Model name: model_name=EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620000052452088
cohesive_energy=3.5402783780697282
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.2894463229206397e-19, 2.31359112479502e-19, 2.8343786396767197e-19, 3.5391601192069794e-19, 4.1614775673852596e-19, 4.492855760595479e-19, 4.62119010897888e-19, 4.706906558897879e-19, 4.7931997924051195e-19, 4.87808311047444e-19, 4.96823758966962e-19, 5.062605793412219e-19, 5.15751873721038e-19, 5.24908313184348e-19, 5.33362999281966e-19, 5.408756055187919e-19, 5.47346796943518e-19, 5.527974018523859e-19, 5.57304324723828e-19, 5.60942867859642e-19, 5.63740268262606e-19, 5.65691719402818e-19, 5.668116408699839e-19, 5.67170528436e-19, 5.66814845223252e-19, 5.657894521774919e-19, 5.6417445813042e-19, 5.62025939264226e-19, 5.59201301858484e-19, 5.55131773208124e-19, 5.4890251045513195e-19, 5.396066816246639e-19, 5.26598609533218e-19, 5.0940404989713e-19, 4.87547156256102e-19, 4.604911994377439e-19, 4.2753122172309596e-19, 3.8725890985087196e-19, 3.3736712946811197e-19, 2.75827524956172e-19, 2.0641963099465799e-19, 1.359092792912886e-19, 5.43669801568488e-20, -6.71411344597308e-20, -2.0328417132191997e-19, -2.76058238391468e-19, -4.7799337698756e-20, 1.3162682136627e-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: 0.015405947086943948
Energy: 0.5205438392294003
Energy: 0.10532709268407803
Energy: 0.10475610118692544
Energy: 0.018941082593017737
Energy: 0.016721788871320573
Energy: 0.10444355428167636
Energy: 0.10582833192801064
Energy: 0.10441814286912122
Energy: 0.018320179705382057
Energy: 0.4329322100521425
Energy: 0.10937497521192929
Energy: 0.10450408286208678
Energy: 0.10649193661028249
Energy: 0.10646156401199006
Energy: 0.1042422049967947
Energy: 0.10840385318856283
Energy: 0.10442886748674364
Energy: 0.10669151917273237
Energy: 0.10572932868367134
Energy: 0.10695680348223036
Energy: 0.01954612915923486
Energy: 0.01585228710844827
Energy: 0.10443504589933217
Energy: 0.10486075779429473
Energy: 0.10593033028266942
Energy: 0.0185654978330516
Energy: 0.015808186030285522
Energy: 0.1047631150579619
Energy: 0.10553358414219018
Energy: 0.1051007224176642
Energy: 0.01697590127215842
Energy: 0.016899798589765175
Energy: 0.10671075088886134
Energy: 0.10439286820619285
Energy: 0.10580746523057985
Energy: 0.017311146863346644
Energy: 0.016065362957295996
Energy: 0.10555305932965642
Energy: 0.10421859300746109
Energy: 0.10475325105364429
Energy: 0.10431028451765505
Energy: 0.10641604752974645
Energy: 0.01738681115507441
Energy: 0.017280785511140363
Energy: 0.10466859659246239
Energy: 0.10481184008526415
Energy: 0.10601725217649217
Energy: 0.018260257742759838
Energy: 0.10510435248936993
Energy: 0.10766605737200825
Energy: 0.10444987758631907
Energy: 0.1053096473583528
Energy: 0.01659742052002238
Energy: 0.016507214646711284
Energy: 0.10801751253375139
Energy: 0.10397057578966273
Energy: 0.1059692787354001
Energy: 0.017282343373628748
Energy: 0.01677896288358168
Energy: 0.01673725878470444
Energy: 0.10778087888703587
Energy: 0.10522782381632968
Energy: 0.10535007760952539
Energy: 0.1070739603861471
Energy: 0.021218832093705196
Energy: 0.1035961448491479
Energy: 0.10511532029585717
Energy: 0.10624084860569057
Energy: 0.10662434942803009

minimum gb energy = 0.015405947086943948 eV
minimum distance =  2.52342729507137 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 0.8654865923835859
Energy: 0.8355329203778947
Energy: 0.8211430323705121
Energy: 0.8906211684938082
Energy: 1.0204315019082937
Energy: 0.8349686871071101
Energy: 0.8381117860281835
Energy: 0.8208475541497074
Energy: 0.8877946587540341
Energy: 0.7894835627650423
Energy: 0.9346931786448035
Energy: 0.8356504179325649
Energy: 0.7285495936267335
Energy: 0.7543351152244563
Energy: 0.7367284402873788
Energy: 0.9631454243350688
Energy: 0.8975014004375618
Energy: 0.7231004215934986
Energy: 0.7442676188392809
Energy: 0.7752933051865322
Energy: 0.9124518838751462
Energy: 0.77079508252146
Energy: 0.7593964260110847
Energy: 0.7231643650853481
Energy: 0.7384190942038928
Energy: 0.9018477491008488
Energy: 0.7694588125976703
Energy: 0.7324775258709356
Energy: 0.7221044805375544
Energy: 0.7991153406581797
Energy: 0.7288899825627398
Energy: 0.9071284842097229
Energy: 0.73134531988534
Energy: 0.7328276719136166
Energy: 0.7442566462499894
Energy: 0.7257212918136456
Energy: 0.9069661286763944
Energy: 0.8187308813136354
Energy: 0.7976576259170777
Energy: 0.8445423572692493
Energy: 0.9168927742425658
Energy: 0.9261024061989088
Energy: 0.747429873491631
Energy: 0.7670497019975829
Energy: 0.8494571371868037
Energy: 0.915776317131559
Energy: 0.8576418790642516
Energy: 0.7957104508169823
Energy: 0.789644682714988
Energy: 0.9077812691127563
Energy: 0.8831491818758233
Energy: 0.7619354876727368
Energy: 0.7398661031019707
Energy: 0.9315048613522848
Energy: 0.8993132077788807
Energy: 0.8908388502330203
Energy: 0.7584373788480913
Energy: 0.7373977812585675
Energy: 0.8973735578275475
Energy: 0.9309417862406262
Energy: 0.9247569406098496
Energy: 0.9661988690329073
Energy: 0.752264539043636
Energy: 0.8602058539520511
Energy: 0.9290123981724434
Energy: 0.9399290339532492
Energy: 0.7974191668382623
Energy: 0.821109765424272
Energy: 0.8592524572715229
Energy: 0.8483507802058736
Energy: 0.8571054703868415
Energy: 0.889893144433111
Energy: 0.6629811858626151
Energy: 0.8685272033349511
Energy: 0.9170255662435953
Energy: 0.8546480000110693
Energy: 0.9111737082815446
Energy: 0.8934581312111073
Energy: 0.8652941005294308
Energy: 0.7519609672230084
Energy: 0.7535078613065351
Energy: 0.7390127889527217
Energy: 1.0021119719838427
Energy: 0.8678339522147329
Energy: 0.7552081669824046
Energy: 0.7295723126360295
Energy: 0.6825692468468717
Energy: 0.9196164848369547
Energy: 0.8616954577994538
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Energy: 0.8023146988219378
Energy: 0.7412035850887747
Energy: 0.7405622896601052
Energy: 0.7514901932290522
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Energy: 0.7351252556251789
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Energy: 0.797290615502992
Energy: 0.8096636849308543
Energy: 0.7486745710042001
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Energy: 0.7580119746281053
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Energy: 0.8132385464589045
Energy: 0.7442653295276394
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Energy: 0.9091506731055635
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Energy: 0.8342130252645797
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Energy: 0.9950265773128214
Energy: 0.9343746871684369
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Energy: 0.8820189203367677
Energy: 0.9260348383999233
Energy: 0.9347681378599948
