Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_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=4.089642539620402
cohesive_energy=2.8502237652528515
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=[8.78438200536252e-20, 1.387832637373578e-19, 1.7995007082434398e-19, 2.1466763630649e-19, 2.45753067359358e-19, 2.74198111319394e-19, 2.99905035411924e-19, 3.22771300332372e-19, 3.4296673680394193e-19, 3.6076211267778e-19, 3.7642338927513e-19, 3.90176473501386e-19, 4.0221362655262796e-19, 4.1270307697542594e-19, 4.21790622843474e-19, 4.29609244817394e-19, 4.362759017914679e-19, 4.41886724363736e-19, 4.46520219189264e-19, 4.502340646268759e-19, 4.53068315092422e-19, 4.550598206484839e-19, 4.562342161212059e-19, 4.5662034069e-19, 4.562037747651599e-19, 4.54859548569234e-19, 4.52443466205162e-19, 4.4877768606657e-19, 4.435113314706119e-19, 4.36309547500782e-19, 4.26794220471456e-19, 4.1452955833818596e-19, 3.9899004716502e-19, 3.7954603153479592e-19, 3.5541725142675597e-19, 3.2562157256425796e-19, 2.88893275406442e-19, 2.43559687547412e-19, 1.87380966052836e-19, 1.173568749578856e-19, 2.94713983117764e-20, -8.16592580287218e-20, -2.23381875018816e-19, -4.06070065710666e-19, -6.449241604840199e-19, -9.62582915177298e-19, -1.3925991128597279e-18, -1.98612224257176e-18, -2.82643184357208e-18, -4.05696758554944e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.008588670158055433
Energy: 0.06598166496514199
Energy: 0.4229514466066095
Energy: 0.00948931925120327
Energy: 0.06598166496563206
Energy: 0.4386773783606072
Energy: 0.00948931925120327
Energy: 0.43867737835965437
Energy: 0.42295144660708595
Energy: 0.00948931925120327
Energy: 0.008588670158055433
Energy: 0.06598166496563206
Energy: 0.00948931925120327
Energy: 0.4386773783586878
Energy: 0.06598166496514199
Energy: 0.43867737835965437

minimum gb energy = 0.008588670158055433 eV
minimum distance =  2.82051131657769 Angstroms
sigma value = 1


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

Energy: 0.8206252284115757
Energy: 0.5799301619772517
Energy: 0.5811165372039115
Energy: 0.5370689532793042
Energy: 0.5514822704896959
Energy: 0.5872658139941668
Energy: 0.5449137023519923
Energy: 0.5872658139929782
Energy: 0.5806538644413194
Energy: 0.5802580693686434
Energy: 0.8911902560364308
Energy: 0.580258069369832
Energy: 0.5472056325815436
Energy: 0.545406937387461
Energy: 0.5448601528854973
Energy: 0.545406937387461
Energy: 0.7633889038053953
Energy: 0.5463459977445884
Energy: 0.5472629905344684
Energy: 0.5463459977445884
Energy: 0.5719444080191526
Energy: 0.6019857362093213
Energy: 0.546140599428339
Energy: 0.6019857362093213
Energy: 0.5727549708845336
Energy: 0.5812805221120337
Energy: 0.5713204055459237
Energy: 0.5812805221114394
Energy: 0.5738897432505157
Energy: 0.5889462204178113
Energy: 0.5963164418525377
Energy: 0.5889462204279156
Energy: 0.582651895985738
Energy: 0.5969367691298187
Energy: 0.5834214081655
Energy: 0.5969367691304132
Energy: 0.5944710626622818
Energy: 0.5975919234352023
Energy: 0.5837026393350595
Energy: 0.597591923434608
Energy: 0.5816198079986871
Energy: 0.5967068881505292
Energy: 0.5828581497059028
Energy: 0.5967068881505292
Energy: 0.572716775853238
Energy: 0.5957154518997957
Energy: 0.5988935706339648
Energy: 0.5957154518997957
Energy: 0.5847733441325234
Energy: 0.5811268477063133
Energy: 0.5559737808034527
Energy: 0.5811268477069076
Energy: 0.5730718283056185
Energy: 0.5822260922125202
Energy: 0.5755484509172766
Energy: 0.5822260922137088
Energy: 0.556296516229672
Energy: 0.5458940447730116
Energy: 0.5456133721423081
Energy: 0.5458940447718228
Energy: 0.5591342716608105
Energy: 0.5461591946413037
Energy: 0.5459348821694534
Energy: 0.5461591946413037
Energy: 0.5808219134909737
Energy: 0.5799197806067894
Energy: 0.5345674399382317
Energy: 0.5799197806073838
Energy: 0.5448986243508852
Energy: 0.5459532208331606
Energy: 0.5553944377311326
Energy: 0.5459532208331606
Energy: 0.5463816218501367
Energy: 0.5803636794391834
Energy: 0.5808886700246761
Energy: 0.5803636794379947
Energy: 0.5715590486881839
Energy: 0.5460212909507002
Energy: 0.5469642426047707
Energy: 0.5460212909512946
Energy: 0.5466585257607572
Energy: 0.5468573823988353
Energy: 0.5714086977565448
Energy: 0.5468573823976466
Energy: 0.5460722397882002
Energy: 0.546341035939659
Energy: 0.5718597886415623
Energy: 0.5463410359402533
Energy: 0.5712978262738454
Energy: 0.5818792119407313
Energy: 0.5717453828822288
Energy: 0.5818792119401369
Energy: 0.5897480936517774
Energy: 0.5818606922048164
Energy: 0.5723548077077075
Energy: 0.5818606922048164
Energy: 0.5841272900363543
Energy: 0.5972146524168981
Energy: 0.6588998043556233
Energy: 0.5972146524168981
Energy: 0.5849472684355509
Energy: 0.5952738871045999
Energy: 0.5952739371818108
Energy: 0.5952738871051942
Energy: 0.6598317364760435
Energy: 0.5964765647548327
Energy: 0.5820305718533603
Energy: 0.5964765647548327
Energy: 0.5971288706068153
Energy: 0.5959714937233946
Energy: 0.5727894917608153
Energy: 0.5959714937233946
Energy: 0.5556754567526787
Energy: 0.5809647882905854
Energy: 0.5850886526949801
Energy: 0.5809647882899911
Energy: 0.5755722416231654
Energy: 0.5819110778552977
Energy: 0.5729237396603901
Energy: 0.5819110778552977
Energy: 0.545397115495694
Energy: 0.5458713293094261
Energy: 0.5564370251409964
Energy: 0.5458713293088316
Energy: 0.5460548778045472
Energy: 0.5459528056255966
Energy: 0.5591486325081433
Energy: 0.5459528056250023
Energy: 0.5345348163866428
Energy: 0.5470817148755532
Energy: 0.58183310233384
Energy: 0.547081714876742

minimum gb energy = 0.5345348163866428 eV
minimum distance =  2.58451633045219 Angstroms
sigma value = 1


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

Energy: 0.9347214600514836
Energy: 0.6104112947401392
Energy: 0.6097577086428352
Energy: 0.5619016910883765
Energy: 0.5808099260137831
Energy: 0.6152898468793576
Energy: 0.573224863230295
Energy: 0.6152898468800352
Energy: 0.61012746475857
Energy: 0.6109150765053007
Energy: 0.8587763844018007
Energy: 0.6109150765086891
Energy: 0.5747625545485721
Energy: 0.5729336922592655
Energy: 0.5728087696167158
Energy: 0.5729336922592655
Energy: 0.5735641042529582
Energy: 0.5731417287564717
Energy: 0.5731419173632428
Energy: 0.57314172875986
Energy: 0.6112245820500893
Energy: 0.6500368141721125
Energy: 0.5724580848807019
Energy: 0.6500368141734678
Energy: 0.6060085230284233
Energy: 0.6166507319018133
Energy: 0.6031699980462017
Energy: 0.6166507319038463
Energy: 0.6045017871345736
Energy: 0.6179269786035833
Energy: 0.6296188448884152
Energy: 0.6179269786035833
Energy: 0.6043448986653944
Energy: 0.6313647636103439
Energy: 0.6125144054449372
Energy: 0.6313647636076332
Energy: 0.6288562586889817
Energy: 0.6349480051625199
Energy: 0.6062487917854006
Energy: 0.6349480051625199
Energy: 0.5874320278122966
Energy: 0.6159212037439158
Energy: 0.6066871593685631
Energy: 0.6159212037439158
Energy: 0.5868528436020827
Energy: 0.6172340670523768
Energy: 0.6046543350744723
Energy: 0.617234067051699
Energy: 0.5734310294731656
Energy: 0.5733631954246979
Energy: 0.5875223875942989
Energy: 0.5733631954260531
Energy: 0.5724107765498565
Energy: 0.5728877584946366
Energy: 0.5588829117079367
Energy: 0.5728877584946366
Energy: 0.557976592383824
Energy: 0.6105266165972956
Energy: 0.6096428085145527
Energy: 0.6105266165959404
Energy: 0.5872707082759729
Energy: 0.5730710026858877
Energy: 0.5728030141249829
Energy: 0.5730710026845325
Energy: 0.6108398478650977
Energy: 0.6104413388438956
Energy: 0.573846695926528
Energy: 0.6104413388411849
Energy: 0.5747103426352763
Energy: 0.5727993670485984
Energy: 0.603440400090722
Energy: 0.5727993670499538
Energy: 0.573759869029949
Energy: 0.575322727465844
Energy: 0.5747752400060492
Energy: 0.5753227274671993
Energy: 0.6126296909439719
Energy: 0.5730539367573644
Energy: 0.5724170022755486
Energy: 0.5730539367614305
Energy: 0.6044185823538711
Energy: 0.6173272568732249
Energy: 0.6029287635066849
Energy: 0.6173272568711919
Energy: 0.6032728412129847
Energy: 0.617322078880252
Energy: 0.6294604253068624
Energy: 0.617322078878219
Energy: 0.60422536076524
Energy: 0.6314778810837766
Energy: 0.6124863505435997
Energy: 0.6314778810830989
Energy: 0.62879793660988
Energy: 0.6319344530062618
Energy: 0.6049150622937423
Energy: 0.6319344530076172
Energy: 0.5870952196771062
Energy: 0.6160829823802602
Energy: 0.6256405104334893
Energy: 0.6160829823789049
Energy: 0.5877313748324743
Energy: 0.61666786656844
Energy: 0.604097109443855
Energy: 0.6166678665670845
Energy: 0.5729271480486666
Energy: 0.5734309758275506
Energy: 0.5868894545675687
Energy: 0.5734309758255176
Energy: 0.5724630144233467
Energy: 0.5728166630165332
Energy: 0.5585857506165793
Energy: 0.5728166630172109
Energy: 0.5579114558284786
Energy: 0.5745468060341689
Energy: 0.6134491894107494
Energy: 0.5745468060328135

minimum gb energy = 0.5579114558284786 eV
minimum distance =  2.58513452981115 Angstroms
sigma value = 25


