628287767646034
Energy: 0.3219543096794646
Energy: 0.9689916023503057
Energy: 0.3208242873468335
Energy: 0.5589547335599386
Energy: 0.32082428734639795
Energy: 0.9693112466440647
Energy: 0.3212959922727234
Energy: 0.5592329351994588
Energy: 0.3212959922727234
Energy: 0.8361950928098175
Energy: 0.3208389666996368
Energy: 0.40592872981431727
Energy: 0.32083896669876577
Energy: 1.0326948033824586
Energy: 0.3208510732994939
Energy: 0.40318284207216937
Energy: 0.320851073300365
Energy: 0.9667536799474423
Energy: 0.32218065730818235
Energy: 0.40729571442979107
Energy: 0.32218065730861795
Energy: 0.8347913539903338
Energy: 0.3220440979250441
Energy: 0.320827789656276
Energy: 0.3220440979237375
Energy: 1.031832964508747
Energy: 0.3210216099606241
Energy: 0.32128349381057436
Energy: 0.32102160996018864
Energy: 0.9086705175840767
Energy: 0.3210568527601023
Energy: 0.32177538384077786
Energy: 0.3210568527601023

minimum gb energy = 0.32070614829974403 eV
minimum distance =  2.64877581274648 Angstroms
sigma value = 113


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

Energy: 0.00978953897585875
Energy: 0.272365479822223
Energy: 0.7786728920624568
Energy: 0.27236547982354375
Energy: 0.5787464624755958
Energy: 0.07303917749034206
Energy: 0.5774905970608457
Energy: 0.07303917749099309
Energy: 0.010149098487427613
Energy: 0.07223405616004062
Energy: 0.576454158867031
Energy: 0.07223405615905477
Energy: 0.010938351009477817
Energy: 0.07471143272722107
Energy: 0.5805099917967359
Energy: 0.07471143272657
Energy: 0.5788429558233646
Energy: 0.07416534973540093
Energy: 0.5796052219041485
Energy: 0.07416534973508469
Energy: 0.010197108382891016
Energy: 0.07241959633518938
Energy: 0.5764874713794148
Energy: 0.07241959633584044

minimum gb energy = 0.00978953897585875 eV
minimum distance =  2.90439624590506 Angstroms
sigma value = 1