Energy: 1.0408825365067358
Energy: 0.8791859444317578
Energy: 0.8851668443479572
Energy: 0.8693403239854692
Energy: 0.889433542253148
Energy: 1.018271061406594
Energy: 0.8791973113244294
Energy: 0.8863311878557285
Energy: 0.8694841763168912
Energy: 0.8899530279755488
Energy: 0.6516209693451753
Energy: 0.9746533631211841
Energy: 0.884499398260354
Energy: 0.775848556733912
Energy: 0.7497603407892948
Energy: 0.6519750474782873
Energy: 0.918207736709073
Energy: 0.8840382898199797
Energy: 0.7746829011901653
Energy: 0.7530706521086069
Energy: 0.7434234041006001
Energy: 0.9107240161718635
Energy: 0.786274358415392
Energy: 0.8052258130414213
Energy: 0.7357412870913989
Energy: 0.7382439263780606
Energy: 0.9123983139528552
Energy: 0.774527805230593
Energy: 0.7751380697754209
Energy: 0.7406068352158769
Energy: 0.7522924106059077
Energy: 0.7688590761377816
Energy: 0.9680651958910899
Energy: 0.7545333843819463
Energy: 0.7023749773752667
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Energy: 0.9656044582030658
Energy: 0.7513754028937454
Energy: 0.7019538402565929
Energy: 0.743957310593174
Energy: 0.8820416177737228
Energy: 0.9231633438584387
Energy: 0.739555052295257
Energy: 0.811575085032589
Energy: 0.7575272157395536
Energy: 0.8806864087545375
Energy: 0.8832040556867493
Energy: 0.7390326735519427
Energy: 0.7376243709559952
Energy: 0.9154020052572619
Energy: 0.8687875373455666
Energy: 0.9168832974012888
Energy: 0.7945689665066875
Energy: 0.8875933625849913
Energy: 0.9107685333947211
Energy: 0.8838578491969432
Energy: 0.8708657686245391
Energy: 0.8970366146726341
Energy: 0.8797365958923836
Energy: 0.9327640003477454
Energy: 0.932464731101582
Energy: 0.7284427069622945
Energy: 0.8290512464509274
Energy: 0.904128757046087
Energy: 0.9230079145528787
Energy: 0.9687948595870974
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Energy: 0.9448127322867084
Energy: 0.9242773175964356
Energy: 0.8541717886006988
Energy: 0.9154264233483311
Energy: 0.7994017810250496
Energy: 0.8662786514010147
Energy: 0.9185364795920812
Energy: 0.8616637034613164
Energy: 0.8932764171176876
Energy: 0.647943928473142
Energy: 0.8684232123145652
Energy: 0.7580449237979012
Energy: 0.753652547744659
Energy: 0.6848970775992689
Energy: 0.9560457802491205
Energy: 0.9054488273465416
Energy: 0.751260522343334
Energy: 0.7576078787085377
Energy: 0.653637868855995
Energy: 1.0076861156448156
Energy: 0.8353739635909572
Energy: 0.7550725355222292
Energy: 0.754903395463067
Energy: 0.7386332192031804
Energy: 0.7505700979929135
Energy: 0.7818788800889104
Energy: 0.7578536860697656
Energy: 0.7520001171713323
Energy: 0.7501560579998309
Energy: 0.8015439921647391
Energy: 0.7973732967169604
Energy: 0.8012360566499576
Energy: 0.7498678464542434
Energy: 0.7431091834903506
Energy: 0.80973983402944
Energy: 0.7672763037784408
Energy: 0.7659247608076912
Energy: 0.746032573819318
Energy: 0.7443759929738119
Energy: 0.7512972102505092
Energy: 0.7934105001759592
Energy: 0.9385333497726908
Energy: 0.788161552497268
Energy: 0.8077557719737604
Energy: 0.7390483688738805
Energy: 0.8278708883338962
Energy: 0.9310257317854937
Energy: 0.7536832776915364
Energy: 0.747025905102084
Energy: 0.7722042625406155
Energy: 0.8390280081228567
Energy: 0.7898478679659441
Energy: 0.8171544158855926
Energy: 0.8973464953488844
Energy: 0.8951714770329932
Energy: 0.9171820512517508
Energy: 0.7392656355722127
Energy: 0.8656308470019547
Energy: 0.8720893506168227
Energy: 0.895180046774061
Energy: 0.909721664790196
Energy: 0.8503801725615039
Energy: 0.740105625842873
Energy: 0.9026190300325441
Energy: 0.9803416042650313
Energy: 0.9784125772655312
Energy: 0.7327841313440722
Energy: 0.7392591031423793
Energy: 0.8995292889307078
Energy: 0.9097624634844244
Energy: 0.9302112858305058
Energy: 0.9598107191089459
Energy: 0.7273225292752625
Energy: 0.8455828642301843
Energy: 0.8467514757392208
Energy: 0.8925512136562884
Energy: 0.8903990787800403
Energy: 0.8243128134620403
Energy: 0.8433671188682652
Energy: 0.8431600838454066
Energy: 0.9037668528232041

minimum gb energy = 0.647943928473142 eV
minimum distance =  2.30435205472667 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 2.172989341568294
Energy: 1.0359700233285498
Energy: 0.7954273341827941
Energy: 0.8164223772734219
Energy: 0.8405046256078859
Energy: 0.7023997456429139
Energy: 0.8028638562264004
Energy: 0.801358134453737
Energy: 0.8272878458955281
Energy: 0.9873025991904265
Energy: 0.836339252772499
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Energy: 0.8148693951811488
Energy: 0.8264710323658299
Energy: 0.7741002980645177
Energy: 0.7926424262839635
Energy: 0.7935211633071403
Energy: 0.8097673815975377
Energy: 0.8445030585659586
Energy: 0.7306170783160183
Energy: 0.8275114585369917
Energy: 0.8295184068913966
Energy: 0.7762465433446023
Energy: 0.7429222193254417
Energy: 0.781667584957373
Energy: 0.7924083847356068
Energy: 0.8221893504112316
Energy: 0.7773636099841462
Energy: 0.809633034288221
Energy: 0.7806358447714931
Energy: 0.8066941441424949
Energy: 0.7797899014352407
Energy: 0.7709066965120779
Energy: 0.7810818898563759
Energy: 0.7726751890826736
Energy: 0.7488739556901686
Energy: 0.8123811721666713
Energy: 0.777604393065118
Energy: 0.8579900914754925
Energy: 0.7800074884509591
Energy: 0.7685036500508947
Energy: 0.7216338699959742
Energy: 0.7717732362219623
Energy: 0.8470025714298768
Energy: 0.7859511609433663
Energy: 0.7888329677690804
Energy: 0.7299957956780951
Energy: 0.7706943901755077
Energy: 0.8644598841898747
Energy: 0.8476942736933841
Energy: 0.7227125837565225
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Energy: 0.83458104096956
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Energy: 0.8464430396160453
Energy: 0.743215545399967
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Energy: 0.7917582820142537
Energy: 0.8334468135660419
Energy: 0.8600462021268799
Energy: 0.766326357062787
Energy: 0.8423419829567044
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Energy: 0.8331733841211442
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Energy: 0.7821490062754496
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Energy: 0.8326916869503422
Energy: 0.9669415686175387
Energy: 0.8439738720940098
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Energy: 0.8132033268128087
Energy: 0.7836968515412773
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Energy: 0.7532439404942175
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Energy: 0.7408757141871013
Energy: 0.7822132331899706
Energy: 1.4686217580405816
Energy: 0.7899012908534417
Energy: 0.7249469228901647
Energy: 0.7429943163195112
Energy: 1.0377754914011097
Energy: 0.8312452086848815
Energy: 0.7874868461986602
Energy: 0.7207429570627273
Energy: 0.7250840317322733
Energy: 1.0386270329538538