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

Energy: 0.8942360909958145
Energy: 0.643156896498909
Energy: 0.6431383076711693
Energy: 0.5861195449730564
Energy: 0.6157828848917525
Energy: 0.6445353704202518
Energy: 0.6039548080816359
Energy: 0.6445353704202518
Energy: 0.642839771586662
Energy: 0.643187481368781
Energy: 0.6024692778868768
Energy: 0.6431874813695688
Energy: 0.6055740569014968
Energy: 0.6039252802878484
Energy: 0.6038504672588042
Energy: 0.6039252802878484
Energy: 0.6037981543282901
Energy: 0.6041274970424383
Energy: 0.6042836457886482
Energy: 0.6041274970424383
Energy: 0.636248125272423
Energy: 0.6770532874417543
Energy: 0.6038925293429169
Energy: 0.6770532874417543
Energy: 0.6339137914445103
Energy: 0.6598563402377812
Energy: 0.6325536080360222
Energy: 0.6598563402377812
Energy: 0.6330171963800427
Energy: 0.6607593655741412
Energy: 0.6674110281797442
Energy: 0.660759365574929
Energy: 0.6339708278379581
Energy: 0.659545551199995
Energy: 0.624809795580635
Energy: 0.659545551199995
Energy: 0.6346024535385489
Energy: 0.6597904830124997
Energy: 0.6039593420309152
Energy: 0.6597904830124997
Energy: 0.5823265053518736
Energy: 0.6038030889664915
Energy: 0.6031117358590836
Energy: 0.6038030889657037
Energy: 0.5824281800825685
Energy: 0.6039165509698645
Energy: 0.6041252272310809
Energy: 0.6039165509698645
Energy: 0.6424138518118588
Energy: 0.6436766876631408
Energy: 0.5821955810067999
Energy: 0.6436766876639286
Energy: 0.603844276158118
Energy: 0.6038209206809693
Energy: 0.6249186997985503
Energy: 0.6038209206809693
Energy: 0.60395992291013
Energy: 0.6435347060681348
Energy: 0.6446707665361988
Energy: 0.6435347060689226
Energy: 0.6043328377331697
Energy: 0.604038756966463
Energy: 0.6053464146181708
Energy: 0.604038756966463
Energy: 0.6057513493168895
Energy: 0.6069235161583705
Energy: 0.6044438550788229
Energy: 0.6069235161583705
Energy: 0.6038903050857486
Energy: 0.6041884435980971
Energy: 0.6360651902056422
Energy: 0.6041884435973093
Energy: 0.6327006698279691
Energy: 0.6609691886016449
Energy: 0.6366770290019725
Energy: 0.6609691886016449
Energy: 0.6033011305529847
Energy: 0.6607052472153141
Energy: 0.6343051069019294
Energy: 0.6607052472153141
Energy: 0.6243176656034634
Energy: 0.6596327226847913
Energy: 0.6337682242572045
Energy: 0.6596327226847913
Energy: 0.6249835174845129
Energy: 0.6598785118671788
Energy: 0.6339050230646837
Energy: 0.6598785118671788
Energy: 0.602569716062896
Energy: 0.6040371576956082
Energy: 0.582160283938131
Energy: 0.6040371576963961
Energy: 0.6038889296659207
Energy: 0.6040877518774194
Energy: 0.5822251981388872
Energy: 0.6040877518774194
Energy: 0.5815858039232356
Energy: 0.6054382991578078
Energy: 0.6466794353444741
Energy: 0.6054382991578078

minimum gb energy = 0.5815858039232356 eV
minimum distance =  2.58378689191546 Angstroms
sigma value = 9


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

Energy: 0.8327267306574092
Energy: 0.6780317264360027
Energy: 0.6785237434482124
Energy: 0.6102596564176129
Energy: 0.6573163240968243
Energy: 0.6724536067423043
Energy: 0.6394472372743217
Energy: 0.6724536067413646
Energy: 0.6780908759098151
Energy: 0.6780655433710531
Energy: 0.676452803947721
Energy: 0.6780655433710531
Energy: 0.6370428152575807
Energy: 0.672892433977225
Energy: 0.639634535741806
Energy: 0.672892433977225
Energy: 0.6368397046998994
Energy: 0.6401426004104759
Energy: 0.6388360078472153
Energy: 0.6401426004114157
Energy: 0.6367921024433626
Energy: 0.6408508769405706
Energy: 0.6403206847920463
Energy: 0.6408508769396308
Energy: 0.6692745013794155
Energy: 0.7144009695638471
Energy: 0.6392985589735339
Energy: 0.7144009695657266
Energy: 0.6403092457824563
Energy: 0.7115035786748116
Energy: 0.6411812034664807
Energy: 0.7115035786738719
Energy: 0.6384812345571061
Energy: 0.6401884347138563
Energy: 0.6038648279290424
Energy: 0.6401884347138563
Energy: 0.6395001061026938
Energy: 0.6404578821998436
Energy: 0.6039343040224449
Energy: 0.6404578821979641
Energy: 0.6029359822022804
Energy: 0.6781444992865914
Energy: 0.6774247461704034
Energy: 0.678144499287531
Energy: 0.6657762151412876
Energy: 0.6401138642283282
Energy: 0.6394940257250976
Energy: 0.6401138642208101
Energy: 0.6780935815710661
Energy: 0.6782697854501475
Energy: 0.6765585042177292
Energy: 0.6782697854473283
Energy: 0.6354086970245162
Energy: 0.6725919302507247
Energy: 0.6337349431945217
Energy: 0.6725919302497851
Energy: 0.6368360198389902
Energy: 0.6371569283807225
Energy: 0.6401814139295602
Energy: 0.637156928375084
Energy: 0.635081594799947
Energy: 0.640458057737592
Energy: 0.6399444016575648
Energy: 0.640458057733833
Energy: 0.6659305436562657
Energy: 0.7150278648751589
Energy: 0.6390301107618807
Energy: 0.7150278648760987
Energy: 0.6645391519227608
Energy: 0.7132809570167321
Energy: 0.639624417045641
Energy: 0.7132809570176717
Energy: 0.6384685062916099
Energy: 0.6403717478426406
Energy: 0.6037465971514121
Energy: 0.6403717478417009
Energy: 0.6403195765793421
Energy: 0.6403364872839011
Energy: 0.6038139779917387
Energy: 0.6403364872829614
Energy: 0.6027991440610321
Energy: 0.6356711741078331
Energy: 0.6830788609798579
Energy: 0.6356711741087729

minimum gb energy = 0.6027991440610321 eV
minimum distance =  2.6098717612696 Angstroms
sigma value = 25


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

Energy: 0.7438323353013591
Energy: 0.7142204281109178
Energy: 0.7150269763159036
Energy: 0.6301167959858321
Energy: 0.7525290443774421
Energy: 0.6743862468467506
Energy: 0.6417079744262029
Energy: 0.6743862468455885
Energy: 0.7139176461991169
Energy: 0.7141831623014048
Energy: 0.7117932991811561
Energy: 0.7141831623014048
Energy: 0.7146037476292464
Energy: 0.6750094273029077
Energy: 0.641462300522025
Energy: 0.6750094273029077
Energy: 0.6393150006187757
Energy: 0.6422254387645546
Energy: 0.6418368500873808
Energy: 0.6422254387668791
Energy: 0.6253595540858383
Energy: 0.6426219891007453
Energy: 0.6403856753954645
Energy: 0.6426219890995831
Energy: 0.6225732757205443
Energy: 0.6419209463558655
Energy: 0.6419526767241204
Energy: 0.6419209463581899
Energy: 0.6227733644310868
Energy: 0.6760263211159122
Energy: 0.642099551483212
Energy: 0.67602632111475
Energy: 0.7135709744514995
Energy: 0.7140964022889663
Energy: 0.7969604852389129
Energy: 0.7140964022901284
Energy: 0.7287341228985121
Energy: 0.6421079152388306
Energy: 0.7109154359657464
Energy: 0.6421079153131846
Energy: 0.7115680987546985
Energy: 0.7143536827699869
Energy: 0.7145233069660275
Energy: 0.7143536827699869
Energy: 0.7119338171675295
Energy: 0.6756504662031978
Energy: 0.7146572569097449
Energy: 0.6756504662043601
Energy: 0.6409659757553744
Energy: 0.6255815692696995
Energy: 0.6392658755742078
Energy: 0.6255815692696995
Energy: 0.6421389383885169
Energy: 0.6429872293862291
Energy: 0.6267462307117733
Energy: 0.6429872279724718
Energy: 0.6419159362572364
Energy: 0.6415797676633296
Energy: 0.622705641156128
Energy: 0.6415797676726007
Energy: 0.6411374578072622
Energy: 0.6418021882812998
Energy: 0.6228085306393406
Energy: 0.6418021882812998
Energy: 0.7980085116782348
Energy: 0.6263935424565178
Energy: 0.7209438599029806
Energy: 0.6263935424565178

minimum gb energy = 0.6225732757205443 eV
minimum distance =  2.65346925343285 Angstroms
sigma value = 17


