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=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5181212425231942
cohesive_energy=4.385853711507128
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01791285459456901
Energy: 0.018503872178674458
Energy: 0.6494878092776769
Energy: 0.018503872178674458
Energy: 0.018503872179336692
Energy: 1.336286596209761
Energy: 0.018503872179336692
Energy: 1.336286596209761
Energy: 0.6494878092783023
Energy: 0.018503872179336692
Energy: 0.01791285459456901
Energy: 0.018503872179962137
Energy: 0.018503872179336692
Energy: 1.336286596209761
Energy: 0.018503872179336692
Energy: 1.3362865962091357

minimum gb energy = 0.01791285459456901 eV
minimum distance =  2.43156973242249 Angstroms
sigma value = 1


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

Energy: 1.3482312034168913
Energy: 1.396057468283682
Energy: 1.2201458705161226
Energy: 1.396057468283682
Energy: 1.2532397776108863
Energy: 1.3515286130052988
Energy: 1.2564995852124676
Energy: 1.3515286130044957
Energy: 1.1781254490787758
Energy: 1.382590154690321
Energy: 1.2470689361114002
Energy: 1.3825901546887147
Energy: 1.2391742394412288
Energy: 1.4038629298292242
Energy: 1.2291515423178692
Energy: 1.4038629298292242
Energy: 1.2428466898305919
Energy: 1.399838866836957
Energy: 1.2428061107734159
Energy: 1.3998388668393662
Energy: 1.1915322777375177
Energy: 1.345729718863696
Energy: 1.194721599269872
Energy: 1.3457297188644992
Energy: 1.2571274357021767
Energy: 1.380123342333351
Energy: 1.1931023663584754
Energy: 1.3801233423341541
Energy: 1.1182470991355484
Energy: 1.397309519644832
Energy: 1.1861180812411114
Energy: 1.3973095196416192
Energy: 1.23503708829384
Energy: 1.2521385598004309
Energy: 1.2431321566981133
Energy: 1.2521385597980212
Energy: 1.1872475311834467
Energy: 1.3837094137333183
Energy: 1.113137053541275
Energy: 1.3837094137349244
Energy: 1.2449280232818647
Energy: 1.3510546433546724
Energy: 1.235136631530403
Energy: 1.3510546433546724
Energy: 1.2056667374492085
Energy: 1.397145341721264
Energy: 1.1986050530248296
Energy: 1.3971453417220672
Energy: 1.2551543149666389
Energy: 1.3814004398683333
Energy: 1.2571458567356422
Energy: 1.3814004398659239
Energy: 1.2480688418165145
Energy: 1.3830835548673932
Energy: 1.2187424057284606
Energy: 1.3830835548689995
Energy: 1.242514476348104
Energy: 1.3971226534309815
Energy: 1.24716407692745
Energy: 1.3971226534358003
Energy: 1.2404575460938
Energy: 1.3995818944447556
Energy: 1.2492612505234146
Energy: 1.3995818944431493
Energy: 1.2473853610156411
Energy: 1.3837855826986567
Energy: 1.1607454792060088
Energy: 1.3837855826978533
Energy: 1.2567076161322412
Energy: 1.3325736876068093
Energy: 1.254086139395111
Energy: 1.3325736876043999
Energy: 1.1216964441238741
Energy: 1.3962547435449433
Energy: 1.1976393030246806
Energy: 1.3962547435449433
Energy: 1.2602208064560063
Energy: 1.2523261456097656
Energy: 1.238436265024184
Energy: 1.2523261456089625
Energy: 1.1906682761238154
Energy: 1.3799226524485197
Energy: 1.1313531533044743
Energy: 1.3799226524501262
Energy: 1.22824171756015
Energy: 1.263595631053129
Energy: 1.2406880330778303
Energy: 1.263595631053129
Energy: 1.2419690333924882
Energy: 1.3999550497959037
Energy: 1.1800244884221434
Energy: 1.3999550497934943
Energy: 1.2186091056905253
Energy: 1.3803425759005377
Energy: 1.191624555843979
Energy: 1.3803425759013408
Energy: 1.1929581218626828
Energy: 1.3447894840340848
Energy: 1.2569278348264143
Energy: 1.3447894840324783
Energy: 1.2382758556405808
Energy: 1.3968458342908867
Energy: 1.1817842254827304
Energy: 1.3968458342892802
Energy: 1.247159940915987
Energy: 1.3370663698715537
Energy: 1.2342492966818401
Energy: 1.337066369872357
Energy: 1.1807772478760048
Energy: 1.3809313608954499
Energy: 1.3284375633442906
Energy: 1.3809313608938438
Energy: 1.251927952637733
Energy: 1.3217671221090717
Energy: 1.2391151720115448
Energy: 1.3217671221066623
Energy: 1.3459294252895349
Energy: 1.3975400866101924
Energy: 1.2083536623849318
Energy: 1.3975400866117986
Energy: 1.2592294671501079
Energy: 1.3821105113069243
Energy: 1.255451860536385
Energy: 1.3821105113077274
Energy: 1.2192860553835925
Energy: 1.3824822816632036
Energy: 1.2481816902312788
Energy: 1.3824822816664162
Energy: 1.242621589894649
Energy: 1.4033538565616306
Energy: 1.2285685202278511
Energy: 1.4033538565632369

minimum gb energy = 1.113137053541275 eV
minimum distance =  2.16869054973113 Angstroms
sigma value = 1


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

Energy: 1.4450903146309995
Energy: 1.4855800871529097
Energy: 1.292984829966628
Energy: 1.4855800871593197
Energy: 1.3033049832993027
Energy: 1.4279760399375119
Energy: 1.318943664689292
Energy: 1.4279760399393433
Energy: 1.2431246588355265
Energy: 1.4884835704847312
Energy: 1.3138835303571808
Energy: 1.488483570468248
Energy: 1.2623120801451737
Energy: 1.298243854507029
Energy: 1.2486714395955394
Energy: 1.2982438545033659
Energy: 1.2627248333589889
Energy: 1.4577706551542962
Energy: 1.2895173607345807
Energy: 1.4577706551506329
Energy: 1.2987642040926792
Energy: 1.4571880930816783
Energy: 1.266426999271921
Energy: 1.4571880930835097
Energy: 1.3024543592573006
Energy: 1.303103398536968
Energy: 1.2489239730161164
Energy: 1.3031033985351363
Energy: 1.1666275920901035
Energy: 1.4884672176210234
Energy: 1.263879787005725
Energy: 1.4884672176228548
Energy: 1.2886974317844169
Energy: 1.334992269624967
Energy: 1.3242297234247795
Energy: 1.334992269618557
Energy: 1.2611139998893945
Energy: 1.4838647912199558
Energy: 1.1727326826376974
Energy: 1.4838647912080514
Energy: 1.301908078284515
Energy: 1.4000045738492672
Energy: 1.319087671226728
Energy: 1.4000045738520146
Energy: 1.2279550212784802
Energy: 1.4715586680317647
Energy: 1.3140424768702073
Energy: 1.471558668023523
Energy: 1.3281284961569213
Energy: 1.4599280746941883
Energy: 1.2899517879585238
Energy: 1.459928074698767
Energy: 1.3280112448037595
Energy: 1.4599732942585046
Energy: 1.2896988457370226
Energy: 1.4599732942502632
Energy: 1.2277701978186895
Energy: 1.4716555756988863
Energy: 1.3140919734858296
Energy: 1.4716555756897287
Energy: 1.3016977467479252
Energy: 1.3999365502958232
Energy: 1.3189845732025707
Energy: 1.3999365502994865
Energy: 1.2611120605994852
Energy: 1.483670578489668
Energy: 1.172746327612371
Energy: 1.4836705784924153
Energy: 1.2887557385461992
Energy: 1.3349004263495283
Energy: 1.3243343022403673
Energy: 1.3349004263422024
Energy: 1.1666259075759555
Energy: 1.4888790555651137
Energy: 1.2638189953295647
Energy: 1.488879055567861
Energy: 1.3023683858419255
Energy: 1.3030079308140048
Energy: 1.2490528768151505
Energy: 1.3030079308176679
Energy: 1.299043047401717
Energy: 1.4572546162328293
Energy: 1.2664368766543652
Energy: 1.4572546162346607
Energy: 1.2626886320094806
Energy: 1.4577035812702335
Energy: 1.2894692145069873
Energy: 1.4577035812674863
Energy: 1.2623682976696307
Energy: 1.2983024983944045
Energy: 1.2485819312797368
Energy: 1.298302498392573
Energy: 1.2431252290739503
Energy: 1.4884855037398947
Energy: 1.3139213868179036
Energy: 1.4884855037380633
Energy: 1.3033901992623216
Energy: 1.4279696346121742
Energy: 1.3188353500788756
Energy: 1.4279696346021014
Energy: 1.4450903146309995
Energy: 1.4855800871519937
Energy: 1.2929848299675437
Energy: 1.4855800871593197
Energy: 1.3033049832993027
Energy: 1.4279760399375119
Energy: 1.3189436646883763
Energy: 1.4279760399411745
Energy: 1.243124658833695
Energy: 1.4884835704838153
Energy: 1.3138835303571808
Energy: 1.4884835704673323
Energy: 1.2623120801460896
Energy: 1.298243854507029
Energy: 1.2486714395955394
Energy: 1.2982438545033659

minimum gb energy = 1.1666259075759555 eV
minimum distance =  2.18780582003597 Angstroms
sigma value = 25