Energy: 0.8286671411101175
Energy: 0.8177807487370699
Energy: 0.7434082848940256
Energy: 0.7281524241422973
Energy: 0.8110681297598401
Energy: 0.8349344151836584
Energy: 0.798752175568043
Energy: 0.7148397827438598
Energy: 0.7111394196683584
Energy: 0.8272926578321288
Energy: 0.8443996158665816
Energy: 0.7389044400408388
Energy: 0.7991674447304722
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Energy: 0.7958448819510149
Energy: 0.8237400847540527
Energy: 0.7643834870551856
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Energy: 0.8098004463171669
Energy: 0.7737216933231527
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Energy: 0.7912054385871921
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Energy: 0.8131430114096169
Energy: 0.7840989908993263
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Energy: 0.7684792793040325
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Energy: 0.7496956819867625
Energy: 0.817019911958698
Energy: 0.786436728279673
Energy: 0.7642539443029338
Energy: 0.833518311614637
Energy: 0.7284000918030624
Energy: 0.8531514643221795
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minimum gb energy = 0.6978688358227974 eV
minimum distance =  2.29914316795101 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.8769252024289476
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Energy: 1.0776901228802174
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Energy: 0.8176739086872615
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Energy: 0.821531292060972
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Energy: 0.9085674605444357
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Energy: 0.7947599425356919
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Energy: 0.8186365786148224
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Energy: 0.7596310251195799
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Energy: 0.827492085459034
Energy: 0.7988727500907908
Energy: 0.8577865778978617
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Energy: 0.8103048843779335
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Energy: 0.931159401319459
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Energy: 0.8313985979298281
Energy: 0.8069187354150492
Energy: 0.758426688381934
Energy: 0.8393413375067331
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Energy: 0.8172349187320449
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Energy: 0.7790144952678866
Energy: 0.8318986072452901
Energy: 0.8628748555172785
Energy: 0.8264840160386595
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Energy: 0.7966959496042696
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Energy: 0.8255322432911787
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Energy: 0.8422455274377996
Energy: 0.7600841520827242
Energy: 0.820141478705561
Energy: 0.8040428051930931
Energy: 0.8181308957223424
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Energy: 0.8036785747286496
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Energy: 0.946447210282098
Energy: 0.778403244358417
Energy: 0.7928811951991827
Energy: 0.8578671737008742
Energy: 0.8709438466317626
Energy: 0.8770249928184515
Energy: 0.808587998335902
Energy: 0.787918117930831
Energy: 0.8854687679044754
Energy: 0.8686187739047264
Energy: 0.8347434432515313
Energy: 0.8696747120257047
Energy: 0.8810753062001299
Energy: 0.7773018716574023
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Energy: 0.7800763210717551
Energy: 0.8794492395185614
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Energy: 0.7906587475853538
Energy: 0.9278380858228846
Energy: 0.7593234661660764
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Energy: 0.7592930399472259
Energy: 0.8701855763214701
Energy: 0.8634302582620845
Energy: 0.8038771241198529
Energy: 0.8093957795828727
Energy: 0.8541520310284255
Energy: 0.8549959367562684
Energy: 0.8586997311257861
Energy: 0.8391407490997019
Energy: 0.8872863581275608
Energy: 0.8840392323211548
Energy: 0.8531344085730617
Energy: 0.8606619430137473
Energy: 0.8453039571339884
Energy: 0.8727400785215975
Energy: 0.8210888427455925
Energy: 0.863230442522334
Energy: 0.8751136714803148
Energy: 0.8715476091749179
Energy: 0.8696455324868162
Energy: 0.8632878802851697
Energy: 0.8631390980005141
Energy: 0.8126166832236268
Energy: 0.8764223148199829
Energy: 0.8678569888669257
Energy: 0.8505827107176611
Energy: 0.8176165915616521
Energy: 0.8024485751088793
Energy: 0.8273755748406237
Energy: 0.9556776946527472
Energy: 0.863803082100929
Energy: 0.8349384871126772
Energy: 0.7963192938131608
Energy: 0.9046581439197198
Energy: 0.8286860948695443
Energy: 0.9028687394845348
Energy: 0.8056753163057284
Energy: 0.8629067509340352
Energy: 0.8621293283136116
Energy: 0.8222705468473864
Energy: 0.9011644720595049
Energy: 0.7481996440231048
Energy: 0.8613803942872458
Energy: 0.8631629003294783
Energy: 0.8407147573548871
Energy: 0.8722103260977959
Energy: 0.8193472648185853
Energy: 0.8659330404332047
Energy: 0.8645223123368995
Energy: 0.8475927997501973
Energy: 0.8344240242396828
Energy: 0.8193893491407216
Energy: 0.868242796548431
Energy: 0.8676248010636085
Energy: 0.8404326176249632
Energy: 0.863156291072038
Energy: 0.8820220001275831
Energy: 0.8977330375312942
Energy: 0.8987285023896793
Energy: 0.8990169050031369
Energy: 0.8124216385490056
Energy: 0.883638557762538
Energy: 0.9624917673481069
Energy: 0.8978475753898374
Energy: 0.9283747522566801
Energy: 0.8614413245267211
Energy: 0.8305573360499084
Energy: 0.8102154686718516
Energy: 0.8504309057115731
Energy: 0.8626960179543262
Energy: 0.8253612029109008
Energy: 0.8070148485564836
Energy: 0.8188256431076595
Energy: 0.8381218706401928
Energy: 0.8673631413492364
Energy: 0.8568841695402346
Energy: 0.8197227016099412
Energy: 0.8311819021722793
Energy: 0.8360125419092163
Energy: 0.8081892391343519
Energy: 0.852329234073318
Energy: 0.8070076250001648
Energy: 0.8326130687394372
Energy: 0.8078030636292479
Energy: 0.7815187060888957

minimum gb energy = 0.7379057268650245 eV
minimum distance =  2.31155976657827 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.0439578376330172
Energy: 0.8474314309762673
Energy: 0.7305796315918792
Energy: 0.7942292041127285
Energy: 0.8482783245871136
Energy: 0.9558337612571592
Energy: 0.7906147081560647
Energy: 0.7308418384631757
Energy: 0.7940556541203783
Energy: 0.8472502880597561
Energy: 0.8184470718702314
Energy: 0.8006750030333643
Energy: 0.7302295499801807
Energy: 0.7875953146872764
Energy: 0.791783716317717
Energy: 0.7892686092673635
Energy: 0.8014945223517361
Energy: 0.7866197535010501
Energy: 0.7882355661031304
Energy: 0.7864640394987239
Energy: 0.7953459171541047
Energy: 0.7972221143189651
Energy: 0.8706403595203355
Energy: 0.8004240767939689
Energy: 0.8478905174566596