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

Energy: 1.0244914825686702
Energy: 0.7882442190607665
Energy: 0.7872642481212379
Energy: 0.7364729628731007
Energy: 0.6592715635128423
Energy: 0.6898814979357164
Energy: 0.6878169038638282
Energy: 0.6898814979350583
Energy: 0.687489392140109
Energy: 0.6864638068838163
Energy: 0.7312098141876667
Energy: 0.6864638068831581
Energy: 0.6874482278722112
Energy: 0.6895611234312817
Energy: 0.6872116019317718
Energy: 0.6895611234306235
Energy: 0.6866810377505673
Energy: 0.7143970409608758
Energy: 0.6412940330767476
Energy: 0.7143970409595592
Energy: 0.688379590263099
Energy: 0.6811983663734595
Energy: 0.6864022692476773
Energy: 0.6811983663728014
Energy: 0.7291445504731924
Energy: 0.6862938156900918
Energy: 0.6857410361756209
Energy: 0.6862938156900918
Energy: 0.7923007717577413
Energy: 0.6881172776146285
Energy: 0.6572771984895843
Energy: 0.6881172776146285
Energy: 0.7886195557346942
Energy: 0.7879417844281591
Energy: 0.7863178365863253
Energy: 0.7879417844288173
Energy: 0.7921346054431717
Energy: 0.7297042504374321
Energy: 0.6879965320374183
Energy: 0.7297042504374321
Energy: 0.6867746618461108
Energy: 0.6548217119316075
Energy: 0.6534946172332566
Energy: 0.6548217119316075
Energy: 0.7330216916916253
Energy: 0.655435006472192
Energy: 0.6554022199232769
Energy: 0.6554350064735083
Energy: 0.7313990107634912
Energy: 0.6752037422562059
Energy: 0.6747202133562115
Energy: 0.6752037422555478
Energy: 0.7296313858004224
Energy: 0.6749074599250762
Energy: 0.6538816648569161
Energy: 0.6749074599244179
Energy: 0.789832665382114
Energy: 0.7344695050746349
Energy: 0.7330408388082059
Energy: 0.7344695050733185
Energy: 0.7883900863470993
Energy: 0.7328500139498895
Energy: 0.8401650994147373
Energy: 0.7328500139492312
Energy: 0.7880258218607634
Energy: 0.6862027783801277
Energy: 0.68662731173131
Energy: 0.6862027783794694
Energy: 0.7878316059697088
Energy: 0.6884225540885258
Energy: 0.6842995047837952
Energy: 0.6884225540885258
Energy: 0.6870694851543117
Energy: 0.7145719180868985
Energy: 0.686338438058541
Energy: 0.7145719180875568
Energy: 0.7072806331593608
Energy: 0.6811974411414429
Energy: 0.6864702402227704
Energy: 0.6811974411414429
Energy: 0.6870820189315884
Energy: 0.688909221660685
Energy: 0.7327916560318116
Energy: 0.6889092216600268
Energy: 0.6862711491399349
Energy: 0.6873588256774541
Energy: 0.7295255284360253
Energy: 0.6873588256761377
Energy: 0.6868061519865948
Energy: 0.7295622170999314
Energy: 0.7498441414638004
Energy: 0.7295622170992732
Energy: 0.7867322771134944
Energy: 0.7880544682211356
Energy: 0.7861490571283021
Energy: 0.7880544682211356
Energy: 0.6545133685737832
Energy: 0.6754582683209885
Energy: 0.7329439886902528
Energy: 0.6754582683209885
Energy: 0.6554982649556594
Energy: 0.6550264673100877
Energy: 0.6867452498117547
Energy: 0.6550264673114042
Energy: 0.6531600036310996
Energy: 0.6561298220084403
Energy: 0.733276080428874
Energy: 0.6561298220084403
Energy: 0.6584950538002509
Energy: 0.6543836291966739
Energy: 0.7293156910179504
Energy: 0.6543836291960158
Energy: 0.6548254512071419
Energy: 0.6776889742380424
Energy: 0.7307297972360064
Energy: 0.6776889742373842
Energy: 0.7337716346853409
Energy: 0.7876948804817354
Energy: 0.786415042257083
Energy: 0.7876948804797607

minimum gb energy = 0.6412940330767476 eV
minimum distance =  2.61018844930851 Angstroms
sigma value = 53


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

Energy: 0.9329286789844828
Energy: 0.7334710978079633
Energy: 0.7347706294091297
Energy: 0.6180806887165947
Energy: 0.7889226496351769
Energy: 0.652725669720468
Energy: 0.7337406543649022
Energy: 0.6527256697175924
Energy: 0.7334909190063965
Energy: 0.7337093168317348
Energy: 0.7352716585214968
Energy: 0.7337093168323375
Energy: 0.7359051599487164
Energy: 0.6534562575194832
Energy: 0.7315057632369535
Energy: 0.6534562575199482
Energy: 0.7411281440029168
Energy: 0.6529804785061836
Energy: 0.6093112274993677
Energy: 0.6529804785042035
Energy: 0.734472170545518
Energy: 0.6553445669463428
Energy: 0.6107810111967952
Energy: 0.6553445669458778
Energy: 0.844673267228316
Energy: 0.7332018600374035
Energy: 0.7330410731256872
Energy: 0.7332018600360432
Energy: 0.845272331492845
Energy: 0.6548162499828064
Energy: 0.7328144878664266
Energy: 0.6548162499831164
Energy: 0.7332337130953145
Energy: 0.7351909729629571
Energy: 0.736268206777089
Energy: 0.7351909729629571
Energy: 0.7298932779121312
Energy: 0.6542310568402857
Energy: 0.7356479818677037
Energy: 0.6542310568404408
Energy: 0.7350857592226278
Energy: 0.6567423678785718
Energy: 0.6201890117672283
Energy: 0.656742367878434
Energy: 0.7355200672738583
Energy: 0.6527961776069678
Energy: 0.6093271444510812
Energy: 0.6527961776060552
Energy: 0.8451153325278955
Energy: 0.6554053512177317
Energy: 0.7323711038691936
Energy: 0.6554053512162165

minimum gb energy = 0.6093112274993677 eV
minimum distance =  2.64325585388353 Angstroms
sigma value = 9


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

Energy: 0.9754210377108671
Energy: 0.8236153211937081
Energy: 0.8252019522243392
Energy: 0.7865014218237318
Energy: 0.6716445827511519
Energy: 0.670243050687184
Energy: 0.8193995143091823
Energy: 0.6702430506911099
Energy: 0.6763608505397058
Energy: 0.6721150965356233
Energy: 0.8349990794781494
Energy: 0.6721150965384275
Energy: 0.6739963558892998
Energy: 0.6718855114154061
Energy: 0.8721396532612371
Energy: 0.671885511413749
Energy: 0.6707274986583954
Energy: 0.670078883353773
Energy: 0.8664840053307119
Energy: 0.6700788833543337
Energy: 0.6701164871918548
Energy: 0.6699387377074097
Energy: 0.8671415897794857
Energy: 0.669938737706849
Energy: 0.8113277512753782
Energy: 0.8106791990791857
Energy: 0.8208273292748405
Energy: 0.8106791990775032
Energy: 0.8117732481133009
Energy: 0.7438347825883084
Energy: 0.8106441435482207
Energy: 0.7438347825911126
Energy: 0.7149920832633797
Energy: 0.7371295139721578
Energy: 0.7486304386871565
Energy: 0.7371295139727185
Energy: 0.6954540672100346
Energy: 0.7392947022973931
Energy: 0.8110294561103029
Energy: 0.7392947022973931
Energy: 0.7133247431927939
Energy: 0.7338964326883054
Energy: 0.7566885520532631
Energy: 0.733896432686062
Energy: 0.7228173218526155
Energy: 0.7818396657265668
Energy: 0.8659039478727617
Energy: 0.7818396657248843
Energy: 0.8126484030259596
Energy: 0.7269673189560015
Energy: 0.7265987743898253
Energy: 0.7269673189582448
Energy: 0.8167239854736029
Energy: 0.7267427073938196
Energy: 0.727029390724753
Energy: 0.7267427073910153
Energy: 0.7786047628432321
Energy: 0.7271140559460552
Energy: 0.7321572907487365
Energy: 0.7271140559477376
Energy: 0.7766251038678438
Energy: 0.7759356177567648
Energy: 0.7331128758613368
Energy: 0.7759356177533997
Energy: 0.7768998267268281
Energy: 0.6666057381939994
Energy: 0.7291262576336099
Energy: 0.6666057381951211
Energy: 0.7642793871393663
Energy: 0.7633299144166313
Energy: 0.9054545845853191
Energy: 0.7633299144143879
Energy: 0.7618662237000831
Energy: 0.6670955917911798
Energy: 0.6883972628503628
Energy: 0.6670955917923015
Energy: 0.875398755960706
Energy: 0.6934995443085034
Energy: 0.6931482129829405
Energy: 0.6934995443090642
Energy: 0.7825891554837756
Energy: 0.6942763332385903
Energy: 0.6938753209312665
Energy: 0.6942763332447596
Energy: 0.8672566841389527
Energy: 0.6875131159263898
Energy: 0.6876914937660447
Energy: 0.6875131159213422
Energy: 0.8669915591180792
Energy: 0.6879166420216248
Energy: 0.6953203769099694
Energy: 0.6879166420199423
Energy: 0.8176603618707932
Energy: 0.8140853096234506
Energy: 0.8090723497017116
Energy: 0.8140853096268157
Energy: 0.8160576784582698
Energy: 0.7482765019353754
Energy: 0.816676800948885
Energy: 0.7482765019342538
Energy: 0.7460304437843569
Energy: 0.7336030866510813
Energy: 0.710610313732283
Energy: 0.7336030866550073
Energy: 0.815710070394695
Energy: 0.6892256453686683
Energy: 0.6953885075473245
Energy: 0.6892256453703507
Energy: 0.7453812864127884
Energy: 0.7380460542306467
Energy: 0.7097151747174916
Energy: 0.7380460542323294
Energy: 0.867274508811437
Energy: 0.7314906679548313
Energy: 0.7168088030555119
Energy: 0.7314906679559529
Energy: 0.7199439637198632
Energy: 0.7035032468732231
Energy: 0.8156791643629654
Energy: 0.7035032468726623
Energy: 0.7121574084907055
Energy: 0.7094937826123242
Energy: 0.8342955827889487
Energy: 0.7094937826173717
Energy: 0.7160436064761029
Energy: 0.704323410818412
Energy: 0.8091366350581352
Energy: 0.7043234108133645
Energy: 0.7160648473397172
Energy: 0.7526433288831758
Energy: 0.7765208570952022
Energy: 0.7526433288854191
Energy: 0.7111767576508283
Energy: 0.6708010559519911
Energy: 0.7792004058642297
Energy: 0.6708010559503086
Energy: 0.8675554102640655
Energy: 0.8103683907407981
Energy: 0.8217305666914034
Energy: 0.8103683907374332

minimum gb energy = 0.6666057381939994 eV
minimum distance =  2.60193965377235 Angstroms
sigma value = 73