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

Energy: 1.3841548270531987
Energy: 1.5627137083359306
Energy: 1.3786412225984332
Energy: 1.5627137083359306
Energy: 1.398071639987212
Energy: 1.4749848623186945
Energy: 1.3553094286853953
Energy: 1.4749848623176303
Energy: 1.3174010814102837
Energy: 1.609718337032553
Energy: 1.355006098386928
Energy: 1.609718337032553
Energy: 1.3702562124853055
Energy: 1.5025892734817563
Energy: 1.3152878264911558
Energy: 1.502589273480692
Energy: 1.3168542883113865
Energy: 1.563337694594464
Energy: 1.3089229585202584
Energy: 1.5633376945955284
Energy: 1.3852411250665464
Energy: 1.6020708380222712
Energy: 1.3955394016095637
Energy: 1.6020708380212068
Energy: 1.3779914841701977
Energy: 1.3679831212177875
Energy: 1.3483864708193307
Energy: 1.3679831212199167
Energy: 1.3793666636213309
Energy: 1.5695293402874275
Energy: 1.2466153172270185
Energy: 1.5695293402874275
Energy: 1.348423976228103
Energy: 1.484596936458692
Energy: 1.398600633756748
Energy: 1.4845969364618858
Energy: 1.3563203880095767
Energy: 1.6027501665393584
Energy: 1.3011954282516005
Energy: 1.6027501665372297
Energy: 1.307617148431663
Energy: 1.563272530848907
Energy: 1.355309374757608
Energy: 1.5632725308499715
Energy: 1.3370249266459118
Energy: 1.5615278553141645
Energy: 1.3547028850915561
Energy: 1.5615278553130998
Energy: 1.3550091413251697
Energy: 1.4939929544955532
Energy: 1.30377340520164
Energy: 1.4939929544976822
Energy: 1.3486246513814495
Energy: 1.4315406693516421
Energy: 1.3963310481793119
Energy: 1.4315406693516421
Energy: 1.265673271710964
Energy: 1.5623112104065113
Energy: 1.2440865640652519
Energy: 1.562311210407576
Energy: 1.3552686001324905
Energy: 1.3670479662673993
Energy: 1.3166619256108825
Energy: 1.367047966268464
Energy: 1.2272041264316862
Energy: 1.6019738444519225
Energy: 1.2268266846494205
Energy: 1.601973844455116
Energy: 1.3151509602533675
Energy: 1.5021778993554906
Energy: 1.3849380554422526
Energy: 1.502177899352297
Energy: 1.3505961352282156
Energy: 1.498769259050354
Energy: 1.3171151276389321
Energy: 1.498769259050354
Energy: 1.3157017058200777
Energy: 1.6016375852613607
Energy: 1.3555906524733743
Energy: 1.6016375852613607
Energy: 1.3806366650704833
Energy: 1.4742979080060508
Energy: 1.377945435183743
Energy: 1.4742979080049863
Energy: 1.3855228276406681
Energy: 1.565153487100364
Energy: 1.3693060448297312
Energy: 1.5651534871024932
Energy: 1.3991977777743947
Energy: 1.5028977061172275
Energy: 1.3545964670623205
Energy: 1.5028977061161632
Energy: 1.226981806282241
Energy: 1.6081835688407684
Energy: 1.3562977811066335
Energy: 1.6081835688407684
Energy: 1.3544161945942876
Energy: 1.3828073953410611
Energy: 1.314996846607915
Energy: 1.3828073953410611

minimum gb energy = 1.2268266846494205 eV
minimum distance =  2.19056015066022 Angstroms
sigma value = 9


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

Energy: 1.4764138909007172
Energy: 1.4754495013784013
Energy: 1.4803623326920865
Energy: 1.4754495013796711
Energy: 1.429188646008459
Energy: 1.5827505262409343
Energy: 1.467242391152314
Energy: 1.5827505262460138
Energy: 1.3081127678953541
Energy: 1.4811244621130877
Energy: 1.4765111449522406
Energy: 1.4811244621219766
Energy: 1.482452996915386
Energy: 1.6018100758533313
Energy: 1.3351519944519021
Energy: 1.6018100758520617
Energy: 1.497644503434551
Energy: 1.5824787049152838
Energy: 1.443458715473136
Energy: 1.5824787049165534
Energy: 1.2935360300300958
Energy: 1.4812023998283246
Energy: 1.33554638567239
Energy: 1.4812023998270547
Energy: 1.4731300463340307
Energy: 1.335243566899496
Energy: 1.3362690332550546
Energy: 1.335243566896956
Energy: 1.3810365929899227
Energy: 1.480983835771194
Energy: 1.322825255287824
Energy: 1.480983835771194
Energy: 1.474150539097532
Energy: 1.582379931284143
Energy: 1.4766876665737685
Energy: 1.582379931284143
Energy: 1.4823090778553305
Energy: 1.4756920035273142
Energy: 1.335288387113204
Energy: 1.4756920035222345
Energy: 1.3828921729670622
Energy: 1.5767449138886247
Energy: 1.4764622440420914
Energy: 1.576744913886085
Energy: 1.482998257139309
Energy: 1.5161009525083258
Energy: 1.3350060068798608
Energy: 1.516100952509596
Energy: 1.2936286784976456
Energy: 1.4752019923595183
Energy: 1.3495105891480965
Energy: 1.4752019923607882
Energy: 1.400577766689578
Energy: 1.4807504561382991
Energy: 1.467586003636361
Energy: 1.4807504561433786
Energy: 1.2936316614394254
Energy: 1.4751125599339214
Energy: 1.3461583794507856
Energy: 1.475112559927601
Energy: 1.482720264238468
Energy: 1.5163521539940505
Energy: 1.335005021951754
Energy: 1.5163521539940505
Energy: 1.3828792879935856
Energy: 1.576756455377438
Energy: 1.3842487985092562
Energy: 1.576756455377438
Energy: 1.4822805247927537
Energy: 1.4756623774327444
Energy: 1.3352080405620061
Energy: 1.4756623774327444
Energy: 1.474173441616403
Energy: 1.582351083513374
Energy: 1.3956189299926678
Energy: 1.5823510835159138
Energy: 1.3810270408224183
Energy: 1.481018119785458
Energy: 1.3229826321425662
Energy: 1.481018119784188
Energy: 1.4731246913883342
Energy: 1.3353055843525006
Energy: 1.3362634026867088
Energy: 1.3353055843613897

minimum gb energy = 1.2935360300300958 eV
minimum distance =  2.28296402508948 Angstroms
sigma value = 25


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

Energy: 1.4132404452386353
Energy: 1.6084754927363762
Energy: 1.6014011933921668
Energy: 1.6084754927348062
Energy: 1.3885044637671848
Energy: 1.5945668400212978
Energy: 1.3718662017773027
Energy: 1.5945668400228683
Energy: 1.3728760527784793
Energy: 1.5122561656284326
Energy: 1.3716605278105907
Energy: 1.5122561656237212
Energy: 1.412710530526346
Energy: 1.4760160837011849
Energy: 1.4871937351907587
Energy: 1.4760160837090373
Energy: 1.4862304230536758
Energy: 1.389473129094506
Energy: 1.43958775750593
Energy: 1.389473129094506
Energy: 1.3762188108399225
Energy: 1.7080433590808946
Energy: 1.3743260387567262
Energy: 1.7080433590793245
Energy: 1.37260420948321
Energy: 1.476630861661496
Energy: 1.3718187027038455
Energy: 1.4766308616583552
Energy: 1.4875727496640805
Energy: 1.6098418807978225
Energy: 1.4154488092828725
Energy: 1.609841880796252
Energy: 1.3716801824745903
Energy: 1.5878768484482384
Energy: 1.39021427931105
Energy: 1.587876848449809
Energy: 1.5412778591376228
Energy: 1.5116847802761277
Energy: 1.3733768703993243
Energy: 1.5116847802745572
Energy: 1.4463299222626937
Energy: 1.4761103284241786
Energy: 1.5884173206758945
Energy: 1.476110328425713
Energy: 1.3722393407878781
Energy: 1.4257319992471433
Energy: 1.5392988751252108
Energy: 1.4257319992471433
Energy: 1.4774439779556678
Energy: 1.512744394871808
Energy: 1.3719957787006916
Energy: 1.5127443948733788
Energy: 1.3716131787880497
Energy: 1.4770729909570677
Energy: 1.4126375979484316
Energy: 1.4770729909539269
Energy: 1.4228058330997297
Energy: 1.4767649160019936
Energy: 1.4814752794871957
Energy: 1.476764916000423
Energy: 1.390863018127905
Energy: 1.5152109798188282
Energy: 1.3761195473562347
Energy: 1.5152109798156874
Energy: 1.3720407431778001
Energy: 1.500830835535713
Energy: 1.5400283113717177
Energy: 1.5008308355372832

minimum gb energy = 1.3716131787880497 eV
minimum distance =  2.26447597868587 Angstroms
sigma value = 17


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

Energy: 1.553244954811242
Energy: 1.5525275207229723
Energy: 1.676348932160683
Energy: 1.5525275207247513
Energy: 1.5359415166821127
Energy: 1.5160042231753332
Energy: 1.417882372149796
Energy: 1.5160042231726651
Energy: 1.5223352164871786
Energy: 1.5448643639156998
Energy: 1.4180352500164817
Energy: 1.5448643639121418
Energy: 1.4197861180208473
Energy: 1.6393740562616457
Energy: 1.4940650930972825
Energy: 1.639374056262535
Energy: 1.5665594213475447
Energy: 1.491705044399204
Energy: 1.463027159947721
Energy: 1.491705044399204
Energy: 1.4360420371682017
Energy: 1.4681627391005936
Energy: 1.5209335115983267
Energy: 1.4681627391041516
Energy: 1.423741379691974
Energy: 1.576277919045362
Energy: 1.4184401135603155
Energy: 1.5762779190462517
Energy: 1.5139813362645687
Energy: 1.5509174825759822
Energy: 1.4332593681491894
Energy: 1.5509174825786505
Energy: 1.439384247343804
Energy: 1.6290094792057548
Energy: 1.5600103082360355
Energy: 1.6290094792039758
Energy: 1.6315856650122773
Energy: 1.5196945461310887
Energy: 1.4185601069744609
Energy: 1.5196945461293097
Energy: 1.4233913233844024
Energy: 1.5515640608276797
Energy: 1.526348294780468
Energy: 1.55156406082679
Energy: 1.4343108296023444
Energy: 1.5735539175727598
Energy: 1.4340819314521285
Energy: 1.5735539175718702
Energy: 1.522926982931156
Energy: 1.5520145697188659
Energy: 1.553347994400933
Energy: 1.5520145697197554
Energy: 1.4182573351088326
Energy: 1.565521246230222
Energy: 1.5337017406564557
Energy: 1.56552124623196
Energy: 1.514462941790732
Energy: 1.5779560818630856
Energy: 1.4393194446644206
Energy: 1.5779560818639753
Energy: 1.5228095462707867
Energy: 1.5510037387259163
Energy: 1.5139585275710854
Energy: 1.5510037387276954
Energy: 1.4188408729372535
Energy: 1.5768416763022068
Energy: 1.6311713125288785
Energy: 1.5768416763030961
Energy: 1.5415533637261538
Energy: 1.546154779856083
Energy: 1.4358806773119643
Energy: 1.5461547798525253
Energy: 1.4186734824645977
Energy: 1.5805010607773333
Energy: 1.5081305834994898
Energy: 1.5805010607782228
Energy: 1.418402788810458
Energy: 1.6393382551591011
Energy: 1.4201524628844115
Energy: 1.6393382551591011
Energy: 1.4662014813513082
Energy: 1.5447315759325393
Energy: 1.5220311787054566
Energy: 1.5447315759360971
Energy: 1.4187614626356517
Energy: 1.6382446703459823
Energy: 1.6327948426779735
Energy: 1.6382446703468718
Energy: 1.5513652159735045
Energy: 1.5514504574603587
Energy: 1.4182741429118544
Energy: 1.5514504574603587
Energy: 1.433541010218301
Energy: 1.578357894433505
Energy: 1.5238669147174688
Energy: 1.5783578944352838
Energy: 1.4330503713898581
Energy: 1.544061642392522
Energy: 1.5225824166986666
Energy: 1.5440616423916325
Energy: 1.5445844348626776
Energy: 1.5513867781064734
Energy: 1.419444625867981
Energy: 1.5513867781091417
Energy: 1.4487682345403978
Energy: 1.6069299004618742
Energy: 1.6761963552216794
Energy: 1.6069299004565376
Energy: 1.5216162243038258
Energy: 1.4688917896941127
Energy: 1.5235292401633942
Energy: 1.4688917896923337
Energy: 1.6312760232364087
Energy: 1.6381734376013872
Energy: 1.4234133914089957
Energy: 1.6381734376013872
Energy: 1.4332651239710867
Energy: 1.6273843324743777
Energy: 1.541697031581893
Energy: 1.6273843324734882