Energy: 0.7945397626828589
Energy: 0.7986407627325852
Energy: 0.8012211522101859
Energy: 0.8003542989978277
Energy: 0.8030532466621189
Energy: 0.9290093358252066
Energy: 0.7943889089520292
Energy: 0.7974007362206077
Energy: 0.7997820065280025
Energy: 0.7210437538436001
Energy: 0.7969378636415785
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Energy: 0.7984194881074993
Energy: 0.8007346327841577
Energy: 0.7195302233389171
Energy: 0.7915863613738275
Energy: 0.7908604502139128
Energy: 0.7889597116162107
Energy: 0.7836919050150692
Energy: 0.7894721726710692
Energy: 0.7915281331698688
Energy: 0.7275888823164705
Energy: 0.7893267803402895
Energy: 0.784141265771262
Energy: 0.7873080761151182
Energy: 0.8912643293451009
Energy: 0.868568356896551
Energy: 0.8746179686621486
Energy: 0.7223739214090367
Energy: 0.7327534969374402
Energy: 0.9247512749802683
Energy: 0.7962246142749246
Energy: 0.8748042297255583
Energy: 0.7203064293043641
Energy: 0.7329680314846503
Energy: 0.7886829198030577
Energy: 0.8047716812136703
Energy: 0.7981035956065937
Energy: 0.7389823115207091
Energy: 0.8009848384509699
Energy: 0.7866004716888855
Energy: 0.8048217100035696
Energy: 0.7973861724492675
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Energy: 0.8480303600647493
Energy: 0.8163102864022223
Energy: 0.7883972195690181
Energy: 0.7322516713646808
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Energy: 0.7887663103294809
Energy: 1.0001828560633976
Energy: 0.7875021560355955
Energy: 0.7341239711863733
Energy: 0.7311100578229235
Energy: 0.7189639690883478
Energy: 0.7187177363749335
Energy: 0.7893032349636897
Energy: 0.7258207970619308
Energy: 0.7874139252770068
Energy: 0.7899607572955285
Energy: 0.7223754394364175
Energy: 0.7331322246486744
Energy: 0.7263081336385222
Energy: 0.7862806863303334
Energy: 0.8432943786943333
Energy: 0.8590100883549125
Energy: 0.7995030881712405
Energy: 0.795178983247353
Energy: 0.7907839400108981
Energy: 0.7998720388301243
Energy: 0.8651286795289157
Energy: 0.7983049707867127
Energy: 0.794647165787936
Energy: 0.7912504691027845
Energy: 0.7896273848974922
Energy: 0.8395580438101595
Energy: 0.7956754662390505
Energy: 0.7995004065232413
Energy: 0.7975032435332062
Energy: 1.0489484553282808
Energy: 0.8912946915602521
Energy: 0.7962324338835475
Energy: 0.7995059308719165
Energy: 0.7983341235285467
Energy: 0.7240430673711254
Energy: 0.8003513987432365
Energy: 0.7869876397105219
Energy: 0.7979342815309193
Energy: 0.7883925829439442
Energy: 0.8014453626949544
Energy: 0.801325682413578
Energy: 0.7893163191674255
Energy: 0.7988053594590554
Energy: 0.7884328928203526
Energy: 0.8015349229746095
Energy: 0.8475149731407251
Energy: 0.7927813357560133
Energy: 0.7866562772134871
Energy: 0.7890019714144848
Energy: 0.7429035526920199
Energy: 0.8474210025557511
Energy: 0.7918000253407711
Energy: 0.7863143225298592
Energy: 0.7901381683857469
Energy: 0.8761141028932248
Energy: 0.7905526378396687
Energy: 0.7953920694332768
Energy: 0.7323607922122973
Energy: 0.7189065950366299
Energy: 0.7866148464029691
Energy: 0.7887420088706295
Energy: 0.79462447056242
Energy: 0.7324622092306927
Energy: 0.7216904265283188
Energy: 0.7866436634694148
Energy: 0.794067913557176
Energy: 0.7911308299586113
Energy: 0.8010789474220305
Energy: 0.7334197732962058
Energy: 0.8015269957983382
Energy: 0.8466310823355419
Energy: 0.7904153199909388
Energy: 0.8005621020520843
Energy: 0.7327803349115256
Energy: 0.8003786900845163

minimum gb energy = 0.7187177363749335 eV
minimum distance =  2.33385233929054 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.8038519354321259
Energy: 0.7098403960663644
Energy: 0.6760568180466341
Energy: 0.7084296175884253
Energy: 0.6845318546433137
Energy: 1.7870433611902263
Energy: 0.7085911497122098
Energy: 0.6970995399671935
Energy: 0.7050450148971693
Energy: 0.7567072291977107
Energy: 0.7500966324856194
Energy: 0.6865372404766455
Energy: 0.683881930949448
Energy: 0.7073959295095016
Energy: 0.710844276583452
Energy: 0.7594798230377845
Energy: 0.6670016590413633
Energy: 0.6903009926233398
Energy: 0.7150027762895659
Energy: 0.7408066520690957
Energy: 0.7066822337843688
Energy: 0.7268242113323806
Energy: 0.7589029939222098
Energy: 0.7199865280724821
Energy: 0.7168145489909191
Energy: 0.7266856640129067
Energy: 0.7066775387354693
Energy: 0.7546392926224939
Energy: 0.7359864082644467
Energy: 0.7909377224975042
Energy: 0.737307455692496
Energy: 0.7212913836384232
Energy: 0.7355911544837994
Energy: 0.7205148632486437
Energy: 0.7320431695321323
Energy: 0.7297872535864504
Energy: 0.7079085840354767
Energy: 0.721391920044863
Energy: 0.7041719728873823
Energy: 0.7297251672867671
Energy: 0.7381972075683245
Energy: 0.6864185855999699
Energy: 0.7266107465150389
Energy: 0.7379374432217166
Energy: 0.7395437232492017
Energy: 0.731602936238455
Energy: 0.7249258795866749
Energy: 0.7055731103253294
Energy: 0.7068629308671408
Energy: 0.7545695894248142
Energy: 0.765739487119362
Energy: 0.7175371158338474
Energy: 0.748112871252988
Energy: 0.6694778799818202
Energy: 0.7061782175137812
Energy: 0.7768560297653536
Energy: 0.7137541326384129
Energy: 0.7395024478484631
Energy: 0.6688043447782945
Energy: 0.7236541009236547
Energy: 0.7589925865116137
Energy: 0.7375296813098986
Energy: 0.7237356311230834
Energy: 0.7006919003325922
Energy: 0.6848531600206543
Energy: 0.7708189239016748
Energy: 0.7219674723022478
Energy: 0.7224950019797429
Energy: 0.7023854848133894
Energy: 0.6861728077960213
Energy: 0.7027503459872521
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Energy: 0.7308020960593893
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Energy: 0.753888557488773
Energy: 0.6836440226784074
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Energy: 0.7274446991042973
Energy: 0.7221616505086794
Energy: 0.6883284541414884
Energy: 0.7486158939793266
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Energy: 0.7304040440551278
Energy: 0.723590508719676
Energy: 0.7237147918513857
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Energy: 0.7406976477543147
Energy: 0.6931107015011679
Energy: 0.6847842390874407
Energy: 0.6845249542264795
Energy: 0.7150336366635006
Energy: 0.7391836733462238
Energy: 0.7264966533752143
Energy: 0.683221322813689
Energy: 0.6889153889749541
Energy: 0.6977814433802779
Energy: 0.7433840578666052
Energy: 0.7257274094360983
Energy: 0.6724052701990052
Energy: 0.7059665516099028
Energy: 0.6863142046002136
Energy: 0.7859978365733412
Energy: 0.7229443515143609
Energy: 0.6698237633085735
Energy: 0.7060968629018649
Energy: 0.6871638188870821
Energy: 0.7569531675190831
Energy: 0.7266321568166565
Energy: 0.6832176595724213
Energy: 0.7096165271390055
Energy: 0.688844393150989
Energy: 0.7585879462441346
Energy: 0.6983992214928608
Energy: 0.7681513815205165