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

Energy: 0.9702694525469455
Energy: 0.7933201931649285
Energy: 0.7928805036062192
Energy: 0.7181583283238266
Energy: 0.6868033954166501
Energy: 0.6841945290045073
Energy: 0.7694863376738043
Energy: 0.6841945290045073
Energy: 0.6866458229304604
Energy: 0.6851729454769675
Energy: 0.7981745700465047
Energy: 0.6851729454778573
Energy: 0.6841209985756651
Energy: 0.6844993201136788
Energy: 0.8558977901566281
Energy: 0.684499320112789
Energy: 0.6852808085927996
Energy: 0.6857515570124252
Energy: 0.8526116896330426
Energy: 0.6857515570133151
Energy: 0.7333338416334565
Energy: 0.6858601353142255
Energy: 0.8530691398872637
Energy: 0.6858601353142255
Energy: 0.7695755115100866
Energy: 0.7948143828341828
Energy: 0.8062860772913016
Energy: 0.7948143828350727
Energy: 0.7256019284870614
Energy: 0.7555491896006454
Energy: 0.7945096074403676
Energy: 0.7555491896015353
Energy: 0.7224258810900851
Energy: 0.7621441960145096
Energy: 0.796357276942795
Energy: 0.7621441960145096
Energy: 0.7196782649469932
Energy: 0.7010670191753482
Energy: 0.7923936508394682
Energy: 0.7010670191753482
Energy: 0.7121934183097743
Energy: 0.6705636768132095
Energy: 0.6741401758504656
Energy: 0.6705636768132095
Energy: 0.7096254570073659
Energy: 0.672019433333491
Energy: 0.8391850828281923
Energy: 0.672019433333491
Energy: 0.7961563759891238
Energy: 0.7195070427521412
Energy: 0.7092386634720942
Energy: 0.7195070427521412
Energy: 0.7964906887534624
Energy: 0.7139521554215074
Energy: 0.7116869331050166
Energy: 0.7139521554215074
Energy: 0.8073628813904254
Energy: 0.7509311389567276
Energy: 0.7096771623352813
Energy: 0.7509311389576174
Energy: 0.8530854928193038
Energy: 0.7094711590463287
Energy: 0.7096587892603082
Energy: 0.7094711590463287
Energy: 0.8535241589984595
Energy: 0.7517593224232141
Energy: 0.7117703871612895
Energy: 0.751759322424104
Energy: 0.7732410668799441
Energy: 0.7721062480825531
Energy: 0.770250935860504
Energy: 0.7721062480825531
Energy: 0.7697623383714932
Energy: 0.7332259183859385
Energy: 0.7672660116493928
Energy: 0.7332259183850488
Energy: 0.7784075022785428
Energy: 0.7316757901082308
Energy: 0.7674746238942578
Energy: 0.7316757901064512
Energy: 0.7701463135149501
Energy: 0.7334701343609497
Energy: 0.7186522367751507
Energy: 0.7334701343600599
Energy: 0.8518887328570606
Energy: 0.7665925989717478
Energy: 0.7692964167283709
Energy: 0.7665925989717478

minimum gb energy = 0.6705636768132095 eV
minimum distance =  2.5738148542745 Angstroms
sigma value = 7


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

Energy: 1.133608768690001
Energy: 0.7953353128463719
Energy: 0.795273648348598
Energy: 0.6921302232068253
Energy: 0.7203175330530367
Energy: 0.6871350919763489
Energy: 0.8436173000782189
Energy: 0.6871350919750906
Energy: 0.6850624210273178
Energy: 0.6864477255924183
Energy: 0.7575975706962369
Energy: 0.6864477255949352
Energy: 0.6843893624679598
Energy: 0.6858249328033323
Energy: 0.8409362826218063
Energy: 0.68582493280522
Energy: 0.6871177329888766
Energy: 0.6876347441596179
Energy: 0.8180193145277745
Energy: 0.6876347441615055
Energy: 0.6856581800873035
Energy: 0.6877220299943017
Energy: 0.8173374703428548
Energy: 0.6877220299974477
Energy: 0.8420861472019142
Energy: 0.6865842860381027
Energy: 0.6843912764994786
Energy: 0.6865842860362152
Energy: 0.8435606447125488
Energy: 0.6883997782709669
Energy: 0.6873516107522517
Energy: 0.6883997782715962
Energy: 0.8396407969529722
Energy: 0.6855717634935388
Energy: 0.6844348246081267
Energy: 0.6855717634929097
Energy: 0.8262745459727724
Energy: 0.6879928999143027
Energy: 0.6858839223761539
Energy: 0.6879928999149321
Energy: 0.8436693574107347
Energy: 0.7777230289648124
Energy: 0.767855401370846
Energy: 0.7777230289641831
Energy: 0.7637135355039262
Energy: 0.758999818688854
Energy: 0.8407844260348369
Energy: 0.7589998186844494
Energy: 0.7579379424237778
Energy: 0.727822565592405
Energy: 0.7630736211641819
Energy: 0.7278225655930342
Energy: 0.7560016831590441
Energy: 0.7263034334843648
Energy: 0.6921550380585045
Energy: 0.7263034334818479
Energy: 0.7632891247912343
Energy: 0.7276107861317873
Energy: 0.6936564882881401
Energy: 0.7276107861311581
Energy: 0.8565991812984843
Energy: 0.7593251806037666
Energy: 0.7636780522532193
Energy: 0.7593251806025083
Energy: 0.6905704401017563
Energy: 0.7294476535898482
Energy: 0.8439845256248156
Energy: 0.7294476535904775
Energy: 0.6862185527700141
Energy: 0.6880046789992177
Energy: 0.7580375615554025
Energy: 0.6880046789973301
Energy: 0.6827407176478635
Energy: 0.6857295230398783
Energy: 0.8399231007867449
Energy: 0.6857295230405075
Energy: 0.6873519632717203
Energy: 0.6883401631423792
Energy: 0.7758435049182612
Energy: 0.6883401631430084
Energy: 0.6843593515232478
Energy: 0.6866906857990804
Energy: 0.8205024494257699
Energy: 0.6866906857990804
Energy: 0.8390653527358659
Energy: 0.688207375155544
Energy: 0.6853951085850329
Energy: 0.688207375155544
Energy: 0.83883145297971
Energy: 0.6875571151297547
Energy: 0.6867907096840753
Energy: 0.6875571151259795
Energy: 0.8407746194625658
Energy: 0.6857588741752021
Energy: 0.6846765485558631
Energy: 0.6857588741714268
Energy: 0.8244487597587498
Energy: 0.6863812579274313
Energy: 0.685224215684669
Energy: 0.6863812579249144
Energy: 0.8205435172010599
Energy: 0.6861264940079222
Energy: 0.6875308626252055
Energy: 0.6861264940110683
Energy: 0.7954914498959738
Energy: 0.766695776492461
Energy: 0.9782169584643012
Energy: 0.7666957764912026
Energy: 0.7593655912029322
Energy: 0.7288835365334234
Energy: 0.7640891554099831
Energy: 0.7288835365321651
Energy: 0.7583777982433457
Energy: 0.7270067803718538
Energy: 0.7579097798681503
Energy: 0.7270067803724832
Energy: 0.7622760704801351
Energy: 0.730229030981289
Energy: 0.691884812817893
Energy: 0.7302290309794015
Energy: 0.8560998374151457
Energy: 0.7625959015911113
Energy: 0.7626865848120341
Energy: 0.762595901592999

minimum gb energy = 0.6827407176478635 eV
minimum distance =  2.59394185420871 Angstroms
sigma value = 29


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

Energy: 0.6410186367683279
Energy: 0.7805346986177406
Energy: 0.656649796584931
Energy: 0.6427615133037189
Energy: 0.6805153739066055
Energy: 0.7059583570623136
Energy: 0.6584380436270164
Energy: 0.7059583570638235
Energy: 0.6538238974358983
Energy: 0.6906580716531915
Energy: 0.6438654753705784
Energy: 0.6906580716521199
Energy: 0.6457078142057575
Energy: 0.6539116947646237
Energy: 0.6539074236819393
Energy: 0.6539116947635523
Energy: 0.6524842658995158
Energy: 0.6562451023038673
Energy: 0.6455593235281569
Energy: 0.6562451023047197
Energy: 0.6531204025898147
Energy: 0.6963677279608255
Energy: 0.646079665892964
Energy: 0.6963677279612394
Energy: 0.6444087396737829
Energy: 0.6896921464511788
Energy: 0.6536024388751714
Energy: 0.6896921464531027
Energy: 0.6572518356810668
Energy: 0.6580035828314363
Energy: 0.646004058822032
Energy: 0.6580035828316555
Energy: 0.6459800823299979
Energy: 0.6545546131800418
Energy: 0.6582441355466103
Energy: 0.6545546131787512

minimum gb energy = 0.6410186367683279 eV
minimum distance =  2.61567059378548 Angstroms
sigma value = 5