minimum gb energy = 1.417882372149796 eV
minimum distance =  2.16150262925167 Angstroms
sigma value = 53


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

Energy: 1.3772427819609234
Energy: 1.3757143181305158
Energy: 1.7430049968782628
Energy: 1.3757143181305158
Energy: 1.5749769049159947
Energy: 1.4876219271363813
Energy: 1.4308900745474507
Energy: 1.4876219271363813
Energy: 1.378013516008419
Energy: 1.3753335250266965
Energy: 1.403446722393223
Energy: 1.3753335250287437
Energy: 1.378010739792412
Energy: 1.3753463013105207
Energy: 1.4034091089686522
Energy: 1.3753463013105207
Energy: 1.57452252907957
Energy: 1.4876049920117174
Energy: 1.4308996794887079
Energy: 1.4876049920158125
Energy: 1.3772427819609234
Energy: 1.375714318134611
Energy: 1.7430049968782628
Energy: 1.3757143181325635
Energy: 1.5749769049180424
Energy: 1.4876219271363813
Energy: 1.4308900745474507
Energy: 1.4876219271363813
Energy: 1.378013516010467
Energy: 1.3753335250266965
Energy: 1.4805790173234519
Energy: 1.3753335250287437
Energy: 1.378010739792412
Energy: 1.3753463013105207
Energy: 1.4034091089727476
Energy: 1.3753463013105207
Energy: 1.574522529083619
Energy: 1.4876049920117174
Energy: 1.4308996794866604
Energy: 1.4876049920178602
Energy: 1.3772427819609234
Energy: 1.3757143181305158
Energy: 1.7430049968782628
Energy: 1.3757143181305158
Energy: 1.5749769049180424
Energy: 1.4876219271363813
Energy: 1.4308900745474507
Energy: 1.4876219271363813
Energy: 1.378013516008419
Energy: 1.3753335250266965
Energy: 1.4805790173234519
Energy: 1.3753335250287437

minimum gb energy = 1.3753335250266965 eV
minimum distance =  2.24912437009615 Angstroms
sigma value = 9


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

Energy: 1.491105638572142
Energy: 1.6517230856349074
Energy: 1.7988459431643191
Energy: 1.6517230856326341
Energy: 1.6137439516986307
Energy: 1.5521277729550373
Energy: 1.4827846997654126
Energy: 1.5521277729535217
Energy: 1.4641883684184451
Energy: 1.4729474541494816
Energy: 1.4764455683366748
Energy: 1.4729474541502396
Energy: 1.5734732433866638
Energy: 1.6954165008225663
Energy: 1.4817689828895426
Energy: 1.6954165008195348
Energy: 1.6231191099153874
Energy: 1.5561335133117713
Energy: 1.474284884829645
Energy: 1.5561335133140448
Energy: 1.473408377416885
Energy: 1.4727488967437117
Energy: 1.5831075969385404
Energy: 1.4727488967421962
Energy: 1.7642544315107702
Energy: 1.5497855890571333
Energy: 1.4791511659313643
Energy: 1.5497855890556178
Energy: 1.4716560092869067
Energy: 1.6919069554165096
Energy: 1.5894495327370881
Energy: 1.6919069554195414
Energy: 1.4648905130446057
Energy: 1.7140648866191346
Energy: 1.480731935082583
Energy: 1.714064886607009
Energy: 1.4641774309729623
Energy: 1.546207066588894
Energy: 1.475659533675113
Energy: 1.5462070665851044
Energy: 1.471915690093079
Energy: 1.6963747116823729
Energy: 1.7235092379030912
Energy: 1.6963747116876777
Energy: 1.6059945832752314
Energy: 1.6370261950624485
Energy: 1.466936731965213
Energy: 1.637026195060175
Energy: 1.4638622088666828
Energy: 1.5688061645630427
Energy: 1.6715645409549047
Energy: 1.5688061645615268
Energy: 1.5785019374890192
Energy: 1.623951948053738
Energy: 1.494468478828252
Energy: 1.6239519480575275
Energy: 1.4730844971495844
Energy: 1.6397798278837488
Energy: 1.5863994923729994
Energy: 1.6397798278867803
Energy: 1.466294673944433
Energy: 1.7331614248541503
Energy: 1.5741593820643516
Energy: 1.7331614248503608
Energy: 1.5327182087126674
Energy: 1.640584821054411
Energy: 1.4729422886194694
Energy: 1.6405848210559266
Energy: 1.4737643415559345
Energy: 1.5504515355180615
Energy: 1.6626529695117083
Energy: 1.5504515355150301
Energy: 1.6203282677340571
Energy: 1.5679102102977578
Energy: 1.4745130396527228
Energy: 1.5679102103038207
Energy: 1.4675720790578377
Energy: 1.5646449254881694
Energy: 1.5502881825479724
Energy: 1.564644925489685
Energy: 1.5795972449394722
Energy: 1.7206316754665756
Energy: 1.5757086252036765
Energy: 1.720631675464302
Energy: 1.5581048112312976
Energy: 1.612994494860968
Energy: 1.463639197800123
Energy: 1.6129944948639994
Energy: 1.4806418417218365
Energy: 1.6447766002524844
Energy: 1.4650044322813676
Energy: 1.644776600254
Energy: 1.7690022508478866
Energy: 1.5923586803324912
Energy: 1.471567259875643
Energy: 1.5923586805369765
Energy: 1.4801705082009529
Energy: 1.6525024785559703
Energy: 1.703766936826425
Energy: 1.652502478556728
Energy: 1.5310952422348871
Energy: 1.4730978804180899
Energy: 1.4638001132444198
Energy: 1.4730978804143005
Energy: 1.592905996408059
Energy: 1.6419026258490022
Energy: 1.5727360345666825
Energy: 1.6419026258482443
Energy: 1.50114925932985
Energy: 1.6963220743904204
Energy: 1.5733215515884553
Energy: 1.6963220743760212
Energy: 1.527870125980364
Energy: 1.4726432928475457
Energy: 1.4643877397857288
Energy: 1.4726432928490614
Energy: 1.4825782199279964
Energy: 1.7430755945031255
Energy: 1.7026249725981804
Energy: 1.7430755945031255
Energy: 1.5948186818033696
Energy: 1.5619503895821123
Energy: 1.4720100998677803
Energy: 1.561948951763556
Energy: 1.4833693854517136
Energy: 1.5512875791492433
Energy: 1.464865763962532
Energy: 1.551287579151517
Energy: 1.4817471857390692
Energy: 1.6165432924027017
Energy: 1.4645303694866358
Energy: 1.6165432924042171
Energy: 1.5725021609627203
Energy: 1.696061175220574
Energy: 1.5733191636882702
Energy: 1.6960611752023855
Energy: 1.473230034018869
Energy: 1.679041247328437
Energy: 1.7635678265030508
Energy: 1.6790412473269214

minimum gb energy = 1.463639197800123 eV
minimum distance =  2.18547567368214 Angstroms
sigma value = 73