Energy: 0.7031062619095864
Energy: 0.7226541449856629
Energy: 0.7360264585442022
Energy: 0.6987466171235155
Energy: 0.7715989252722942
Energy: 0.6707592256059872
Energy: 0.7238053982604769
Energy: 0.7344552436105992
Energy: 0.6926537713085258
Energy: 0.6975721742149119
Energy: 0.6984887694876265
Energy: 0.7527161773876504
Energy: 0.7297576054751153
Energy: 0.6917238401268488
Energy: 0.6993619979942753
Energy: 0.6992098042439343
Energy: 0.753491701385135
Energy: 0.729606903559671
Energy: 0.7349183446316988
Energy: 0.7014714879074273
Energy: 0.6974961886374773
Energy: 0.7727442671475981
Energy: 0.6851531284793813
Energy: 0.6967923398491147
Energy: 0.7022942371095756
Energy: 0.7284948921369336
Energy: 0.729459603539334
Energy: 0.7606629091588589
Energy: 1.1314362577235437
Energy: 0.7213621242698276
Energy: 0.7283823619840513
Energy: 0.7297072057631415
Energy: 0.7215019102243092
Energy: 0.7195572135609339
Energy: 0.7212295783077101
Energy: 0.7281688952257717
Energy: 0.7286850302434921
Energy: 0.7214806219394817
Energy: 0.7296109530450274
Energy: 0.7215768263531832
Energy: 0.6983648112563996
Energy: 0.7274702808507258
Energy: 0.7370777330734111
Energy: 0.7288672332793746
Energy: 0.7215670844980119
Energy: 0.7000073725964303
Energy: 0.7483412699037743
Energy: 0.7176389107857245
Energy: 0.72443894050824
Energy: 0.7227036556085316
Energy: 0.7629734736084894
Energy: 0.7671399158409341
Energy: 0.7360527134087408
Energy: 0.7222801088707648
Energy: 0.7223907146256242
Energy: 0.7553820785453417
Energy: 0.8144705499017234
Energy: 0.7002233171013454
Energy: 0.7536883279163674
Energy: 0.7297005944641851
Energy: 0.7003790195234655
Energy: 0.7289242693221517
Energy: 0.7225374755312692
Energy: 0.7586333274778694
Energy: 0.7809127755797086
Energy: 0.7005812891043464
Energy: 0.7249023150131398
Energy: 0.7304132221014661
Energy: 0.7408422224033807
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Energy: 0.7328804673873114
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Energy: 0.7509067607624157
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Energy: 0.7287918591651464
Energy: 0.7253306127863917
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Energy: 0.6715496523136071
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Energy: 0.7132490542278617
Energy: 0.7391268289993501
Energy: 0.7505003730957391
Energy: 0.7059522967100854
Energy: 0.8555941019336721
Energy: 0.7225339909472294
Energy: 0.7394684389255204
Energy: 0.6699709129932195
Energy: 0.6650399835841158
Energy: 0.6843645651925048
Energy: 0.7218609627283238
Energy: 0.7383946027831536
Energy: 0.7049998890156215
Energy: 0.6868422686811354
Energy: 0.6872344441759298
Energy: 0.6706132087018487
Energy: 0.7963479598952097
Energy: 0.666864836389867
Energy: 0.7210759549330324
Energy: 0.7208684355822562
Energy: 0.6704373785043364
Energy: 0.8049918319333478
Energy: 0.7011399714911329
Energy: 0.6766268551348341
Energy: 0.7135822853280627
Energy: 0.7109190021369152
Energy: 0.750532089851491
Energy: 0.7101011105424357
Energy: 0.6987163678841196
Energy: 0.6661273897574004
Energy: 0.7264017667542757
Energy: 0.7450883888425832
Energy: 0.7018095813200662
Energy: 0.7214412566839686
Energy: 0.6853983288302669
Energy: 0.7019381245660764
Energy: 0.6911456150217637
Energy: 0.7664556109936064
Energy: 0.7659333627669968
Energy: 0.7157429051638307
Energy: 0.6967004595062329
Energy: 0.6770321081293041
Energy: 0.7535566269260433
Energy: 0.6845565908738724
Energy: 0.7019621514865683

minimum gb energy = 0.6650399835841158 eV
minimum distance =  2.33061352443363 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.4681219946717295
Energy: 0.3265433962213913
Energy: 0.34521482342902066
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Energy: 0.5481826738912656
Energy: 0.32636453296359724
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Energy: 0.32149483200850504
Energy: 0.3357957625146036
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Energy: 0.33057956068791233
Energy: 0.4624525264364791
Energy: 0.33141845087700544
Energy: 0.32369302878459116
Energy: 0.3204180542218026
Energy: 0.34355953195267513
Energy: 0.525592214035371
Energy: 0.33937624042185205
Energy: 0.33749980146103875
Energy: 0.356353678210917
Energy: 0.4879869995290204
Energy: 0.4909182092017063
Energy: 0.3301672855641926
Energy: 0.44671764535044145
Energy: 0.31616782629150797
Energy: 0.5658500560510058
Energy: 0.5680088129264927
Energy: 0.32832902905445843
Energy: 0.3206907668368407
Energy: 0.34764469383622093
Energy: 0.43673678453738757
Energy: 0.32408076595311625
Energy: 0.3304178887885258
Energy: 0.3458739255274213
Energy: 0.3164984200125725
Energy: 0.3228430188486257
Energy: 0.3243079942831396
Energy: 0.3433476437571392
Energy: 0.35852462430450815
Energy: 0.31589175079346743
Energy: 0.6419731834835303
Energy: 0.34359163217058936
Energy: 0.3459032961627391
Energy: 0.3247142130224528
Energy: 0.3310045638466526
Energy: 0.4861235724539001
Energy: 0.34406214416760966
Energy: 0.3718584091025163
Energy: 0.3204006410507713
Energy: 0.6520521293601294

minimum gb energy = 0.31307184251770537 eV
minimum distance =  2.36706534058111 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.8240074935389221
Energy: 0.6263905292060917
Energy: 0.6521005155849107
Energy: 0.6171148476576648
Energy: 0.6447674936182016
Energy: 0.7541400995582229
Energy: 0.627465579974634
Energy: 0.6495457633825811
Energy: 0.6170876050111761
Energy: 0.6980776640723512
Energy: 0.6304295953651378
Energy: 0.6288463949334626
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Energy: 0.6152091986383365
Energy: 0.6300002705819362
Energy: 0.6302906322684309
Energy: 0.613999580721613
Energy: 0.614305635543977
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Energy: 0.6292506721265514
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Energy: 0.614040517836582
Energy: 0.6150678959385807
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Energy: 0.6240070461378636
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Energy: 0.6228299864183688
Energy: 0.6299296085224434
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Energy: 0.6265580090795092
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Energy: 0.6308004481585101
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Energy: 0.6921639374248801
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Energy: 0.6270583412241111
Energy: 0.6297733109299631
Energy: 0.6295875321484687
Energy: 0.6917463366397687
Energy: 0.7488165345798139
Energy: 0.6242990505340608
Energy: 0.6296998826850262
Energy: 0.6139340627479424
Energy: 0.7449720913185416
Energy: 0.745251019029556
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Energy: 0.6319305349848099
Energy: 0.6991092437018674
Energy: 0.6477697052306244