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

Energy: 0.8953918136142118
Energy: 0.6404650720985511
Energy: 0.7533650410149534
Energy: 0.6204497475714758
Energy: 0.6823602194184982
Energy: 0.6390982924790426
Energy: 0.7408724348501645
Energy: 0.6390982924784482
Energy: 0.7585514753273975
Energy: 0.6901891951464485
Energy: 0.759735593264075
Energy: 0.690189195145854
Energy: 0.6544136578876681
Energy: 0.6378993851215862
Energy: 0.7338050922858471
Energy: 0.6378993851209918
Energy: 0.7324856078610833
Energy: 0.6371600417782959
Energy: 0.7566650634279336
Energy: 0.6371600417771073
Energy: 0.6374980631801745
Energy: 0.6388427167214455
Energy: 0.7567777095149553
Energy: 0.6388427167214455
Energy: 0.6372667924811272
Energy: 0.6374362687864833
Energy: 0.7341420170248251
Energy: 0.6374362687858889
Energy: 0.6442220933023924
Energy: 0.6400875695018654
Energy: 0.8116489465949991
Energy: 0.6400875695018654
Energy: 0.6569322368366244
Energy: 0.6576688746995712
Energy: 0.8544534811785917
Energy: 0.6576688746989768
Energy: 0.7736863648574156
Energy: 0.6230854287685537
Energy: 0.6258557982108491
Energy: 0.6230854287679594
Energy: 0.65582394214376
Energy: 0.6215060893042259
Energy: 0.621138704593905
Energy: 0.6215060893042259
Energy: 0.8546710056502083
Energy: 0.6207202769305644
Energy: 0.6209624447179437
Energy: 0.6207202769305644
Energy: 0.8510022256827586
Energy: 0.6210963645662926
Energy: 0.620678535230551
Energy: 0.6210963645651039
Energy: 0.6376850272896346
Energy: 0.6544070702930225
Energy: 0.7576362785224532
Energy: 0.6544070702924282
Energy: 0.6371437700823439
Energy: 0.6375162815514837
Energy: 0.7576256038795175
Energy: 0.6375162815508891
Energy: 0.640730945385321
Energy: 0.6385993240630506
Energy: 0.7327351777571007
Energy: 0.6385993240630506
Energy: 0.6384183645853931
Energy: 0.6379047166658037
Energy: 0.6525891633062109
Energy: 0.637904716664615
Energy: 0.7505291197446811
Energy: 0.6398733115594145
Energy: 0.6539442503240979
Energy: 0.6398733115606033
Energy: 0.7605910039347938
Energy: 0.6913409738736466
Energy: 0.7423896164967092
Energy: 0.6913409738736466
Energy: 0.7353796403451933
Energy: 0.6918151344323613
Energy: 0.6526899497898945
Energy: 0.6918151344329556
Energy: 0.7571114254181666
Energy: 0.6447247583033474
Energy: 0.7343462002131779
Energy: 0.6447247583027529
Energy: 0.7567128891322638
Energy: 0.6369437684875742
Energy: 0.6371890707772929
Energy: 0.6369437684863855
Energy: 0.7334887331068038
Energy: 0.6377059924716822
Energy: 0.637861202822886
Energy: 0.6377059924722766
Energy: 0.8120894127044029
Energy: 0.6390752131220403
Energy: 0.6413575660417199
Energy: 0.6390752131214729
Energy: 0.8145723559637277
Energy: 0.6549599163135114
Energy: 0.655571213286052
Energy: 0.6549599163135114
Energy: 0.630007397667527
Energy: 0.622887965120111
Energy: 0.7735865090087416
Energy: 0.6228879651207053
Energy: 0.6226303788376866
Energy: 0.6228653899353932
Energy: 0.6569377552876554
Energy: 0.6228653899347989
Energy: 0.6201288292760886
Energy: 0.622874658635727
Energy: 0.686613384867704
Energy: 0.6228746586363213
Energy: 0.6203834014656059
Energy: 0.6218962150157541
Energy: 0.8101202350073446
Energy: 0.6218962150157541
Energy: 0.7576005723767849
Energy: 0.6539758223575701
Energy: 0.6551051165044919
Energy: 0.6539758223569758
Energy: 0.7576947478943596
Energy: 0.6380698040120235
Energy: 0.6386569076575492
Energy: 0.6380698040126178
Energy: 0.732812865781228
Energy: 0.6383413952020383
Energy: 0.6383507297664127
Energy: 0.6383413952026327
Energy: 0.6537576512165559
Energy: 0.6374019459788082
Energy: 0.6374340536336803
Energy: 0.6374019459794025

minimum gb energy = 0.6201288292760886 eV
minimum distance =  2.58754192835023 Angstroms
sigma value = 1


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

Energy: 1.0603668148707703
Energy: 0.6154223848086074
Energy: 0.6150921240382646
Energy: 0.5974874519451052
Energy: 0.7088367388281374
Energy: 0.6150606742244706
Energy: 0.7556904493186378
Energy: 0.6150606742261143
Energy: 0.714081884046141
Energy: 0.6813944562785538
Energy: 0.7592483688028994
Energy: 0.681394456277732
Energy: 0.7053085449850137
Energy: 0.6812603252631042
Energy: 0.7483653111091718
Energy: 0.6812603252631042
Energy: 0.6270397694280443
Energy: 0.6196365898882596
Energy: 0.7009925088910165
Energy: 0.6196365898874379
Energy: 0.6196943307460594
Energy: 0.6212910007999527
Energy: 0.6925939645881093
Energy: 0.6212910007983089
Energy: 0.6193126581929571
Energy: 0.6193468058871917
Energy: 0.7482511725886917
Energy: 0.6193468058871917
Energy: 0.6210680489565115
Energy: 0.6221432700168136
Energy: 0.7990609227844706
Energy: 0.6221432700168136
Energy: 0.6244670265254681
Energy: 0.6516841817912282
Energy: 0.7999702247542751
Energy: 0.6516841817920501
Energy: 0.8745507206450708
Energy: 0.5872934019524509
Energy: 0.6558330960868451
Energy: 0.587293401951629
Energy: 0.6268692174192225
Energy: 0.5870575149017153
Energy: 0.6598522648243201
Energy: 0.5870575149008934
Energy: 0.8488339839899873
Energy: 0.5849275963871694
Energy: 0.6531740261439484
Energy: 0.5849275963871694
Energy: 0.8488854296411817
Energy: 0.5856415738822381
Energy: 0.6544841038452215
Energy: 0.5856415738830598
Energy: 0.6239430230807026
Energy: 0.6527618178228783
Energy: 0.7874276854079465
Energy: 0.6527618178237001
Energy: 0.70554359206411
Energy: 0.6524849097406713
Energy: 0.7872602245438298
Energy: 0.6524849097414932
Energy: 0.7069281583642023
Energy: 0.6514383323499283
Energy: 0.7485804064666498
Energy: 0.6514383323482845
Energy: 0.620890408899052
Energy: 0.6207100696920188
Energy: 0.7031320388552891
Energy: 0.6207100696911969
Energy: 0.6251295018762293
Energy: 0.622327838350476
Energy: 0.7032589019024039
Energy: 0.6223278383488323
Energy: 0.6232677006498624
Energy: 0.6199582230262637
Energy: 0.7994885150910019
Energy: 0.6199582230279073
Energy: 0.6217490179631855
Energy: 0.6339539652001132
Energy: 0.7989210203545151
Energy: 0.6339539652017567
Energy: 0.821484335714127
Energy: 0.6469544880879093
Energy: 0.7468194696999796
Energy: 0.6469544880870876
Energy: 0.819880465629997
Energy: 0.6144968189042788
Energy: 0.6148282556764884
Energy: 0.6144968189042788
Energy: 0.7004951416711075
Energy: 0.6133029482620138
Energy: 0.6139312691450178
Energy: 0.613302948262817
Energy: 0.7975000722062373
Energy: 0.6134064256916318
Energy: 0.6139757051786248
Energy: 0.6134064256940972

minimum gb energy = 0.5849275963871694 eV
minimum distance =  2.57433151125279 Angstroms
sigma value = 17


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

Energy: 1.028844303555178
Energy: 0.6012508147378353
Energy: 0.7300601150833466
Energy: 0.5859614883029305
Energy: 0.6313536721363362
Energy: 0.5994421756731803
Energy: 0.6896407928360673
Energy: 0.5994421756726724
Energy: 0.7802042169631807
Energy: 0.5977823401972524
Energy: 0.7085838614407648
Energy: 0.5977823402190936
Energy: 0.8057375738653991
Energy: 0.6309344334330744
Energy: 0.6827340708069072
Energy: 0.6309344334330744
Energy: 0.6717874998035719
Energy: 0.5860890774232715
Energy: 0.8050120201268067
Energy: 0.5860890774237794
Energy: 0.5864855328340335
Energy: 0.585655561474024
Energy: 0.7712473638076268
Energy: 0.5856555614735159
Energy: 0.5863030514878504
Energy: 0.5855629217419142
Energy: 0.6110698068290814
Energy: 0.5855629217424221
Energy: 0.5922742184977403
Energy: 0.5872489801296177
Energy: 0.7871072079486718
Energy: 0.5872489801311416
Energy: 0.7781107858577893
Energy: 0.5872176726192386
Energy: 0.7589192702067988
Energy: 0.5872176726197466
Energy: 0.7109173710679162
Energy: 0.6336157728129399
Energy: 0.6895730432752751
Energy: 0.6336157728139558
Energy: 0.7754859140526561
Energy: 0.5977965613777232
Energy: 0.6083032335989701
Energy: 0.5977965613812556
Energy: 0.7821828325993262
Energy: 0.6016446721961434
Energy: 0.6833524164371747
Energy: 0.6016446721971591
Energy: 0.7711939815755992
Energy: 0.5978098270207787
Energy: 0.5982312333579791
Energy: 0.5978098270202707
Energy: 0.700149033508442
Energy: 0.5978758254038985
Energy: 0.599365216354325
Energy: 0.5978758254049144
Energy: 0.8012973521951042
Energy: 0.5997906400997203
Energy: 0.6014822429772795
Energy: 0.5997906401002282
Energy: 0.7869933630583776
Energy: 0.5977919783964556
Energy: 0.6010506244540382
Energy: 0.5977919783959476
Energy: 0.5981814596870981
Energy: 0.6831277894568417
Energy: 0.7056436413388627
Energy: 0.6831277894568417
Energy: 0.5979782489103693
Energy: 0.5983290391340067
Energy: 0.7767071836141685
Energy: 0.5983290391345147
Energy: 0.6109234640679867
Energy: 0.5992603700858
Energy: 0.7565653568925645
Energy: 0.599260370085292
Energy: 0.599134806312821
Energy: 0.5978255413064201
Energy: 0.7878973879129396
Energy: 0.5978255413064201
Energy: 0.708722350092602
Energy: 0.5995840262361136
Energy: 0.5987278695480603
Energy: 0.5995840262361136
Energy: 0.7085724983247027
Energy: 0.6011668585803657
Energy: 0.8003015934810344
Energy: 0.6011668585818895
Energy: 0.6833498291228038
Energy: 0.6294755866979564
Energy: 0.8025160324749199
Energy: 0.6294755866979564
Energy: 0.8087747609102323
Energy: 0.5869772629967289
Energy: 0.6710123442740756
Energy: 0.5869772629967289
Energy: 0.7762454541912067
Energy: 0.5855644437997478
Energy: 0.5858525744063622
Energy: 0.5855644437992399
Energy: 0.6837103111871995
Energy: 0.5863103751611114
Energy: 0.5890452935592698
Energy: 0.5863103751611114
Energy: 0.5909948093832093
Energy: 0.5876817182805543
Energy: 0.5904126641094142
Energy: 0.5876817182810621
Energy: 0.6854240657929438
Energy: 0.5872376839662732
Energy: 0.777044345027301
Energy: 0.5872376839657653
Energy: 0.6893757452014042
Energy: 0.6322784583044097
Energy: 0.708958358596991
Energy: 0.6322784583044097
Energy: 0.6093421789647044
Energy: 0.5976092550254811
Energy: 0.773646938724578
Energy: 0.597609255026497
Energy: 0.6831892108862478
Energy: 0.5983834802345223
Energy: 0.7856804779040388
Energy: 0.5983834802335064
Energy: 0.5977851129881993
Energy: 0.598131299387556
Energy: 0.7710164436628488
Energy: 0.5981312993870482
Energy: 0.597784346263549
Energy: 0.597409436185802
Energy: 0.7010953216037507
Energy: 0.5974094361868177
Energy: 0.6037799760789847
Energy: 0.6011733300722654
Energy: 0.8028761647291816
Energy: 0.6011733300732812
Energy: 0.7044488198869646
Energy: 0.6151713253667391
Energy: 0.7869239477852823
Energy: 0.615171325367247
Energy: 0.9213828147840252
Energy: 0.6013973959479023
Energy: 0.5994810190668899
Energy: 0.6013973959484102
Energy: 0.77606166724226
Energy: 0.5976820555673813
Energy: 0.598592102624772
Energy: 0.597682055568397
Energy: 0.7594869751114142
Energy: 0.6009709630189656
Energy: 0.5984184247773733
Energy: 0.6009709630118546

minimum gb energy = 0.5855629217419142 eV
minimum distance =  2.59320294599973 Angstroms
sigma value = 89