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

Energy: 1.5645985515511331
Energy: 1.561717480054049
Energy: 1.8195725426952811
Energy: 1.561717480051644
Energy: 1.5586075949239337
Energy: 1.6096932915952866
Energy: 1.480535891598198
Energy: 1.6096932915952866
Energy: 1.4805044031873622
Energy: 1.477978428796171
Energy: 1.4752558571349572
Energy: 1.4779784287913889
Energy: 1.4604116827898483
Energy: 1.6678111080578872
Energy: 1.4942198747002848
Energy: 1.6678111080614946
Energy: 1.5233926769383916
Energy: 1.602765238287445
Energy: 1.5242585439558196
Energy: 1.602765238287445
Energy: 1.49247954971685
Energy: 1.7378252877526497
Energy: 1.6445222864831657
Energy: 1.7378252877502451
Energy: 1.7635917901121847
Energy: 1.6608129590359035
Energy: 1.4775474848645738
Energy: 1.6608129590371061
Energy: 1.466252981830984
Energy: 1.4728470893160595
Energy: 1.6722909730500457
Energy: 1.4728470893160595
Energy: 1.698304334029223
Energy: 1.475310516625757
Energy: 1.479294140445798
Energy: 1.475310516623352
Energy: 1.477277590445855
Energy: 1.5858421835840983
Energy: 1.4770806707841657
Energy: 1.5858421835828962
Energy: 1.4682616470654937
Energy: 1.4754678770567446
Energy: 1.6467303021087043
Energy: 1.47546787705434
Energy: 1.603563171860987
Energy: 1.6646747656405338
Energy: 1.4601807397744349
Energy: 1.6646747656405338
Energy: 1.4931290915684607
Energy: 1.5792846477864417
Energy: 1.698346400082287
Energy: 1.579284647784037
Energy: 1.6950791747527076
Energy: 1.6610774230605043
Energy: 1.492481858063474
Energy: 1.6610774230593017
Energy: 1.4620499896718078
Energy: 1.7018682947589252
Energy: 1.6577038934682289
Energy: 1.701868294757723
Energy: 1.6452348787272464
Energy: 1.4737805216307052
Energy: 1.4668100208515007
Energy: 1.4737805216283002
Energy: 1.5526188813565558
Energy: 1.554814321184655
Energy: 1.4806114759707887
Energy: 1.5548143211882623
Energy: 1.5550177015727922
Energy: 1.6791757397032767
Energy: 1.4812255053455474
Energy: 1.679175739704479
Energy: 1.5303481828020247
Energy: 1.47292444956445
Energy: 1.468454742870183
Energy: 1.472924449562045
Energy: 1.4806660530868612
Energy: 1.5847317054962486
Energy: 1.7248856526477947
Energy: 1.5847317054998558
Energy: 1.6701531699429077
Energy: 1.47722760615011
Energy: 1.493691806356264
Energy: 1.4772276061537173
Energy: 1.4940462334808169
Energy: 1.6026285130917783
Energy: 1.5673633127524609
Energy: 1.6026285130905757

minimum gb energy = 1.4601807397744349 eV
minimum distance =  2.1859669725049 Angstroms
sigma value = 7


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

Energy: 1.5082980567336144
Energy: 1.5066604578886915
Energy: 1.8334522539215767
Energy: 1.506660457899706
Energy: 1.7523869258898501
Energy: 1.5701261279245153
Energy: 1.4789845804363697
Energy: 1.5701261279228145
Energy: 1.4688939836543078
Energy: 1.686985469812855
Energy: 1.4799931090704206
Energy: 1.6869854698179563
Energy: 1.4972909063269142
Energy: 1.6050996807035245
Energy: 1.4784887228854902
Energy: 1.6050996807171283
Energy: 1.468939261778055
Energy: 1.5744470415919378
Energy: 1.493689732108146
Energy: 1.5744470415808847
Energy: 1.465229790321354
Energy: 1.5069260304696517
Energy: 1.6773210588692682
Energy: 1.5069260304756034
Energy: 1.6195339736098553
Energy: 1.649632671049657
Energy: 1.4972190944104025
Energy: 1.6496326710445552
Energy: 1.4653585051658908
Energy: 1.5078559337232713
Energy: 1.7293474651899994
Energy: 1.5078559337343242
Energy: 1.6559975158952378
Energy: 1.5848486602154304
Energy: 1.4805826113549834
Energy: 1.5848486602111789
Energy: 1.4651549084528694
Energy: 1.6072247129736976
Energy: 1.5943964962892225
Energy: 1.6072247129770987
Energy: 1.498973421279583
Energy: 1.6994061401686376
Energy: 1.4971202284925607
Energy: 1.6994061401524831
Energy: 1.5137957285890027
Energy: 1.5748262157868882
Energy: 1.5037489164766227
Energy: 1.5748262157970911
Energy: 1.5143606659295197
Energy: 1.512332163993321
Energy: 1.504451311988411
Energy: 1.5123321639890697
Energy: 1.4983240784548633
Energy: 1.4957000079847078
Energy: 1.5025441270274853
Energy: 1.4957000079813458
Energy: 1.462850810173205
Energy: 1.6949811112317672
Energy: 1.779185418698383
Energy: 1.6949811112377189
Energy: 1.8140627349071008
Energy: 1.4954767289692572
Energy: 1.4846592687961455
Energy: 1.49547672897946
Energy: 1.4627139031884346
Energy: 1.5751921293191227
Energy: 1.5396112464714657
Energy: 1.5751921293191227
Energy: 1.4880976353769872
Energy: 1.672651596416346
Energy: 1.5020784485292975
Energy: 1.6726515964061432
Energy: 1.4629131146450665
Energy: 1.7012181292975206
Energy: 1.5040277506194992
Energy: 1.7012181292958202
Energy: 1.4647442865841558
Energy: 1.5770255334298333
Energy: 1.5017681758639216
Energy: 1.5770255334213308
Energy: 1.4987050411510674
Energy: 1.6996467718763186
Energy: 1.4806248663896955
Energy: 1.699646771884821
Energy: 1.4650262074261455
Energy: 1.687607967437763
Energy: 1.5958238994804126
Energy: 1.6876079674420141
Energy: 1.7110508492348377
Energy: 1.5863032092353302
Energy: 1.4971469780912663
Energy: 1.5863032092370308
Energy: 1.510744221765386
Energy: 1.507631621209779
Energy: 1.6772946787415326
Energy: 1.5076316212046774
Energy: 1.51128800773312
Energy: 1.5777483836890058
Energy: 1.4971709352299
Energy: 1.5777483836779531
Energy: 1.4970415342177295
Energy: 1.6976588409455253
Energy: 1.4983624366194952
Energy: 1.6976588409523272
Energy: 1.4692754997815924
Energy: 1.6042473593514346
Energy: 1.598313343858814
Energy: 1.6042473593429323
Energy: 1.4977847162534466
Energy: 1.5746429103113995
Energy: 1.4786594422150983
Energy: 1.5746429102977957
Energy: 1.4684492319666314
Energy: 1.507223653608477
Energy: 1.6354095981676817
Energy: 1.507223653604226
Energy: 1.821719356590465
Energy: 1.50760663806645
Energy: 1.4787452834210344
Energy: 1.5076066380604982
Energy: 1.4684746740063606
Energy: 1.5071832442628141
Energy: 1.6895115395436218
Energy: 1.5071832442713167

minimum gb energy = 1.4627139031884346 eV
minimum distance =  2.16702585853591 Angstroms
sigma value = 29


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

Energy: 1.462895886613558
Energy: 1.43186142257903
Energy: 1.8503205423805462
Energy: 1.4318614225787338
Energy: 1.4075513840603067
Energy: 1.4640685754801104
Energy: 1.46460240083542
Energy: 1.4640685754798142
Energy: 1.4361313596288658
Energy: 1.548761895566539
Energy: 1.5765096743371463
Energy: 1.5487618955659466
Energy: 1.464727991164571
Energy: 1.4076037772981027
Energy: 1.4639160777831015
Energy: 1.4076037773018542
Energy: 1.4630496042598558
Energy: 1.5038124899513872
Energy: 1.444199984176358
Energy: 1.5038124899522425
Energy: 1.4311722340851185
Energy: 1.5469008720551536
Energy: 1.4311655101791185
Energy: 1.5469008720540018
Energy: 1.4301469771430702
Energy: 1.503803703062347
Energy: 1.463031098039583
Energy: 1.5038037030629066
Energy: 1.4640594939996463
Energy: 1.4075648958180378
Energy: 1.464646757459349
Energy: 1.407564895819782
Energy: 1.5765339609291862
Energy: 1.5485803170728774
Energy: 1.4086130733989455
Energy: 1.5485803170728774

minimum gb energy = 1.4075513840603067 eV
minimum distance =  2.24847996722793 Angstroms
sigma value = 5


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

Energy: 1.3857147369338207
Energy: 1.3968268284813015
Energy: 1.8070468910791606
Energy: 1.3968268284813015
Energy: 1.356782526204906
Energy: 1.4745157287159818
Energy: 1.335439446085529
Energy: 1.4745157287175878
Energy: 1.343144773845722
Energy: 1.3827998991944332
Energy: 1.5897683867557069
Energy: 1.3827998991936299
Energy: 1.3323836349741234
Energy: 1.4608736501095954
Energy: 1.3518884412287795
Energy: 1.460873650107989
Energy: 1.3606869432154642
Energy: 1.4700320830451634
Energy: 1.61613960539546
Energy: 1.4700320830459666
Energy: 1.3835501068061917
Energy: 1.3999948455352773
Energy: 1.3343538697208117
Energy: 1.3999948455368838
Energy: 1.3429567783387695
Energy: 1.4681121675434217
Energy: 1.3346242169718723
Energy: 1.4681121675442246
Energy: 1.3394429945767088
Energy: 1.4012984528447172
Energy: 1.3481629815725555
Energy: 1.4012984528454473
Energy: 1.3609493637490735
Energy: 1.4685543267864918
Energy: 1.34438483519773
Energy: 1.4685543267856886
Energy: 1.357475462842086
Energy: 1.4691980275763417
Energy: 1.3342918926862057
Energy: 1.4691980275787508
Energy: 1.3320359192741105
Energy: 1.459997217356016
Energy: 1.3463893121919999
Energy: 1.4599972173536064
Energy: 1.3469090273769364
Energy: 1.4792784049646284
Energy: 1.3998165692374165
Energy: 1.4792784049694472
Energy: 1.3829060975885297
Energy: 1.3985980959058222
Energy: 1.401849710232392
Energy: 1.398598095905019
Energy: 1.3608148177270485
Energy: 1.3974401845272166
Energy: 1.379362476970759
Energy: 1.397440184528823
Energy: 1.378823761654352
Energy: 1.4630913771307332
Energy: 1.3463493654731815
Energy: 1.46309137712993
Energy: 1.3529180824823424
Energy: 1.382492881905168
Energy: 1.3629006730046838
Energy: 1.3824928819035616
Energy: 1.6193413740459668
Energy: 1.4817782938903081
Energy: 1.3340953927158612
Energy: 1.4817782938870956
Energy: 1.3623841049560752
Energy: 1.3981370309564356
Energy: 1.462117611013644
Energy: 1.3981370309572387
Energy: 1.3456229758241127
Energy: 1.471359044352898
Energy: 1.3366373429610099
Energy: 1.471359044352898
Energy: 1.3436945548637318
Energy: 1.4429556104094605
Energy: 1.3672942657706233
Energy: 1.4429556103982164
Energy: 1.3325798203697945
Energy: 1.4590116356025382
Energy: 1.3550780831008806
Energy: 1.4590116356057508
Energy: 1.3615985448183943
Energy: 1.4684384275984779
Energy: 1.365130683781804
Energy: 1.468438427599281
Energy: 1.3347732781681243
Energy: 1.399711008074605
Energy: 1.3318067090977714
Energy: 1.3997110080778175
Energy: 1.3974239534147688
Energy: 1.4101812331872652
Energy: 1.3434384078814
Energy: 1.4101812331848556
Energy: 1.4058253018756806
Energy: 1.391104952736496
Energy: 1.3357269944770496
Energy: 1.3911049527381023
Energy: 1.3858051096253694
Energy: 1.397388206233252
Energy: 1.3610302244274317
Energy: 1.3973882062364646
Energy: 1.3346304493839825
Energy: 1.447329122577879
Energy: 1.377455658193003
Energy: 1.4473291225762728
Energy: 1.3975409217166934
Energy: 1.4684925601392806
Energy: 1.352985181457304
Energy: 1.46849256014169
Energy: 1.3442693673989166
Energy: 1.471209042911354
Energy: 1.6061610153967771
Energy: 1.4712090429121571
Energy: 1.5142248047492968
Energy: 1.3983132762395802
Energy: 1.362437403611674
Energy: 1.3983132762379737
Energy: 1.337065233010821
Energy: 1.3654937992819103
Energy: 1.512013626745375
Energy: 1.3654937992795009
Energy: 1.6031799867860064
Energy: 1.4163991831404428
Energy: 1.3432588973076758
Energy: 1.4163991831340907
Energy: 1.355846803967785
Energy: 1.462678794537038
Energy: 1.3320415681271633
Energy: 1.4626787945394475