Energy: 0.6293358565397438
Energy: 0.6292738889039826
Energy: 0.6830819194058001
Energy: 0.6993199560645209
Energy: 0.654847404959903
Energy: 0.6313330396965532
Energy: 0.6290298567301655
Energy: 0.6831669777504407
Energy: 0.6302038760326153
Energy: 0.6566127511184932
Energy: 0.6827556023429326
Energy: 0.6268325365760605
Energy: 0.6296368012934747
Energy: 0.6302557055907644
Energy: 0.6662710647827123
Energy: 0.6829211670599517
Energy: 0.6264224459141227
Energy: 0.6294797412017543
Energy: 0.6296798377991359
Energy: 0.6300459525268114
Energy: 0.6231438042278435
Energy: 0.61619385167317
Energy: 0.6281934694899834
Energy: 0.6312422636533516
Energy: 0.6297164294628183
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Energy: 0.616751333911702
Energy: 0.629376424543957
Energy: 0.6226005493368023
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Energy: 0.6211860466283626
Energy: 0.6979078687646837
Energy: 0.6322143529491194
Energy: 0.6254720172674506
Energy: 0.6166852530940511
Energy: 0.6210330427849167
Energy: 0.6982726562287075

minimum gb energy = 0.6086666642231059 eV
minimum distance =  2.33661072943837 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.2293526400707722
Energy: 0.8696951853589863
Energy: 0.8279209010176641
Energy: 0.8231250898410497
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Energy: 0.7923904181748829
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Energy: 0.7920950329525902
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Energy: 0.8570042568351075
Energy: 0.8443123766989705
Energy: 0.7957653251220866
Energy: 0.7926514786656405
Energy: 0.7888856193375451
Energy: 0.8324868235172023
Energy: 0.7939963280861723
Energy: 0.7954008143512803
Energy: 0.7934291422775286
Energy: 0.8343030820073511
Energy: 0.8218259957702567
Energy: 0.8593492558995383
Energy: 0.8286780957531271
Energy: 0.7976379544493971
Energy: 0.8344445025895854
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Energy: 0.7960800243796768
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Energy: 0.7985142594321272
Energy: 0.834861325294937
Energy: 0.8222458565127788
Energy: 0.8313005885083786
Energy: 0.8339616397512613
Energy: 0.7769949328414358
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Energy: 0.8359595299100262
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Energy: 0.7792997119565482
Energy: 0.7772536245819408
Energy: 0.838314588940292
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Energy: 0.8437091373363962
Energy: 0.8338263102694623
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Energy: 0.8432900109125075
Energy: 0.8291905322622503
Energy: 0.834624157599553
Energy: 0.8307933968965074
Energy: 0.865746369650811
Energy: 0.7994511349718071
Energy: 0.8006797037905589
Energy: 0.865346552508918
Energy: 0.8422669561400747
Energy: 0.8696795411865629
Energy: 0.799045109067835
Energy: 0.7989387596049122
Energy: 0.8650827858445035
Energy: 0.7956728503460091
Energy: 0.871482846541384
Energy: 0.8448420666564787
Energy: 0.7988320436556761
Energy: 0.8402292278759522
Energy: 0.8254109959870907
Energy: 0.844346518503422
Energy: 0.845592976964922
Energy: 0.7978644512675829
Energy: 0.8390565243830143
Energy: 0.8337999152277579
Energy: 0.842007719842709
Energy: 0.8491634088517677
Energy: 0.8360709313353136
Energy: 0.7955743191051878
Energy: 0.7957981641263074
Energy: 0.8296668463004777
Energy: 0.8594273470022179
Energy: 0.835100616775548
Energy: 0.7947609626465327
Energy: 0.7967631136294514
Energy: 0.8301542747891428

minimum gb energy = 0.7769949328414358 eV
minimum distance =  2.34829295632861 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.625528550838972
Energy: 0.8770370153530397
Energy: 0.9177153454892248
Energy: 0.9270184238910995
Energy: 0.8968274543295316
Energy: 1.6156366033993217
Energy: 0.8847362204728006
Energy: 0.922571804258848
Energy: 0.9287463178707858
Energy: 0.8997939489154526
Energy: 0.9074190680431237
Energy: 0.8918811138985491
Energy: 0.8845647787276963
Energy: 0.8954141765937111
Energy: 0.9323672884879768
Energy: 0.8976161141267276
Energy: 0.888650110003421
Energy: 0.8845075929406389
Energy: 0.8965413735160391
Energy: 0.902647121206141
Energy: 0.9304758917789855
Energy: 0.9014962290731116
Energy: 0.9052374759137624
Energy: 0.9251033359112129
Energy: 0.8845195809589406
Energy: 0.9523767188855707
Energy: 0.8994795430628599
Energy: 0.9068564978752647
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minimum gb energy = 0.8535954076075047 eV
minimum distance =  2.3173369486504 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.9152316123670083
Energy: 0.901652546815047
Energy: 0.87155887437916
Energy: 0.9025528809544472
Energy: 0.8736004999153884
Energy: 0.8785898027826985
Energy: 0.8969729136643136
Energy: 0.9040072600765777
Energy: 0.9015475924175738
Energy: 0.9147620331407587
Energy: 0.8773717424515631
Energy: 0.8978183809626668
Energy: 0.8796477147956119
Energy: 0.8848559933930397
Energy: 0.9427720844075295
Energy: 0.8790336449600088
Energy: 0.8880195239914181
Energy: 0.9196094275844676
Energy: 0.8635394990836608
Energy: 0.9431083211639253
Energy: 0.878685844453112
Energy: 0.8880871239257526
Energy: 0.9094881783483558
Energy: 0.9152776170100012
Energy: 0.8718171231171421
Energy: 0.8737369342413571
Energy: 0.8674463328167558
Energy: 0.9104656409935148
Energy: 0.9450448498139221
Energy: 0.871528312994718
Energy: 0.8718786515555048
Energy: 0.897699227835562
Energy: 0.8284486311115166
Energy: 0.8919998031478031
Energy: 0.9201387630622055
Energy: 0.8782292439049421
Energy: 0.8693993800737081
Energy: 0.8272342904528859
Energy: 0.8924736277058355
Energy: 0.9190797319875621
Energy: 0.8786840079841667
Energy: 0.8700157522207891
Energy: 0.9241871458525225
Energy: 0.8786632149287082
Energy: 0.8664476165851764
Energy: 0.8730953690521847
Energy: 0.8546598352782863
Energy: 0.8829586165221892
Energy: 0.877894374798381
Energy: 0.8666470584141122
Energy: 0.8723977531936852
Energy: 0.8806867366125883
Energy: 0.8663802781517285
Energy: 0.8640855397101922
Energy: 0.8897874696858331
Energy: 0.9156903573986391
Energy: 0.9026817532484814
Energy: 0.8650477891524397
Energy: 0.8540251808012937
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Energy: 0.9164019320355107
Energy: 0.902838533924879
Energy: 0.91574320534732
Energy: 0.8391833899425001
Energy: 0.8312541301651661
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Energy: 0.9031043122472517
Energy: 0.9064973302846656
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Energy: 0.8314773424393055
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Energy: 0.9055465798291659
Energy: 0.9603911909981453
Energy: 0.8319824400614102
Energy: 0.8753916890940783
Energy: 0.8988474881203226
Energy: 0.8857362709649287
Energy: 0.9140576663116633
Energy: 0.8314324174709129