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

Energy: 1.0948675379551818
Energy: 0.5469865995550954
Energy: 0.5472262486796108
Energy: 0.5653753866395833
Energy: 0.65997540140792
Energy: 0.5979403523135163
Energy: 0.5469533055718898
Energy: 0.5979403523139091
Energy: 0.541560529456778
Energy: 0.5982135712488972
Energy: 0.5597636688146799
Energy: 0.5982135712488972
Energy: 0.5421451632464432
Energy: 0.5988422115254621
Energy: 0.5455197352977507
Energy: 0.5988422115255829
Energy: 0.5448276962034371
Energy: 0.5454803320374543
Energy: 0.5558854351309178
Energy: 0.5454803320371976
Energy: 0.5447940352986133
Energy: 0.5448694746625332
Energy: 0.5549470431165355
Energy: 0.544869474663062
Energy: 0.5442741277241157
Energy: 0.5439926440670454
Energy: 0.5463640047723618
Energy: 0.5439926440673172
Energy: 0.5462598865153591
Energy: 0.5476180224278917
Energy: 0.540459240616996
Energy: 0.547618022427635
Energy: 0.546015278633267
Energy: 0.5468087987969158
Energy: 0.540644181296834
Energy: 0.5468087987965232
Energy: 0.5580719410162478
Energy: 0.599531888731316
Energy: 0.5582290634085654
Energy: 0.5995318887306514
Energy: 0.5464435904593213
Energy: 0.5992553158608602
Energy: 0.5400021040736293
Energy: 0.5992553158609962
Energy: 0.5546169425205293
Energy: 0.5459668443706932
Energy: 0.5470524359671187
Energy: 0.5459668443708292
Energy: 0.5566009931765367
Energy: 0.5462260426582349
Energy: 0.5473923227187939
Energy: 0.5462260426578271
Energy: 0.5460060356203433
Energy: 0.5437517874222026
Energy: 0.5437599151993939
Energy: 0.5437517874224593
Energy: 0.5404393907009616
Energy: 0.5457279102732733
Energy: 0.5461029116804808
Energy: 0.5457279102728656

minimum gb energy = 0.5400021040736293 eV
minimum distance =  2.61411208723153 Angstroms
sigma value = 13


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

Energy: 0.9609248050074853
Energy: 0.5187108676969685
Energy: 0.6741388831307308
Energy: 0.5132425596441876
Energy: 0.5669942760280545
Energy: 0.5168183234604465
Energy: 0.6205320530044461
Energy: 0.5168183234604465
Energy: 0.5196553345478674
Energy: 0.5157818602237527
Energy: 0.6269579369581163
Energy: 0.5157818602231957
Energy: 0.7301040853771533
Energy: 0.5182077387604942
Energy: 0.6133080756912143
Energy: 0.5182077387660646
Energy: 0.6167942493292514
Energy: 0.517498934201685
Energy: 0.7415182692915855
Energy: 0.5174989341961146
Energy: 0.6146009804770703
Energy: 0.5166861980500149
Energy: 0.6242815227186984
Energy: 0.5166861980550029
Energy: 0.625190291297172
Energy: 0.5163447099528861
Energy: 0.6115217028371076
Energy: 0.5163447099489868
Energy: 0.6128252634012169
Energy: 0.5155140778606611
Energy: 0.6267344556597372
Energy: 0.5155140778606611
Energy: 0.5258877031503588
Energy: 0.5175420000185016
Energy: 0.615561796121226
Energy: 0.5175420000168306
Energy: 0.5156210871042987
Energy: 0.5164484988070845
Energy: 0.6146176624145607
Energy: 0.5164484988059704
Energy: 0.51739062356782
Energy: 0.5200533566148832
Energy: 0.9612920996340224
Energy: 0.5200533566081985
Energy: 0.6112779582249819
Energy: 0.5159686722918064
Energy: 0.6148260301249401
Energy: 0.5159686722873501
Energy: 0.6253058521484709
Energy: 0.5453583381532533
Energy: 0.6107626060074669
Energy: 0.5453583381493542
Energy: 0.6129567948741972
Energy: 0.5468214047941273
Energy: 0.7308808686385181
Energy: 0.5468214047957984
Energy: 0.6177679357276961
Energy: 0.5168619622018404
Energy: 0.6140910782425357
Energy: 0.5168619622018404
Energy: 0.6177840895202444
Energy: 0.5168794299770729
Energy: 0.5185394705493142
Energy: 0.5168794299759588
Energy: 0.6116533228298177
Energy: 0.516600462466358
Energy: 0.5165917742542518
Energy: 0.516600462466358
Energy: 0.5211264548935263
Energy: 0.5170849440099521
Energy: 0.5180531439387629
Energy: 0.5170849440155224
Energy: 0.6990567390946637
Energy: 0.5173536702735104
Energy: 0.6106959063516191
Energy: 0.5173536702735104
Energy: 0.6136863411557315
Energy: 0.5153986336861766
Energy: 0.6255375210817992
Energy: 0.5153986336856194
Energy: 0.7294972320476861
Energy: 0.5189752429518804
Energy: 0.6110092296139743
Energy: 0.5189752429273706
Energy: 0.6140693908259232
Energy: 0.5539057032810809
Energy: 0.6106652892005107
Energy: 0.5539057032794098
Energy: 0.6159818581299821
Energy: 0.5177423189409753
Energy: 0.6245772874812446
Energy: 0.5177423189398612
Energy: 0.5198356799043522
Energy: 0.5153970259755712
Energy: 0.6135352299167214
Energy: 0.5153970259733685
Energy: 0.6121127111637946
Energy: 0.5166498566747879
Energy: 0.6173590768270775
Energy: 0.516649856677016
Energy: 0.5167402616643073
Energy: 0.5155267454473796
Energy: 0.6166266666514446
Energy: 0.5155267454429233
Energy: 0.5158716100161864
Energy: 0.5154767532970278
Energy: 0.6129149392552941
Energy: 0.5154767532925715
Energy: 0.5259189093200896
Energy: 0.5177918154369999
Energy: 0.5215883653897875
Energy: 0.5177918154369999
Energy: 0.6103410859489465
Energy: 0.5171264312454371
Energy: 0.6998797686924891
Energy: 0.5171264312487794
Energy: 0.6249237147738779
Energy: 0.547260233502194
Energy: 0.6104492742378462
Energy: 0.5472602334971807
Energy: 0.7204140579562648
Energy: 0.5454684534224536
Energy: 0.7303203193973287
Energy: 0.54546845342691
Energy: 0.6176391966787093
Energy: 0.5166729873065651
Energy: 0.6103484859039411
Energy: 0.5166729873087933
Energy: 0.6182801968367153
Energy: 0.5171053925927134
Energy: 0.522029142703344
Energy: 0.5171053925971697
Energy: 0.7216752459441521
Energy: 0.5155721061652663
Energy: 0.5161338770665378
Energy: 0.5155721061680515
Energy: 0.6990020507621949
Energy: 0.5169181736327552
Energy: 0.5193091449003361
Energy: 0.5169181736283242

minimum gb energy = 0.5132425596441876 eV
minimum distance =  2.60692167467435 Angstroms
sigma value = 37


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

Energy: 0.9375810519579758
Energy: 0.4853315363741255
Energy: 0.4847136547321128
Energy: 0.47863887061557264
Energy: 0.7927815648986661
Energy: 0.48460203609041014
Energy: 0.6526884256210781
Energy: 0.48460203609041014
Energy: 0.7208201827359286
Energy: 0.5398105081021203
Energy: 0.6494604338570568
Energy: 0.5398105081021203
Energy: 0.7219033187259579
Energy: 0.5408883497510342
Energy: 0.6468614741476485
Energy: 0.5408883497500757
Energy: 0.6307651196689149
Energy: 0.47648774896337187
Energy: 0.7255637532291453
Energy: 0.476487748932704
Energy: 0.5672304600407421
Energy: 0.47635780286006935
Energy: 0.6348830028920508
Energy: 0.47635780285911106
Energy: 0.564103181175497
Energy: 0.4757292446520037
Energy: 0.7908736867697952
Energy: 0.4757292446510454
Energy: 0.5636726474280506
Energy: 0.4709217565599505
Energy: 0.7243801256850168
Energy: 0.4709217565580338
Energy: 0.5555760190192349
Energy: 0.47269068449099366
Energy: 0.7244577059538221
Energy: 0.47269068449099366
Energy: 0.555113110878907
Energy: 0.4686040902684607
Energy: 0.7902445574186147
Energy: 0.4686040902684607
Energy: 0.5810093327121846
Energy: 0.5808482411697501
Energy: 0.8336500380548438
Energy: 0.5808482411707084
Energy: 0.7169671228779512
Energy: 0.4685630555878247
Energy: 0.7901206231678194
Energy: 0.4685630555878247
Energy: 0.7163142689911308
Energy: 0.5232971582470767
Energy: 0.7207500610964154
Energy: 0.5232971582461182
Energy: 0.7164962895660921
Energy: 0.5236716078141053
Energy: 0.7223045574184737
Energy: 0.5236716078141053
Energy: 0.725563753228187
Energy: 0.53306520184255
Energy: 0.6360356793880532
Energy: 0.5330652018435084
Energy: 0.7929062300893238
Energy: 0.532080532079866
Energy: 0.5674945626573289
Energy: 0.532080532079866
Energy: 0.7939580655374202
Energy: 0.5320096232690997
Energy: 0.5641328385571213
Energy: 0.532009623270058
Energy: 0.7243801253842193
Energy: 0.48382390363592925
Energy: 0.4907115999418809
Energy: 0.48382390363688765
Energy: 0.7244577059547805
Energy: 0.48622269674929913
Energy: 0.4838197652375413
Energy: 0.4862226967483408
Energy: 0.7184267663392833
Energy: 0.48467672321088406
Energy: 0.48998934292033386
Energy: 0.48467672321184246

minimum gb energy = 0.4685630555878247 eV
minimum distance =  2.60589728361928 Angstroms
sigma value = 25