minimum gb energy = 1.3318067090977714 eV
minimum distance =  2.16952944271294 Angstroms
sigma value = 1


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

Energy: 1.3325043176263105
Energy: 1.3312859617602728
Energy: 1.789863772596488
Energy: 1.3312859617635535
Energy: 1.343735148682008
Energy: 1.35406686762622
Energy: 1.299884428433703
Energy: 1.3540668676217782
Energy: 1.2649247755666926
Energy: 1.331321998642662
Energy: 1.519585802877675
Energy: 1.3313219986437723
Energy: 1.2941585663901276
Energy: 1.4222322348940561
Energy: 1.2908389981253585
Energy: 1.4222322348940561
Energy: 1.264524634337383
Energy: 1.4631398049070459
Energy: 1.6073721597549857
Energy: 1.4631398049026039
Energy: 1.2636680973658994
Energy: 1.337649845701852
Energy: 1.2905193928957859
Energy: 1.3376498457040729
Energy: 1.2641497583229486
Energy: 1.4661302479056726
Energy: 1.3124486453265347
Energy: 1.466130247906783
Energy: 1.2642651179105828
Energy: 1.3377671992154399
Energy: 1.3456043361205137
Energy: 1.3377671992165505
Energy: 1.3315364085250794
Energy: 1.338435393791894
Energy: 1.345557909205091
Energy: 1.338435393796336
Energy: 1.331455353335005
Energy: 1.338252748857185
Energy: 1.3458033806237752
Energy: 1.338252748857185
Energy: 1.2642594227528556
Energy: 1.337771922650882
Energy: 1.3455562495723867
Energy: 1.3377719226586555
Energy: 1.264143654253771
Energy: 1.466111293231989
Energy: 1.3121849441627906
Energy: 1.4661112932330997
Energy: 1.2634804617605113
Energy: 1.337429800327113
Energy: 1.290096969828648
Energy: 1.3374298003148979
Energy: 1.2642825825618502
Energy: 1.4631549754669209
Energy: 1.6075008042674557
Energy: 1.4631549754680313
Energy: 1.2940539953796306
Energy: 1.4222550044850173
Energy: 1.2907809498693685
Energy: 1.4222550044872382
Energy: 1.264923296277932
Energy: 1.3311038112053202
Energy: 1.4518547772617998
Energy: 1.331103811214204
Energy: 1.342669637736961
Energy: 1.3542919297354015
Energy: 1.2998553936181125
Energy: 1.354291929734291
Energy: 1.3325043176263105
Energy: 1.3312859617613328
Energy: 1.5399327099630822
Energy: 1.3312859617635535
Energy: 1.343735148684229
Energy: 1.3540668676251095
Energy: 1.299884428433703
Energy: 1.3540668676228886
Energy: 1.2649247755666926
Energy: 1.331321998642662
Energy: 1.5195858028787856
Energy: 1.3313219986437723
Energy: 1.294158566387907
Energy: 1.4222322348951664
Energy: 1.2908389981242478
Energy: 1.4222322348940561
Energy: 1.264524634335162
Energy: 1.4631398049070459
Energy: 1.6073721597549857
Energy: 1.4631398049026039
Energy: 1.26366809736701
Energy: 1.3376498457007415
Energy: 1.2905193928968963
Energy: 1.3376498457040729
Energy: 1.2641497583218382
Energy: 1.4661302479056726
Energy: 1.3124486453254243
Energy: 1.466130247906783

minimum gb energy = 1.2634804617605113 eV
minimum distance =  2.19682041824255 Angstroms
sigma value = 17


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

Energy: 1.314515086389216
Energy: 1.3123772807408352
Energy: 1.7696731590231234
Energy: 1.3123772807415215
Energy: 1.5142933808508268
Energy: 1.2997560137008386
Energy: 1.2731449849322864
Energy: 1.2997560137070159
Energy: 1.2716138836821684
Energy: 1.2937128729917773
Energy: 1.6116405838350036
Energy: 1.2937128729938363
Energy: 1.3084467170666587
Energy: 1.2612618044127897
Energy: 1.2675035876393346
Energy: 1.2612618044326322
Energy: 1.2602957165704252
Energy: 1.3992876855180203
Energy: 1.2977591984038597
Energy: 1.3992876855152752
Energy: 1.2516622769851944
Energy: 1.2816013483299569
Energy: 1.2892891704326872
Energy: 1.281601348325152
Energy: 1.2756620441701791
Energy: 1.3752357885233226
Energy: 1.2965728851028397
Energy: 1.3752357885246953
Energy: 1.2531379670769838
Energy: 1.365409054551483
Energy: 1.2617736595093931
Energy: 1.365409054551483
Energy: 1.3068758319271343
Energy: 1.3670483432440461
Energy: 1.294050332804923
Energy: 1.3670483432419869
Energy: 1.2933476498345715
Energy: 1.3690247422815642
Energy: 1.2739539014699401
Energy: 1.3690247422849335
Energy: 1.271246419983005
Energy: 1.3370287630754034
Energy: 1.2625721931273444
Energy: 1.3370287630726578
Energy: 1.2754390528694008
Energy: 1.3703684427374423
Energy: 1.2734071509492815
Energy: 1.3703684427381286
Energy: 1.2500262743607808
Energy: 1.3572477559716696
Energy: 1.2745372699894866
Energy: 1.3572477559675515
Energy: 1.2670232690121306
Energy: 1.3977992828168013
Energy: 1.3122749198564243
Energy: 1.3977992828209196
Energy: 1.2516396504481493
Energy: 1.2708343065539218
Energy: 1.3237732140422762
Energy: 1.2708343065511765
Energy: 1.2710965240988725
Energy: 1.295542428764106
Energy: 1.5104318154677305
Energy: 1.2955424287620472
Energy: 1.2866027748204172
Energy: 1.2703779193537659
Energy: 1.2740505805991147
Energy: 1.270377919350334
Energy: 1.26256244582082
Energy: 1.3130626982140514
Energy: 1.2745818686603654
Energy: 1.3130626982181695
Energy: 1.4781836287567758
Energy: 1.373376840489376
Energy: 1.271805515462929
Energy: 1.3733768404585518
Energy: 1.2841907679223368
Energy: 1.2939917363522417
Energy: 1.315228463578615
Energy: 1.2939917363549873
Energy: 1.2690007553420086
Energy: 1.2869110909621364
Energy: 1.2642970315807363
Energy: 1.286911090959391
Energy: 1.263673343179614
Energy: 1.3707047133482417
Energy: 1.4989382625793295
Energy: 1.3707047133475554
Energy: 1.2974957054255487
Energy: 1.2814372409028691
Energy: 1.2861503062681503
Energy: 1.2814372409056145
Energy: 1.271604341542273
Energy: 1.3767211780851598
Energy: 1.5049247069153848
Energy: 1.376721178089278
Energy: 1.2863813929727752
Energy: 1.314122982417516
Energy: 1.2643288914795523
Energy: 1.3141229824188885
Energy: 1.2623709515191148
Energy: 1.4006901764203101
Energy: 1.285945879132452
Energy: 1.4006901764175648
Energy: 1.4833968926868464
Energy: 1.359076588397158
Energy: 1.2722991358955504
Energy: 1.3590765883916671
Energy: 1.3224219054746047
Energy: 1.5568485044674283
Energy: 1.2516155661283235
Energy: 1.5568485044701739
Energy: 1.3123747494963385
Energy: 1.397287596019086
Energy: 1.2613691421021531
Energy: 1.3972875960183997
Energy: 1.2624603215242554
Energy: 1.3571039530291262
Energy: 1.2864953442188631
Energy: 1.3571039530236348
Energy: 1.2639958923385861
Energy: 1.397591122797194
Energy: 1.2793318335131332
Energy: 1.397591122795135
Energy: 1.251679231584137
Energy: 1.3378727428584127
Energy: 1.267810259808744
Energy: 1.3378727428590989
Energy: 1.272007729663298
Energy: 1.368507319016405
Energy: 1.5122498959060007
Energy: 1.3685073190136596
Energy: 1.322654605275923
Energy: 1.3002290109800287
Energy: 1.288727219728882
Energy: 1.3002290109779697
Energy: 1.2622190896700756
Energy: 1.314845992712084
Energy: 1.3023702901961796
Energy: 1.314845992710711
Energy: 1.3547635240912548
Energy: 1.3770723526093673
Energy: 1.2741024843851343
Energy: 1.3770723526093673
Energy: 1.2862454522607922
Energy: 1.804218777242802
Energy: 1.2548449831864403
Energy: 1.8042187772469203
Energy: 1.2905072770740884
Energy: 1.4007806366877287
Energy: 1.2639083729132599
Energy: 1.4007806366932194

minimum gb energy = 1.2500262743607808 eV
minimum distance =  2.18019208290162 Angstroms
sigma value = 89