Energy: 0.892400829507453
Energy: 0.898131927431104
Energy: 0.8777081208501054
Energy: 0.9014668047663805
Energy: 0.8828211382919164
Energy: 0.9115659857721552
Energy: 0.8739715938313997
Energy: 0.8712793864973748
Energy: 0.9018650620240178
Energy: 0.8840218329988783
Energy: 0.9118626997991341
Energy: 0.8872988123293318
Energy: 0.8718957743771222
Energy: 0.8604915771775565
Energy: 0.89157418753219
Energy: 0.9267870027103853
Energy: 0.9031041959915422
Energy: 0.9153162083934195
Energy: 0.859016601651257
Energy: 0.8500777425898403
Energy: 0.9261128901947704
Energy: 0.9031415336556101
Energy: 0.9170422634838991
Energy: 0.9027402591202015
Energy: 0.8910222827179601
Energy: 0.8740232210630977
Energy: 0.9138852428088288
Energy: 0.9029088527039232
Energy: 0.8634520690869304
Energy: 0.8915902992629401
Energy: 0.8735697292662299
Energy: 0.913248201459954
Energy: 0.8734867047199484
Energy: 0.8856590004743804
Energy: 0.9292571937830775
Energy: 0.8999938928215174
Energy: 0.9008199439517276
Energy: 0.8837687316938326
Energy: 0.885109396923475
Energy: 0.8807660969578385
Energy: 0.8656050983355655
Energy: 0.8856834809907799
Energy: 0.9190565484982328
Energy: 0.9138270449513491
Energy: 0.871575550030666
Energy: 0.8715111150138862
Energy: 0.9075244646162492
Energy: 0.8736227908802943
Energy: 0.9102972121460304
Energy: 0.8720563723193095
Energy: 0.8682673445013547
Energy: 0.8904343815002137
Energy: 0.8726880788913253
Energy: 0.8792975797775505
Energy: 0.9210848724895625
Energy: 0.8265301991291762
Energy: 0.8356111414532335
Energy: 0.884356562389012
Energy: 0.8786093608785854
Energy: 0.9224251756590938
Energy: 0.8268751486790819
Energy: 0.8308004926151176
Energy: 0.8849709775780114
Energy: 0.8710894862984245
Energy: 0.9139313076847192
Energy: 0.8939813624015122
Energy: 0.9003950340309931
Energy: 0.8744527609052255
Energy: 0.8743704033880692
Energy: 0.9477606868159134
Energy: 0.8946362952988918
Energy: 0.9007956330235112
Energy: 0.8726459994797116
Energy: 0.8964643189925195
Energy: 0.8752561923708375
Energy: 0.8651296974557754
Energy: 0.9165780101785126
Energy: 0.8792263536749736
Energy: 0.8962231638714808
Energy: 0.874458064957297
Energy: 0.8658160625016348
Energy: 0.9154019612783235
Energy: 0.879374088996597
Energy: 0.8315649887754331
Energy: 0.8785944387001698
Energy: 0.8650537535622221
Energy: 0.9015760186529772
Energy: 0.8335021334789025
Energy: 0.9060470350414566
Energy: 0.9197501029256077
Energy: 0.8640263847571356
Energy: 0.90331958545011
Energy: 0.832737545835105
Energy: 0.9063841274468716
Energy: 0.879963696298991
Energy: 0.8647602005726536
Energy: 0.9405783710604897
Energy: 0.8321332018209245
Energy: 0.9046150906662954
Energy: 0.8801519731193325
Energy: 0.8651920282125181
Energy: 0.9428095131972112
Energy: 0.8324847216791434
Energy: 0.9112921700338029
Energy: 0.873036337134704
Energy: 0.8746048911192734
Energy: 0.8887079757016157
Energy: 0.855856062632569
Energy: 0.87303777526533
Energy: 0.8709468268430982
Energy: 0.8784469276372187
Energy: 0.919100478964116
Energy: 0.8965413965179939
Energy: 0.9250730210773631
Energy: 0.9048413716844829
Energy: 0.9167257666212294
Energy: 0.8594835314979934
Energy: 0.8489827917576704
Energy: 0.8805863478271981
Energy: 0.9065726398094593
Energy: 0.9157344228308519
Energy: 0.891550555643277
Energy: 0.8486694966836031
Energy: 0.8731481866556361
Energy: 0.9129146491873865
Energy: 0.8754300798950698
Energy: 0.8839077325492851
Energy: 0.8650305668170457
Energy: 0.9028877599789149
Energy: 0.9037378913886335
Energy: 0.877914648707173
Energy: 0.8833500192953476
Energy: 0.8807475756914372
Energy: 0.9239440698128327
Energy: 0.8613334313600837
Energy: 0.9460843149830018
Energy: 0.8778132660498073
Energy: 0.9005548587562964
Energy: 0.9225752076544438
Energy: 0.9280867251357668
Energy: 0.9435873741943978
Energy: 0.878232836942234
Energy: 0.8887096701700883
Energy: 0.8275349399295601
Energy: 0.9132353701168463
Energy: 0.8710428768634759
Energy: 0.8841061377472959
Energy: 0.8831089991960797
Energy: 0.8278099459292878
Energy: 0.9127618792492151
Energy: 0.8705811608173694
Energy: 0.8874677747910001
Energy: 0.8353488162683889

minimum gb energy = 0.8264913783233122 eV
minimum distance =  2.32902157779897 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.8292121045470885
Energy: 0.8756038542516226
Energy: 0.8877116018598135
Energy: 0.8566180677161535
Energy: 0.8211111725537713
Energy: 0.8293641425281956
Energy: 0.855715415456447
Energy: 0.8870233755892509
Energy: 0.9027220180869816
Energy: 0.8208265349327517
Energy: 0.9093796958694498
Energy: 0.8425951569330055
Energy: 0.8308374123831548
Energy: 0.8398189294401399
Energy: 0.8546636474060367
Energy: 0.8833341821241965
Energy: 0.8395731690295061
Energy: 0.8267029135809014
Energy: 0.8413340804809547
Energy: 0.8549781835305548
Energy: 0.8554335046469452
Energy: 0.8444890669577847
Energy: 0.8369150646101559
Energy: 0.886403746986051
Energy: 0.8777823690266243
Energy: 0.8407527484489377
Energy: 0.8423668031920017
Energy: 0.8342467530183801
Energy: 0.8875736388553308
Energy: 0.9017181913867371
Energy: 0.846763779956949
Energy: 0.8644100245056244
Energy: 0.8205170331095192
Energy: 0.851878320905562
Energy: 0.8432100461834375
Energy: 0.8835338585385913
Energy: 0.8652111746963961
Energy: 0.8205286200793614
Energy: 0.8531551795467966
Energy: 0.8240299153046658
Energy: 0.8567028376415173
Energy: 0.822368976927306
Energy: 0.8243838744828436
Energy: 0.8886215652988796
Energy: 0.8388865163022295
Energy: 0.8542541699884519
Energy: 0.8212847763878048
Energy: 0.8224745903097005
Energy: 0.8905571303944472
Energy: 0.8389119841779309
Energy: 0.8404745280491428
Energy: 0.8814826381557103
Energy: 0.8564806605587525
Energy: 0.8373452763319552
Energy: 0.8257839085146429
Energy: 0.8411916982795383
Energy: 0.8889215050028035
Energy: 0.8568126981797581
Energy: 0.8378998927153006
Energy: 0.8252797124523701
Energy: 0.8459331766934978
Energy: 0.8192346844355737
Energy: 0.8400761547788839
Energy: 0.8844989567718538
Energy: 0.8917425318903377
Energy: 0.8461157753584104
Energy: 0.8178590930633417
Energy: 0.8393632676829842
Energy: 0.8829175116986625
Energy: 0.9104141136267848
Energy: 0.8550352789395662
Energy: 0.8999410524160287
Energy: 0.8794928084716678
Energy: 0.828459426458428
Energy: 0.8213525130083589
Energy: 0.9006526475252767
Energy: 0.9082600026118708
Energy: 0.8792436864940223
Energy: 0.8305439214359475
Energy: 0.824080725818837
Energy: 0.8323184104055685
Energy: 0.8271046741999825
Energy: 0.851344368774414
Energy: 0.8208465565609256
Energy: 0.8817353979910789
Energy: 0.8319275183377555
Energy: 0.8379447504126921
Energy: 0.8510334104366174
Energy: 0.8217816751715769
Energy: 0.8747049383585528
Energy: 0.8380350199686621
Energy: 0.8381208586380792
Energy: 0.8836280423327981
Energy: 0.9021745480875413