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

Energy: 0.9974762351601212
Energy: 0.4215394204932126
Energy: 0.5977006279832614
Energy: 0.42415522946929124
Energy: 0.7442809897927465
Energy: 0.4196799913193551
Energy: 0.5520944710757086
Energy: 0.4196799913193551
Energy: 0.8982256287134471
Energy: 0.41909986125949716
Energy: 0.5547837153195705
Energy: 0.4190998612587488
Energy: 0.6922510235573829
Energy: 0.42269353021249295
Energy: 0.5513689663185712
Energy: 0.42269353021249295
Energy: 0.689961938439825
Energy: 0.46414302093205717
Energy: 0.7916493037068231
Energy: 0.46414302093205717
Energy: 0.6836004143109728
Energy: 0.46294297707151516
Energy: 0.7933647450479135
Energy: 0.46294297707226356
Energy: 0.690508079713942
Energy: 0.4639873502305744
Energy: 0.7918678364988911
Energy: 0.4639873502305744
Energy: 0.5512665972153896
Energy: 0.4225274353110394
Energy: 0.7890776636903565
Energy: 0.4225274353110394
Energy: 0.5546956358030696
Energy: 0.41904493531456444
Energy: 0.7923268211449757
Energy: 0.41904493531456444
Energy: 0.5550245476595107
Energy: 0.4198330880620482
Energy: 0.7915234567605588
Energy: 0.4198330880620482
Energy: 0.41957818699784527
Energy: 0.42243459372849984
Energy: 0.8445383253061537
Energy: 0.42243459372775144
Energy: 0.4220450944005746
Energy: 0.4195295966384734
Energy: 0.7917857249676251
Energy: 0.4195295966384734
Energy: 0.42047162864448623
Energy: 0.4212560649379256
Energy: 0.6872838066963
Energy: 0.4212560649379256
Energy: 0.4287191780933908
Energy: 0.42397157192344836
Energy: 0.8938873346200543
Energy: 0.4239715719241967
Energy: 0.5553338598029876
Energy: 0.41887824188333767
Energy: 0.8995014217997637
Energy: 0.41887824188333767
Energy: 0.5549132720467042
Energy: 0.42013463327985806
Energy: 0.8957103022463513
Energy: 0.42013463327985806
Energy: 0.6899909514717548
Energy: 0.42099200213196225
Energy: 0.8955397817828862
Energy: 0.42099200213046556
Energy: 0.5556059619705853
Energy: 0.466520723240478
Energy: 0.7943138592282308
Energy: 0.466520723240478
Energy: 0.7917456671211177
Energy: 0.4635447645632889
Energy: 0.6858400548275843
Energy: 0.4635447645632889
Energy: 0.6904234977859854
Energy: 0.4636353194759785
Energy: 0.6840532978951551
Energy: 0.46363531947298503
Energy: 0.8450090782841642
Energy: 0.421598460129492
Energy: 0.5560075397290148
Energy: 0.4215984601302404
Energy: 0.901577491102379
Energy: 0.418566783961343
Energy: 0.41948124079490207
Energy: 0.4185667839605946
Energy: 0.8962314973345188
Energy: 0.4211535058958552
Energy: 0.5512003520742057
Energy: 0.4211535058966036
Energy: 0.7986491926978753
Energy: 0.4212606207490561
Energy: 0.41972617244499044
Energy: 0.42126062074980447
Energy: 0.9001543687729354
Energy: 0.41862953397542907
Energy: 0.4193436779002436
Energy: 0.41862953397617736
Energy: 0.8936626042089563
Energy: 0.4201969199166406
Energy: 0.42295734997544854
Energy: 0.4201969199166406

minimum gb energy = 0.4185667839605946 eV
minimum distance =  2.62020107136238 Angstroms
sigma value = 41


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

Energy: 1.10084014818375
Energy: 0.38422860550102644
Energy: 0.5675411079559266
Energy: 0.3879359139613292
Energy: 0.8364207388849206
Energy: 0.3812733631638375
Energy: 0.49175532209812445
Energy: 0.3812733631656781
Energy: 0.9699080892155783
Energy: 0.3808278892418206
Energy: 0.4958017318480747
Energy: 0.38082788924243416
Energy: 0.7958866643113336
Energy: 0.3846462365885024
Energy: 0.6102302909155382
Energy: 0.3846462365885024
Energy: 0.7942356836298289
Energy: 0.37984598855678353
Energy: 0.6999598964756552
Energy: 0.3798459885573971
Energy: 0.7900839798106547
Energy: 0.38129166118613383
Energy: 0.6977279324122881
Energy: 0.38129166114993535
Energy: 0.7935216448286964
Energy: 0.41876887675752283
Energy: 0.7933402877168166
Energy: 0.4187688767599769
Energy: 0.7025428915255957
Energy: 0.4185629071914064
Energy: 0.6987977984882436
Energy: 0.4185629071914064
Energy: 0.6048720426716205
Energy: 0.5084063469631426
Energy: 0.8799091997819276
Energy: 0.5084063469631426
Energy: 0.6048115142501134
Energy: 0.37996184111009385
Energy: 0.7962948928053922
Energy: 0.379961841111321
Energy: 0.49828164284019666
Energy: 0.3837618330442688
Energy: 0.97056607990879
Energy: 0.3837618330418147
Energy: 0.4926915329243451
Energy: 0.3800428094144053
Energy: 0.8783147256901116
Energy: 0.38004280941256474
Energy: 0.49171029455499166
Energy: 0.38198807285122005
Energy: 0.8768053533744735
Energy: 0.38198807285183356
Energy: 0.38685192346042224
Energy: 0.38287650325562855
Energy: 0.8760251932165254
Energy: 0.38287650325562855
Energy: 0.3820473559722951
Energy: 0.38096033477692526
Energy: 0.879173179333831
Energy: 0.38096033477753877
Energy: 0.38495848041098524
Energy: 0.3814798520213796
Energy: 0.9710917689509391
Energy: 0.38147985202199314
Energy: 0.4963610363647054
Energy: 0.38307394988219867
Energy: 0.9641297991081782
Energy: 0.3830739498772903
Energy: 0.490990362211322
Energy: 0.3796563599397698
Energy: 0.9690220344645366
Energy: 0.3796563599416104
Energy: 0.4921782539867222
Energy: 0.38301116250462036
Energy: 0.7918932750560921
Energy: 0.38301116250462036
Energy: 0.6970754983247011
Energy: 0.38145191770907605
Energy: 0.7902279176126874
Energy: 0.3814519177096896
Energy: 0.7210144307988289
Energy: 0.38043246883582227
Energy: 0.8779437587413788
Energy: 0.3804324688407305
Energy: 0.6978402698316974
Energy: 0.5107533404498218
Energy: 0.7943454894888798
Energy: 0.5107533404492084
Energy: 0.8804487413479063
Energy: 0.41620936155766114
Energy: 0.7890848807155313
Energy: 0.4162093615564341
Energy: 0.6985203185811878
Energy: 0.511006790291648
Energy: 0.6971656461864091
Energy: 0.511006790291648
Energy: 0.8789775662401085
Energy: 0.38222593893792917
Energy: 0.6000344514913901
Energy: 0.3822259389385427
Energy: 0.8805295494467521
Energy: 0.3812433184022598
Energy: 0.6957247231551009
Energy: 0.3812433184010327
Energy: 0.8828117376078836
Energy: 0.38339948216801994
Energy: 0.4927304650505963
Energy: 0.3833994821674065
Energy: 0.9684749694863314
Energy: 0.3801836255205379
Energy: 0.4899077025641592
Energy: 0.38018362551931084
Energy: 0.8820479634584167
Energy: 0.38275149342163967
Energy: 0.49578975511549384
Energy: 0.3827514934197991
Energy: 0.8806250206137262
Energy: 0.38185375765050056
Energy: 0.38540200719403755
Energy: 0.38185375765050056
Energy: 0.9687256711985652
Energy: 0.38064091065772154
Energy: 0.3812228814943977
Energy: 0.38064091065772154
Energy: 0.9644177739338636
Energy: 0.38455071832173143
Energy: 0.38768810193021336
Energy: 0.38455071832111787

minimum gb energy = 0.3796563599397698 eV
minimum distance =  2.62378180210428 Angstroms
sigma value = 15