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

Energy: 1.1590911190094364
Energy: 1.1584708844707354
Energy: 1.741244077710134
Energy: 1.1584708844689395
Energy: 1.161670977786388
Energy: 1.2052840940018743
Energy: 1.1762871020053813
Energy: 1.2052840940000784
Energy: 1.1734348461802118
Energy: 1.3933166912873285
Energy: 1.969443526873759
Energy: 1.3933166912873285
Energy: 1.1483137271855406
Energy: 1.2051226130057375
Energy: 1.176486373909988
Energy: 1.2051226130075334
Energy: 1.1729620464075445
Energy: 1.2812387060559103
Energy: 1.1789793325143165
Energy: 1.2812387060559103
Energy: 1.1603872735248315
Energy: 1.1607120843273966
Energy: 1.158318846161119
Energy: 1.1607120843256007
Energy: 1.1734114661291384
Energy: 1.393508115056392
Energy: 1.1756420744584892
Energy: 1.393508115056392
Energy: 1.162844301137489
Energy: 1.3929434380747099
Energy: 1.1765009748646427
Energy: 1.3929434380765058
Energy: 1.1732650710799397
Energy: 1.2815954528071032
Energy: 1.1707863646533363
Energy: 1.2815954528071032
Energy: 1.2054619241441968
Energy: 1.2800909891287668
Energy: 1.1609592201934495
Energy: 1.2800909891233792
Energy: 1.158532516316185
Energy: 1.2065943065877474
Energy: 1.1732509567690164
Energy: 1.2065943065877474
Energy: 1.158982667382011
Energy: 1.3935501483600037
Energy: 1.1756435443596749
Energy: 1.3935501483582078
Energy: 1.174210392182319
Energy: 1.1639138625645948
Energy: 1.1506163790386665
Energy: 1.1639138625645948
Energy: 1.1602855203986595
Energy: 1.2810068411053868
Energy: 1.1609375848065655
Energy: 1.2810068411053868
Energy: 1.1595648624339967
Energy: 1.163909127926856
Energy: 1.1600662712745757
Energy: 1.1639091279250602

minimum gb energy = 1.1483137271855406 eV
minimum distance =  2.21534443476473 Angstroms
sigma value = 13


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

Energy: 1.14876259466446
Energy: 1.1030168812132406
Energy: 1.674153614201777
Energy: 1.1030168812117354
Energy: 1.13751577210103
Energy: 1.13537729410361
Energy: 1.0933024300829541
Energy: 1.1353772940156097
Energy: 1.1050574831139417
Energy: 1.1035862027909795
Energy: 1.3283615841293646
Energy: 1.1035862028030232
Energy: 1.108617144582509
Energy: 1.1378193696438315
Energy: 1.0874235078223309
Energy: 1.1377549929480593
Energy: 1.116595821143184
Energy: 1.1949501189913319
Energy: 1.1096629523624153
Energy: 1.1949501189845573
Energy: 1.0864231816069814
Energy: 1.1356687181172955
Energy: 1.1183861248674831
Energy: 1.1356687181203065
Energy: 1.1166557979208032
Energy: 1.1984557579781778
Energy: 1.3142623677311664
Energy: 1.1984557579608652
Energy: 1.0763193488057314
Energy: 1.1348879346071017
Energy: 1.1185290536019488
Energy: 1.1348879346251672
Energy: 1.1152709996805124
Energy: 1.1986853271143179
Energy: 1.4166186475482387
Energy: 1.1986853271241031
Energy: 1.3413069463023706
Energy: 1.222186633000029
Energy: 1.0877571156440244
Energy: 1.2221866328337452
Energy: 1.116459769799157
Energy: 1.222967832899498
Energy: 1.0928551115475211
Energy: 1.2229678329010036
Energy: 1.1268840842842087
Energy: 1.2228335522530138
Energy: 1.0870215569085702
Energy: 1.2228335522537666
Energy: 1.158765205359445
Energy: 1.1245870958175845
Energy: 1.0928267010099317
Energy: 1.1245870958115627
Energy: 1.5631174472385154
Energy: 1.2222956239139784
Energy: 1.08689487296665
Energy: 1.2222956239177418
Energy: 1.1106268259778276
Energy: 1.103594002879683
Energy: 1.0913160269790732
Energy: 1.1035940028857048
Energy: 1.1175387898896325
Energy: 1.2229124607868094
Energy: 1.09248478403208
Energy: 1.2229124607965949
Energy: 1.1166074399757118
Energy: 1.1027550093942629
Energy: 1.0919150056903
Energy: 1.102755009388241
Energy: 1.1079612446689509
Energy: 1.1946301305973084
Energy: 1.1148683477975079
Energy: 1.1946301305897813
Energy: 1.1166309212021848
Energy: 1.1957040379285357
Energy: 1.1150720687160565
Energy: 1.195704037917245
Energy: 1.1166778678548723
Energy: 1.195554991219352
Energy: 1.1150866678840872
Energy: 1.1955549912216104
Energy: 1.1080096745718755
Energy: 1.1947067768141488
Energy: 1.1151038386101808
Energy: 1.194706776811138
Energy: 1.1169732053995631
Energy: 1.1025470675010411
Energy: 1.0916556192362097
Energy: 1.1025470675055575
Energy: 1.1175038992805078
Energy: 1.223208096622366
Energy: 1.0925280038416942
Energy: 1.2232080966306456
Energy: 1.1106262527157404
Energy: 1.1035387267435495
Energy: 1.093110463395783
Energy: 1.1035387267533348
Energy: 1.5632270330255096
Energy: 1.2226274183932793
Energy: 1.0869216351607425
Energy: 1.222627418394032
Energy: 1.1545456747219676
Energy: 1.124675890388153
Energy: 1.0928346534735005
Energy: 1.1246758903926695
Energy: 1.1268571945973496
Energy: 1.2227008221815054
Energy: 1.0871798701301285
Energy: 1.2227008222010762
Energy: 1.1164819734205829
Energy: 1.2230929464876183
Energy: 1.0928819496301112
Energy: 1.2230929464861129
Energy: 1.3413387323150197
Energy: 1.22214849020067
Energy: 1.0877762490501277
Energy: 1.2221484904549542
Energy: 1.1164404778114863
Energy: 1.198441088853538
Energy: 1.4958854119146323
Energy: 1.1984410888573016
Energy: 1.0765261789495402
Energy: 1.1348644420789322
Energy: 1.118449948819648
Energy: 1.1348644420842013
Energy: 1.1163190793306252
Energy: 1.1983497817928606
Energy: 1.313797926075088
Energy: 1.1983497818086677
Energy: 1.0865697757179715
Energy: 1.1355017371326708
Energy: 1.1186031479839171
Energy: 1.1355017371334235
Energy: 1.1165821915293566
Energy: 1.1946487824302867
Energy: 1.1064905411991925
Energy: 1.1946487824220753
Energy: 1.1082408331406042
Energy: 1.1380489258967985
Energy: 1.0876476507821293
Energy: 1.1380492206611448

minimum gb energy = 1.0763193488057314 eV
minimum distance =  2.2300735651843 Angstroms
sigma value = 37


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

Energy: 1.0528792184446079
Energy: 1.051366757872352
Energy: 1.63484240988593
Energy: 1.051366757871057
Energy: 1.0321209425647082
Energy: 1.0512769263864354
Energy: 0.9987996409010539
Energy: 1.0512769263864354
Energy: 0.9895813559530037
Energy: 1.1994728563269423
Energy: 1.4353295981309369
Energy: 1.1994728563256474
Energy: 0.9901211297545959
Energy: 1.0513886115667204
Energy: 0.9985888078603581
Energy: 1.0513886115667204
Energy: 0.9976148986103299
Energy: 1.0508531611906073
Energy: 1.0195740703599847
Energy: 1.0508531611906073
Energy: 0.9858770728034281
Energy: 1.051272424208519
Energy: 0.9927002243161679
Energy: 1.051272424208519
Energy: 0.9996818115843712
Energy: 1.1070092349950031
Energy: 1.3630140895008667
Energy: 1.1070092349950031
Energy: 0.9903060005459656
Energy: 1.0524826592856156
Energy: 1.055504558334971
Energy: 1.0524826592856156
Energy: 0.9976751121146176
Energy: 1.051673895749113
Energy: 1.2127305924434002
Energy: 1.051673895750408
Energy: 1.4180390266781717
Energy: 1.5036236324176895
Energy: 0.9928278442734915
Energy: 1.5036236324163943
Energy: 0.9993713145574967
Energy: 1.1074102878065286
Energy: 0.9906647900446566
Energy: 1.1074102878078236
Energy: 1.437118045638304
Energy: 1.0517165244979598
Energy: 0.9986496794516119
Energy: 1.0517165244992548
Energy: 0.989442678487962
Energy: 1.051694835747979
Energy: 0.9978174049093619
Energy: 1.051694835747979
Energy: 1.3754117816758364
Energy: 1.1067504832457749
Energy: 0.9899146997048451
Energy: 1.1067504832509552
Energy: 1.0511407020740944
Energy: 1.1077330961723877
Energy: 0.9906488010192939
Energy: 1.1077330961710927
Energy: 1.0519928285258682
Energy: 1.0520037306501122
Energy: 0.9990000656526357
Energy: 1.0520037306514072
Energy: 0.9896097467136329
Energy: 1.1846715517814386
Energy: 0.9858168140071533
Energy: 1.1846715517801436
Energy: 0.9984311243451954
Energy: 1.106866611892274
Energy: 0.9990637447584659
Energy: 1.106866611892274
Energy: 0.9972512878032413
Energy: 1.054268804908449
Energy: 0.9902757917868902
Energy: 1.054268804908449
Energy: 0.9900126426931419
Energy: 1.0518969336656794
Energy: 0.9895862548061957
Energy: 1.0518969336643844

minimum gb energy = 0.9858168140071533 eV
minimum distance =  2.24160183064667 Angstroms
sigma value = 25