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

Energy: 0.9465854849218058
Energy: 0.3542670062730176
Energy: 0.5426454987630993
Energy: 0.35816015318538
Energy: 0.9022254216386361
Energy: 0.3517961143114878
Energy: 0.452012063934565
Energy: 0.3517961143114878
Energy: 1.0193780092123557
Energy: 0.35122009856186126
Energy: 0.44833129590072385
Energy: 0.3512200985608217
Energy: 0.8697787485172781
Energy: 0.35352822493082076
Energy: 0.6290003279444578
Energy: 0.3535282249303011
Energy: 0.8666526108531637
Energy: 0.34943291136123367
Energy: 0.6248263719431045
Energy: 0.34943291136435223
Energy: 0.8651180402334113
Energy: 0.3501029337899426
Energy: 0.6235027374145015
Energy: 0.3501029337909822
Energy: 0.7067497933601342
Energy: 0.3527392439273868
Energy: 0.7848855287072751
Energy: 0.35273924392998557
Energy: 0.7876207221140072
Energy: 0.3837225006716712
Energy: 0.6225136608531202
Energy: 0.3837225006716712
Energy: 0.7059549465687819
Energy: 0.3807929400153554
Energy: 0.7835457821106799
Energy: 0.3807929400158751
Energy: 0.7046676122934941
Energy: 0.3818184781161145
Energy: 0.8689156043925828
Energy: 0.381818478115075
Energy: 0.6280936580465694
Energy: 0.35258832689237796
Energy: 0.8402845694910659
Energy: 0.35258832689549646
Energy: 0.5378629346733197
Energy: 0.34961437355749153
Energy: 0.9395962310748164
Energy: 0.3496143735554125
Energy: 0.6230695579165665
Energy: 0.35032842086530425
Energy: 0.9409598569926053
Energy: 0.3503284208647845
Energy: 0.45135568532197207
Energy: 0.35372952953537934
Energy: 0.7886507649494751
Energy: 0.35372952953641884
Energy: 0.44296400005711317
Energy: 0.3499758103312007
Energy: 1.0177169441499803
Energy: 0.3499758103317204
Energy: 0.4493431204108983
Energy: 0.3529888488516659
Energy: 0.9427317380176129
Energy: 0.35298884885114623
Energy: 0.3551825262366988
Energy: 0.35282442460431823
Energy: 0.9454625067790279
Energy: 0.3528244246032788
Energy: 0.3500864936734858
Energy: 0.3503805700420911
Energy: 1.0169777361416399
Energy: 0.35038057004157136
Energy: 0.35791685321048183
Energy: 0.3523500790174228
Energy: 0.8667428988338989
Energy: 0.3523500790179426
Energy: 0.44963486382329
Energy: 0.351893231581018
Energy: 1.0213835551836965
Energy: 0.35189323158153774
Energy: 0.4418989453895122
Energy: 0.35008454224660496
Energy: 0.9392368264030193
Energy: 0.3500845422460852
Energy: 0.45144877661127825
Energy: 0.35316819936096566
Energy: 0.8691260207539755
Energy: 0.353168199362525
Energy: 0.6229454837793139
Energy: 0.35048306336601015
Energy: 0.8633509005849018
Energy: 0.35048306336549045
Energy: 0.6219627147994903
Energy: 0.34965052184018947
Energy: 0.9404576050096761
Energy: 0.3496505218427882
Energy: 0.6277341196703937
Energy: 0.35241502692438287
Energy: 0.733513009955409
Energy: 0.3524150269249027
Energy: 0.7856525704362466
Energy: 0.47062524815406215
Energy: 0.8695578287344441
Energy: 0.47062524815458184
Energy: 0.62398550744312
Energy: 0.3810525109725025
Energy: 0.7843379729881578
Energy: 0.38105251097198267
Energy: 0.7880199580074517
Energy: 0.38368432133390723
Energy: 0.7101393556195423
Energy: 0.3836843213333874
Energy: 0.7872450454174856
Energy: 0.35238374941379175
Energy: 0.784925317631763
Energy: 0.35238374942158796
Energy: 0.7849261859260763
Energy: 0.3503241425663019
Energy: 0.6229760272583702
Energy: 0.35032414257045996
Energy: 0.8648286983274557
Energy: 0.3497565752301392
Energy: 0.5374160164805963
Energy: 0.3497565752332341
Energy: 0.7899329168521102
Energy: 0.3541904806236676
Energy: 0.6277809873893345
Energy: 0.35419048061639113
Energy: 0.9416384267854037
Energy: 0.3515156158731297
Energy: 0.4472106574021295
Energy: 0.35151561587416924
Energy: 0.9386211937737332
Energy: 0.3513417887796748
Energy: 0.4490662290596623
Energy: 0.3513417887817538
Energy: 0.937450061890397
Energy: 0.3540784437046263
Energy: 0.36026708058171436
Energy: 0.3540784437046263
Energy: 0.9387074612275025
Energy: 0.3518686104878977
Energy: 0.3547536508407022
Energy: 0.3518686104883938
Energy: 1.0173622553876216
Energy: 0.35241927406058066
Energy: 0.352363464210909
Energy: 0.35241927406058066

minimum gb energy = 0.34943291136123367 eV
minimum distance =  2.62153220724476 Angstroms
sigma value = 85


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

Energy: 1.01521100739758
Energy: 0.3169140827837584
Energy: 0.318433116590545
Energy: 0.3304259616113076
Energy: 0.9428470934311011
Energy: 0.3177183675110462
Energy: 0.4027807107015143
Energy: 0.3177183675119478
Energy: 0.9082662629868591
Energy: 0.3174726238507615
Energy: 0.4026475236258096
Energy: 0.31747262384986
Energy: 0.7663435773461181
Energy: 0.3191941025278269
Energy: 0.5572107615614065
Energy: 0.3191941025282776
Energy: 0.9115679217066549
Energy: 0.31643727713481234
Energy: 0.5571860746886123
Energy: 0.3164372771379677
Energy: 0.7692699905956342
Energy: 0.316891221432738
Energy: 0.5579577216490644
Energy: 0.3168912214345412
Energy: 0.767439738368916
Energy: 0.31716603052759146
Energy: 0.701382882762783
Energy: 0.3171660305271407
Energy: 0.8392756833322054
Energy: 0.3173714933966759
Energy: 0.5535501746550141
Energy: 0.3173714933989298
Energy: 0.7690073080616443
Energy: 0.3170158963473968
Energy: 0.6992521741695834
Energy: 0.3170158963478476
Energy: 0.7710950027667003
Energy: 0.3686246533941685
Energy: 0.8383483982070974
Energy: 0.3686246533955208
Energy: 0.6994598603175572
Energy: 0.43662866886807383
Energy: 0.7380131572532335
Energy: 0.43662866886852464
Energy: 0.6307959335225717
Energy: 0.31722293252369127
Energy: 0.8384693622358245
Energy: 0.31722293251512645
Energy: 0.6989786343530076
Energy: 0.316677325284201
Energy: 0.8387121186542614
Energy: 0.31667732528375026
Energy: 0.5570680144908499
Energy: 0.3179504886033929
Energy: 0.6969176640999567
Energy: 0.3179504886024913
Energy: 0.47523840974778764
Energy: 0.31646316352087767
Energy: 0.9750791674191425
Energy: 0.31646316351952536
Energy: 0.5592665650219024
Energy: 0.3179719217193462
Energy: 0.8394661059146653
Energy: 0.31797192171844463
Energy: 0.40342937505168364
Energy: 0.3197598666989675
Energy: 0.8369818065240805
Energy: 0.3197598666998691
Energy: 0.3965726410285029
Energy: 0.31653958939167415
Energy: 0.910697948885675
Energy: 0.31653958939167415
Energy: 0.4002685035303412
Energy: 0.31668686585096467
Energy: 0.9732017511726475
Energy: 0.31668686585096467
Energy: 0.3167745698031436
Energy: 0.3171483692150023
Energy: 0.9732585855457841
Energy: 0.3171483692154531
Energy: 0.31732099057557034
Energy: 0.3165970688738486
Energy: 0.9769334743804514
Energy: 0.3165970688738486
Energy: 0.3171340120925978
Energy: 0.3193441322510996
Energy: 0.9052353068341322
Energy: 0.31934413225425506
Energy: 0.40336504807156737
Energy: 0.3183879392518816
Energy: 1.0403813298135995
Energy: 0.3183879392518816
Energy: 0.39834070811086614
Energy: 0.31653317593737584
Energy: 0.97584892453354
Energy: 0.31653317593827734
Energy: 0.40033722050027354
Energy: 0.3168065410944804
Energy: 0.766488457342675
Energy: 0.3168065410958327
Energy: 0.5574158691575899
Energy: 0.31682475964049817
Energy: 0.9751484925201502
Energy: 0.31682475964049817
Energy: 0.5574356917430444
Energy: 0.3166054206141982
Energy: 0.9077546743150258
Energy: 0.31660542061374747
Energy: 0.5572347356404632
Energy: 0.3180806074897952
Energy: 0.7678186548553321
Energy: 0.3180806074897952
Energy: 0.6995642971705861
Energy: 0.316481508799132
Energy: 0.9109221989063709
Energy: 0.3164815087928211
Energy: 0.7000342722611089
Energy: 0.31716970765789737
Energy: 0.7692040835361641
Energy: 0.3171697076606021
Energy: 0.7752911195427464
Energy: 0.3686822119030054
Energy: 0.6295403980932849
Energy: 0.36868221190210376
Energy: 0.6982753168537235
Energy: 0.368301885758477
Energy: 0.7743775248252825
Energy: 0.3683018857278445
Energy: 0.8397363532553428
Energy: 0.317167188526275
Energy: 0.6282437539705651
Energy: 0.317167188526275
Energy: 0.9114301983015014
Energy: 0.31735004315238896
Energy: 0.6292007569643252
Energy: 0.3173500431505858
Energy: 0.6967191075411671
Energy: 0.3181962209108754
Energy: 0.5570121335717751
Energy: 0.3181962209203417
Energy: 0.9762609211819467
Energy: 0.31652159532705054
Energy: 0.5564598973158198
Energy: 0.31652159532614893
Energy: 0.9749942893958378
Energy: 0.31694411757197966
Energy: 0.5573745689578434
Energy: 0.31694411757288127
Energy: 0.8369205635332758
Energy: 0.3197881965679712
Energy: 0.4006698138627444
Energy: 0.31978819656842195
Energy: 0.9760636729017788
Energy: 0.31643819124384776
Energy: 0.3978137464914929
Energy: 0.3164381912442985
Energy: 0.9731414715914746
Energy: 0.31673855101465503
Energy: 0.40373573874738017
Energy: 0.31673855101465503
Energy: 0.8360399530980281
Energy: 0.31934911737572863
Energy: 0.31679495389127815
Energy: 0.31934911737617944
Energy: 0.9768116194678166
Energy: 0.3164609319823949
Energy: 0.31696107181368344
Energy: 0.3164609319819441
Energy: 0.905403193712582
Energy: 0.3167018530145868
Energy: 0.3166295256519396
Energy: 0.316701853014136

minimum gb energy = 0.31643727713481234 eV
minimum distance =  2.62139825335954 Angstroms
sigma value = 113


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

Energy: 0.00971697105433401
Energy: 0.2762097814065641
Energy: 0.8043470057431908
Energy: 0.010285359219450431
Energy: 0.5895398912854851
Energy: 0.07097162722073236
Energy: 0.5904868249545646
Energy: 0.07097162722073236
Energy: 0.010299001229281873
Energy: 0.07036097761121463
Energy: 0.5901725949129288
Energy: 0.07036097761156117
Energy: 0.01100121771356557
Energy: 0.07174787501818514
Energy: 0.5918828212293556
Energy: 0.07174787501818514
Energy: 0.5936205848890661
Energy: 0.07180107842898709
Energy: 0.5934913061421541
Energy: 0.0718010784286598
Energy: 0.010174746445240565
Energy: 0.07016810073996246
Energy: 0.5925423258669774
Energy: 0.07016810073996246

minimum gb energy = 0.00971697105433401 eV
minimum distance =  2.85684083278316 Angstroms
sigma value = 1