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

Energy: 0.9689324091033904
Energy: 0.9103474536405551
Energy: 1.5529232050288644
Energy: 0.910347453639544
Energy: 1.2144924186878399
Energy: 0.934355306327331
Energy: 0.9114058262641002
Energy: 0.9343553063283423
Energy: 0.9068255843173834
Energy: 0.906444545221018
Energy: 1.246272801437375
Energy: 0.9064445452200068
Energy: 0.912998850980132
Energy: 1.2618096880284242
Energy: 0.9143381250397289
Energy: 1.261809078730757
Energy: 0.9128938058520121
Energy: 0.9347545466329413
Energy: 0.9099277735277483
Energy: 0.9347545466339526
Energy: 0.8784696554245841
Energy: 1.2494379025459617
Energy: 0.9141619756710481
Energy: 1.249437053160708
Energy: 0.9141650683399025
Energy: 0.9064660366662397
Energy: 0.9134279873062873
Energy: 0.9064660366642171
Energy: 0.8777055062910465
Energy: 0.9676536543057191
Energy: 0.9084892641628529
Energy: 0.9676536543067306
Energy: 0.9130252587181058
Energy: 0.9346075673896787
Energy: 1.484170670063029
Energy: 0.9346075673886672
Energy: 0.878809604723478
Energy: 1.263032665560108
Energy: 0.9702199887917488
Energy: 1.2630326657319755
Energy: 0.9140847799233965
Energy: 0.9066612866795037
Energy: 1.4820009987355043
Energy: 0.9066612866795037
Energy: 1.2144039146331294
Energy: 1.2383680153551302
Energy: 0.9085360609129196
Energy: 1.2383680156219636
Energy: 0.9130324688098584
Energy: 0.9347048109787741
Energy: 1.461474124905777
Energy: 0.9347048109797855
Energy: 1.2248537675931321
Energy: 0.9075849869361441
Energy: 0.9142355784432995
Energy: 0.9075849870453135
Energy: 0.9139088717087623
Energy: 0.9066086416519474
Energy: 0.8783891933688098
Energy: 0.9066086416519474
Energy: 1.2237923366449255
Energy: 1.3345070287991507
Energy: 0.9122374248558649
Energy: 1.3345070286475083
Energy: 0.9131576740503198
Energy: 0.9673446369669502
Energy: 0.8831898052234067
Energy: 0.967344636965939
Energy: 1.216796469377002
Energy: 0.9339677084044643
Energy: 0.9142738263427671
Energy: 0.933967708387273
Energy: 0.9743415880564996
Energy: 0.9063111599891791
Energy: 0.8789129954903953
Energy: 0.9063111599891791
Energy: 1.479523913539332
Energy: 1.3346129524516503
Energy: 0.9121233747210236
Energy: 1.3346129524869983
Energy: 0.9129639412425844
Energy: 0.9673369381343283
Energy: 0.8832737058276389
Energy: 0.9673369381353396
Energy: 0.9071793672120041
Energy: 0.9348765585343073
Energy: 0.914354054662785
Energy: 0.9348765585353187
Energy: 0.9141578170224136
Energy: 0.9067096739407827
Energy: 1.2246129848132894
Energy: 0.906709673941794
Energy: 0.8789124013002785
Energy: 1.0760926237177473
Energy: 0.912216090631407
Energy: 1.0760926237157245
Energy: 0.9120544208099274
Energy: 1.0739590905238194
Energy: 1.2251393649276656
Energy: 1.0739590905248306
Energy: 0.8785312974830024
Energy: 0.9677911852033805
Energy: 0.9150723318279163
Energy: 0.9677911852033805

minimum gb energy = 0.8777055062910465 eV
minimum distance =  2.24506944306123 Angstroms
sigma value = 41


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

Energy: 1.3008619973569102
Energy: 0.8466640265390798
Energy: 1.4967107392642416
Energy: 0.8466640265349346
Energy: 1.3297671632176074
Energy: 0.8264418531619949
Energy: 0.8153723418016282
Energy: 0.8264418531595077
Energy: 0.8452724957018136
Energy: 0.8127700451484021
Energy: 1.1036958472912595
Energy: 0.812770045145086
Energy: 1.0777524021007492
Energy: 1.1117587397472761
Energy: 0.8154175781624406
Energy: 1.1117584856593732
Energy: 0.810529090718491
Energy: 1.094336732695843
Energy: 0.8272913466518291
Energy: 1.0943367326734583
Energy: 0.82724149423442
Energy: 0.8275275673540914
Energy: 0.8153416486658536
Energy: 0.8275275673449717
Energy: 0.8143374414002059
Energy: 0.8267486838897062
Energy: 0.8276221075806758
Energy: 0.8267486838855609
Energy: 0.7960395999940788
Energy: 0.8456762484453708
Energy: 0.8116386807087452
Energy: 0.8456762484461998
Energy: 0.8180126743282927
Energy: 0.8469711641301455
Energy: 1.1989396809744075
Energy: 0.8469711641301455
Energy: 0.7968308639054583
Energy: 0.8130938561436322
Energy: 0.8460538792257749
Energy: 0.8130938560905722
Energy: 0.8144518013220192
Energy: 0.826588491631068
Energy: 1.5106054152895367
Energy: 0.8265884916285807
Energy: 0.7961463390017427
Energy: 1.1102844004023211
Energy: 1.3016745871862014
Energy: 1.1102819154463925
Energy: 0.8181267036065809
Energy: 0.8498431794784639
Energy: 1.6052862626640716
Energy: 0.8498431794792929
Energy: 1.0721853135829682
Energy: 0.9442904899472273
Energy: 0.8459044216253635
Energy: 0.9442904899538598
Energy: 0.8145579038305677
Energy: 0.8267311244862577
Energy: 1.2985210602391055
Energy: 0.8267311244870867
Energy: 1.0819494729900587
Energy: 1.0723509669606826
Energy: 0.8115558787248792
Energy: 1.0723509669590245
Energy: 0.8180217095457554
Energy: 0.848117315977322
Energy: 1.1872257403381907
Energy: 0.8481173159748348
Energy: 1.0777856821968483
Energy: 0.9441347249484225
Energy: 0.8152317894021972
Energy: 0.9441347249732944
Energy: 0.8143128694118885
Energy: 0.845319106487471
Energy: 0.7958873202350424
Energy: 0.845319106486642
Energy: 1.0962831598795566
Energy: 1.0729472314501838
Energy: 0.8219304926323401
Energy: 1.0729465634481736
Energy: 0.8486566087130843
Energy: 0.8475771993703133
Energy: 0.8007302540937961
Energy: 0.8475771993761168
Energy: 1.5040867153449533
Energy: 0.87133274839778
Energy: 0.8154751974196015
Energy: 0.8713327483903185
Energy: 1.3043049190075728
Energy: 0.8451989686172094
Energy: 0.7960502620709868
Energy: 0.8451989685053612
Energy: 1.309485604807365
Energy: 1.4382278782711577
Energy: 0.8209876763013453
Energy: 1.4382278782703288
Energy: 0.8485633372178439
Energy: 0.9347970179129936
Energy: 0.7974602845734668
Energy: 0.93479701791631
Energy: 1.2932649196598778
Energy: 1.508678580969658
Energy: 0.8152741297594223
Energy: 1.5086785809729741
Energy: 0.8145233200174861
Energy: 0.8445220247802271
Energy: 1.0815240904789556
Energy: 0.8445220247868597
Energy: 0.8249896914820917
Energy: 0.8477010621662875
Energy: 0.8179207827704139
Energy: 0.8477010621704328
Energy: 0.8179697707650597
Energy: 0.9349121185905063
Energy: 1.0843426810386427
Energy: 0.9349121185888482
Energy: 0.7959409002689266
Energy: 0.8991166536023723
Energy: 0.8189115645268448
Energy: 0.8991166536048594
Energy: 0.8217265330548752
Energy: 0.8449310962283402
Energy: 1.0962802122789184
Energy: 0.8449310962283402
Energy: 0.7961146611275912
Energy: 0.8469623985468777
Energy: 0.8527700826235531
Energy: 0.8469623985443906

minimum gb energy = 0.7958873202350424 eV
minimum distance =  2.22817982702814 Angstroms
sigma value = 15


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

Energy: 1.1756495617809142
Energy: 0.7669709940991362
Energy: 1.454947932232748
Energy: 0.7669709941026478
Energy: 1.3596743541917988
Energy: 0.7626588220418254
Energy: 0.7640759168236259
Energy: 0.762658822041123
Energy: 0.793491329410231
Energy: 0.7623280074289855
Energy: 0.7472209033157525
Energy: 0.7623280074282832
Energy: 1.1891730311325164
Energy: 0.7642013294265377
Energy: 0.7639202135169078
Energy: 0.7642013294258354
Energy: 0.7610492329374131
Energy: 0.7669385449342767
Energy: 0.7627848144822148
Energy: 0.7669385449377883
Energy: 1.1648197003167673
Energy: 0.7635700027884587
Energy: 0.7640605057314056
Energy: 0.7635700027940775
Energy: 0.7633984503101141
Energy: 1.0607495513416745
Energy: 0.7613982128234356
Energy: 1.0607495512321106
Energy: 0.7627574421297837
Energy: 0.7773607921905391
Energy: 0.763973014136705
Energy: 0.7773607921961577
Energy: 0.7656251736221857
Energy: 0.7789616723853836
Energy: 1.080473244767959
Energy: 0.778961672383979
Energy: 0.7322838909555105
Energy: 0.7628781640120237
Energy: 0.7616227655643423
Energy: 0.7628781640085122
Energy: 0.7633925377434553
Energy: 0.7636322445645728
Energy: 1.1921415037584138
Energy: 0.7636322445659774
Energy: 0.7335112164416256
Energy: 0.7624161860434433
Energy: 0.7941400787331451
Energy: 0.7624161860504667
Energy: 0.7659364382145587
Energy: 0.7791181360385574
Energy: 1.5221809002680882
Energy: 0.7791181360434737
Energy: 0.7322076190036804
Energy: 0.7670461688915052
Energy: 1.1761692217187945
Energy: 0.7670461688893982
Energy: 0.7634762394330386
Energy: 0.7630260372147603
Energy: 1.5224040412409154
Energy: 0.7630260372161649
Energy: 0.9664879569325929
Energy: 0.762568791336758
Energy: 0.7941864806941135
Energy: 0.7625687913381626
Energy: 0.7660197962212337
Energy: 0.7780095167454868
Energy: 1.4336343157658147
Energy: 0.7780095167398682
Energy: 0.9751302316284679
Energy: 0.7703471131144564
Energy: 0.7616048629707411
Energy: 0.7703471131193727
Energy: 0.763477051988187
Energy: 0.7616552711436564
Energy: 1.1631737086697653
Energy: 0.7616552711443586
Energy: 0.9860037224935226
Energy: 0.7636401851744018
Energy: 0.7639202396609361
Energy: 0.7636401851772112
Energy: 0.7657522911012102
Energy: 0.7942736157567869
Energy: 1.0748345264415298
Energy: 0.7942736157588938
Energy: 0.980662479522868
Energy: 0.7796190307630264
Energy: 0.7687436943189472
Energy: 0.7796190307609833
Energy: 0.7634605918369335
Energy: 0.7617496622766585
Energy: 0.732011423933364
Energy: 0.7617496622717423
Energy: 1.4005258703157728
Energy: 0.763764948747453
Energy: 0.764067721954997
Energy: 0.763764948747453
Energy: 0.7957990927517452
Energy: 0.7943298167188875
Energy: 0.7413646382426581
Energy: 0.7943298167146733
Energy: 1.3611440929475882
Energy: 0.7795510523088378
Energy: 0.7687175586303258
Energy: 0.7795510523039215
Energy: 1.1778805292121421
Energy: 0.7622817975648518
Energy: 0.732039102116336
Energy: 0.7622817975620425
Energy: 1.5213433100968685
Energy: 1.2888264823418187
Energy: 0.7643669052991134
Energy: 1.288826482329177
Energy: 0.7960770972253658
Energy: 0.8678736910782024
Energy: 0.7414511611424008
Energy: 0.8678736910796073
Energy: 1.1549474340839703
Energy: 0.7772107049568184
Energy: 0.7687316680684122
Energy: 0.7772107049540089
Energy: 0.7635880512346692
Energy: 0.7618519972915956
Energy: 0.9747434475064244
Energy: 0.7618519972915956
Energy: 1.1725855218553853
Energy: 0.7610098636727497
Energy: 0.7639570055817039
Energy: 0.7610098636678335
Energy: 0.7658942115985073
Energy: 0.8710747238509221
Energy: 0.9867492683269109
Energy: 0.8710747238438987
Energy: 0.7412955633928275
Energy: 0.7939224823772489
Energy: 0.768711864367676
Energy: 0.7939224823828678
Energy: 0.7451540283032276
Energy: 0.8413977801687328
Energy: 0.9831231005512282
Energy: 0.8413977801722444
Energy: 0.7319079957028854
Energy: 0.7613395770044551
Energy: 0.7664012091872844
Energy: 0.7613395770051575
Energy: 0.7661135311089889
Energy: 0.8700191033167823
Energy: 1.397372651414036
Energy: 0.8700191033153777

minimum gb energy = 0.7319079957028854 eV
minimum distance =  2.23123858598185 Angstroms
sigma value = 85


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

Energy: 1.1006273971804763
Energy: 0.7439422968486314
Energy: 1.398348257802555
Energy: 0.7439422968486314
Energy: 1.3834792617174758
Energy: 0.7395536375210667
Energy: 0.6989780716217889
Energy: 0.7395536375210667
Energy: 1.05607929186929
Energy: 0.7392166151929048
Energy: 0.661653351660913
Energy: 0.7392166151953414
Energy: 1.3464065432003876
Energy: 0.7395196106570371
Energy: 0.699152141990561
Energy: 0.7395196106588644
Energy: 0.7388266911458671
Energy: 0.6970393019237078
Energy: 0.7008213190211757
Energy: 0.6970393019230986
Energy: 1.1847685905706682
Energy: 0.7399999654285757
Energy: 0.699080463578509
Energy: 0.7399999654285757
Energy: 0.6962687218037409
Energy: 0.9197360007756955
Energy: 0.7054920353817302
Energy: 0.9197360007763046
Energy: 1.0200138338587135
Energy: 0.7383265683862165
Energy: 0.6991830238941081
Energy: 0.7383265683880161
Energy: 0.6984099784662815
Energy: 0.8765384939122033
Energy: 0.9843080030322849
Energy: 0.876538494026056
Energy: 0.8474860602500544
Energy: 0.7647166808282337
Energy: 0.6968217585941533
Energy: 0.7647166808282337
Energy: 0.6995126034995911
Energy: 0.7394910571971989
Energy: 1.0827104846002817
Energy: 0.739491057197808
Energy: 0.6582345696714382
Energy: 0.7383698694164861
Energy: 0.73938529590437
Energy: 0.7383698694170951
Energy: 0.6985920242695105
Energy: 0.7154981548074693
Energy: 1.2992900404141488
Energy: 0.7154981548074693
Energy: 0.6595970526809783
Energy: 0.7395794055712076
Energy: 1.0567003319628159
Energy: 0.7395794055693802
Energy: 0.699729604054656
Energy: 0.7393433639796585
Energy: 1.5060316613234108
Energy: 0.7393433639833132
Energy: 0.6584330058175188
Energy: 0.7440742672979367
Energy: 1.1008577860384388
Energy: 0.7440742672967184
Energy: 0.6987013780855424
Energy: 0.7154827236742689
Energy: 1.5783809947694605
Energy: 0.7154827236736597
Energy: 0.8658602508327551
Energy: 0.7394444769268821
Energy: 1.056710412104615
Energy: 0.7394444769274913
Energy: 0.6998916524022235
Energy: 0.7394498075176705
Energy: 1.347582750536303
Energy: 0.739449807515843
Energy: 0.8701330810083949
Energy: 0.7439618773723264
Energy: 0.7392766846786686
Energy: 0.7439618773784177
Energy: 0.6985518853087944
Energy: 0.7156174520125933
Energy: 1.2640302852578371
Energy: 0.7156174520138116
Energy: 0.8663605338078185
Energy: 0.739635195303787
Energy: 0.6969414353201838
Energy: 0.7396351953050052
Energy: 0.6993192907624127
Energy: 0.7381122785374545
Energy: 1.0218384947415962
Energy: 0.7381122785374545
Energy: 0.8773144123274327
Energy: 0.7673288498010977
Energy: 0.6991023176616303
Energy: 0.7673288498053616
Energy: 0.6985294119888025
Energy: 0.7378615326602262
Energy: 0.944743356252065
Energy: 0.7378615326583988
Energy: 1.2364754542327476
Energy: 0.7395019521741442
Energy: 0.7000235000953532
Energy: 0.7395019521820629
Energy: 0.740789260645353
Energy: 0.7381209633072808
Energy: 0.658065932616768
Energy: 0.7381209633048443
Energy: 1.2485500204636903
Energy: 0.7675360768627415
Energy: 0.6992654073680011
Energy: 0.7675360768633507
Energy: 1.0583230851899945
Energy: 0.8964519070472757
Energy: 0.6598258621986245
Energy: 0.8964519070460575
Energy: 1.5062224817581493
Energy: 0.7395326725745955
Energy: 0.6999968532251447
Energy: 0.7395326725709406
Energy: 1.1020456078979532
Energy: 0.7378065344986929
Energy: 0.6582016944102346
Energy: 0.7378065344980838
Energy: 1.3731869035897613
Energy: 0.7675447083673096
Energy: 0.6991979974755544
Energy: 0.7675447083660913
Energy: 1.0583636610181333
Energy: 0.8962165230272994
Energy: 0.6602179727825819
Energy: 0.8962165230151168
Energy: 1.3469462803153966
Energy: 0.7396132703525221
Energy: 0.6999884897572343
Energy: 0.739613270351913
Energy: 0.7407543658550758
Energy: 0.7379027810928005
Energy: 0.8690545144549281
Energy: 0.7379027810946279
Energy: 1.027421097844613
Energy: 0.7643169638942271
Energy: 0.6992707372409519
Energy: 0.7643169638954455
Energy: 0.6987478497436251
Energy: 0.8963202004553826
Energy: 0.8661533876349995
Energy: 0.8963202004547736
Energy: 1.0306701763320172
Energy: 0.7380178795894201
Energy: 0.7001528885296904
Energy: 0.7380178795827474
Energy: 0.7000215598348891
Energy: 0.7379087134819851
Energy: 0.877108395725702
Energy: 0.7379087134825942
Energy: 0.6690699724619166
Energy: 0.793130313199289
Energy: 0.6988114141060008
Energy: 0.7931303132011165
Energy: 0.6980086454153399
Energy: 0.8962330808528731
Energy: 1.2345909747174013
Energy: 0.8962330808528731
Energy: 0.658080362886108
Energy: 0.7380350874811133
Energy: 0.7420912440470985
Energy: 0.7380350874811133
Energy: 0.6990585820940445
Energy: 0.7382239246123516
Energy: 1.2475802965311364
Energy: 0.7382239246129608

minimum gb energy = 0.658065932616768 eV
minimum distance =  2.24770141073472 Angstroms
sigma value = 113


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

Energy: 0.02025632788965611
Energy: 0.021029029286157404
Energy: 1.207409493551623
Energy: 0.021029029288446733
Energy: 0.8979468184120736
Energy: 0.4362786444693323
Energy: 0.4376755150514765
Energy: 0.4362786444698005
Energy: 0.020256327890124385
Energy: 0.021029029285689133
Energy: 2.0498104813937097
Energy: 0.02102902928886297
Energy: 0.8979468184116053
Energy: 0.4362786444693323
Energy: 0.43767551505100816
Energy: 0.43627864447021675
Energy: 0.02025632788965611
Energy: 0.021029029285689133
Energy: 2.4270830227952387
Energy: 0.021029029288446733
Energy: 0.8979468184116053
Energy: 0.4362786444693323
Energy: 0.4376755150514765
Energy: 0.4362786444693323

minimum gb energy = 0.02025632788965611 eV
minimum distance =  2.48313029023438 Angstroms
sigma value = 1