Energy: 0.9417702771925722
Energy: 0.837407077998287
Energy: 0.83836196759788
Energy: 0.8575432396068331
Energy: 0.9008023587181766
Energy: 0.9387101484628817
Energy: 0.8730281130391282
Energy: 0.854719706083802
Energy: 0.8378238703324451
Energy: 0.8429651174887293
Energy: 0.8968460906822605
Energy: 0.8730754476706944
Energy: 0.8545788232678664
Energy: 0.8267704452760201
Energy: 0.8491790570479112
Energy: 0.8988671421041382
Energy: 0.829805004210435
Energy: 0.8561095889890746
Energy: 0.8873067154433741
Energy: 0.8580116134039225
Energy: 0.821191388092424
Energy: 0.8301423819621048
Energy: 0.8557747400364336
Energy: 0.8873542671726147
Energy: 0.8569407106090734
Energy: 0.8209118830651582
Energy: 0.8799598173235971
Energy: 0.8390735880087224
Energy: 0.829879245889294
Energy: 0.8403503009875933
Energy: 0.8546309777507375
Energy: 0.8996379073566253
Energy: 0.8325705991028238
Energy: 0.8268446286085189
Energy: 0.8409771290069398
Energy: 0.8548254493887658
Energy: 0.8556762788173606
Energy: 0.9394863415662086
Energy: 0.8379848748009997
Energy: 0.8867702091255304
Energy: 0.8776167880278428
Energy: 0.8535637701622016
Energy: 0.8416863730470729
Energy: 0.8349139394492068
Energy: 0.8873930351910644
Energy: 0.9086186182075193
Energy: 0.8470132074436357
Energy: 0.8842900028509606
Energy: 0.8203238550423825
Energy: 0.8514077440979526
Energy: 0.8449542029601207
Energy: 0.8833642567905249
Energy: 0.8672341228414947
Energy: 0.8203275872162055
Energy: 0.8529203965172159
Energy: 0.8763727313547407
Energy: 0.8569846139032424
Energy: 0.8227077800223127
Energy: 0.8251893548559699
Energy: 0.8881207051862866
Energy: 0.8384227633333391
Energy: 0.8544348933396603
Energy: 0.8218485745615545
Energy: 0.8230225436811206
Energy: 0.8906108428748776
Energy: 0.8386920148416646
Energy: 0.839795335248318
Energy: 0.8816750549061293
Energy: 0.9083587325419679
Energy: 0.8328219437780607
Energy: 0.8260737947338465
Energy: 0.8410035069333142
Energy: 0.8871369566786635
Energy: 0.858148980819394
Energy: 0.8373657820187831
Energy: 0.8258677381559117
Energy: 0.8436738245318725
Energy: 0.8191597953413481
Energy: 0.8400885840159754
Energy: 0.8843806316725152
Energy: 0.892302137592229
Energy: 0.8477376544320864
Energy: 0.8181006842300144
Energy: 0.839470210408669
Energy: 0.8835627021715029
Energy: 0.909424877621094
Energy: 0.8983679101558711
Energy: 0.9049433030201902
Energy: 0.8827925406477036
Energy: 0.8275545706168157
Energy: 0.8212472053026751
Energy: 0.9006519184505336
Energy: 0.8827906920795153
Energy: 0.8801614842856177
Energy: 0.8304416201719994
Energy: 0.823840162467755
Energy: 0.8321453968773836
Energy: 0.8271525721731151
Energy: 0.8517881514819488
Energy: 0.8213089968646223
Energy: 0.8752876267900993
Energy: 0.831845405399734
Energy: 0.8380181248773576
Energy: 0.8517256734901573
Energy: 0.8211561771966577
Energy: 0.8815308964671638
Energy: 0.8380612806868345
Energy: 0.8382197961939769
Energy: 0.8832589506158298
Energy: 0.901527593050775
Energy: 0.9420608220882638
Energy: 0.837804571829608
Energy: 0.8390741196915522
Energy: 0.8575091466107406
Energy: 0.9008555089833599
Energy: 0.9406674368153256
Energy: 0.8832676179424688
Energy: 0.8545209709208546
Energy: 0.8374196514657142
Energy: 0.84046087721317
Energy: 0.8984661088437785
Energy: 0.883998390132569
Energy: 0.8543795264091321
Energy: 0.8261242924228941
Energy: 0.8437718964425666
Energy: 0.8986975592490131

minimum gb energy = 0.8178590930633417 eV
minimum distance =  2.37331505058881 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.94640277325047
Energy: 0.92561214690083
Energy: 0.9296809427523911
Energy: 0.9491458066828715
Energy: 0.9470986739528464
Energy: 0.860547992815736
Energy: 0.9151606695230823
Energy: 0.932616272119417
Energy: 0.9409713951125835
Energy: 0.9024189907953677
Energy: 0.8896468975427401
Energy: 0.864636994081835
Energy: 0.8915917889738109
Energy: 0.9216638479086975
Energy: 0.9211982232318634
Energy: 0.866696992666357
Energy: 0.8733020032116721
Energy: 0.8919152854982785
Energy: 0.9589650956164785
Energy: 0.8814767294390048
Energy: 0.8668985049534208
Energy: 0.9308303850035671
Energy: 0.8756488028618626
Energy: 0.9206274844292529
Energy: 0.8859828084255429
Energy: 0.8650937664491181
Energy: 0.9104641427167407
Energy: 0.8898874567316095
Energy: 0.879334061333913
Energy: 1.1403401341822923
Energy: 0.8993917266472549
Energy: 0.9000162051478681
Energy: 1.0002591632536302
Energy: 0.8815965356123941
Energy: 1.0137952463579485
Energy: 0.9187155404459201
Energy: 0.858799990469028
Energy: 0.9907103836239851
Energy: 0.9972836880941737
Energy: 0.8680496283593823
Energy: 1.0234341889720253
Energy: 0.8661098781556859
Energy: 0.893120085925709
Energy: 0.9124908081520344
Energy: 0.9213579673889695
Energy: 1.0264721938050663
Energy: 0.840768444850661
Energy: 0.8884000057519561
Energy: 0.8884648510827701
Energy: 0.9656753680829818
Energy: 0.8807128927777539
Energy: 0.8568482092944988
Energy: 0.8701673735339407
Energy: 0.8546424389957666
Energy: 1.2247153651693967
Energy: 0.9006938831973837
Energy: 0.857515564849427
Energy: 0.8680134075588495
Energy: 0.8785221949669968
Energy: 1.0167437546143525
Energy: 0.8608872347306773
Energy: 0.8584749353226429
Energy: 0.8645753195125897
Energy: 0.8733022049925652
Energy: 0.9146541612854256
Energy: 0.8606238843618835
Energy: 0.8565880029515313
Energy: 0.8615391295527955
Energy: 0.8510364033947024
Energy: 0.9644982105012747
Energy: 0.8721626829788115
Energy: 0.8620259359167534
Energy: 0.8784177557431618
Energy: 0.870532599434289
Energy: 0.9356101716628915
Energy: 0.8581854503982908
Energy: 0.8746970935350479
Energy: 0.8806047894690737
Energy: 0.9302312580889025
Energy: 0.9180037916016013
Energy: 0.8760877326939136
Energy: 1.0507971320803702
Energy: 0.9119160738613035
Energy: 0.9363691144557821
Energy: 0.8980529214618592
Energy: 0.8751610115282934
Energy: 1.0491142759130092
Energy: 0.9341856451267185
Energy: 0.9715697551819946
Energy: 0.8876524481213354
Energy: 0.9196186690046086
Energy: 0.9246504183442061
Energy: 0.8874904350937506
Energy: 0.9078229590251453
Energy: 0.8784490892512653
Energy: 0.9106033469095007
Energy: 0.9196688608579815
Energy: 0.8968988588677802
Energy: 0.9013821799878332
Energy: 0.8854652023885896
Energy: 0.9566143789545406
Energy: 0.8946558831970716
Energy: 0.834728929239125
Energy: 0.9108623623557277
Energy: 0.88211553888908
Energy: 0.9370069802659029
Energy: 0.864650062721774
Energy: 0.8731927443674486
Energy: 0.9045719034776415
Energy: 0.880967092158212
Energy: 1.0673385576860104
Energy: 0.9192984212236606
Energy: 0.8902740673507208
Energy: 0.8376279476059109
Energy: 0.9719167246467485
Energy: 1.0645029615379245
Energy: 0.917387401874849
Energy: 0.8565932544818441
Energy: 0.8376022387659455
Energy: 1.0023960289562786
Energy: 0.8638922924324333
Energy: 0.9549501243195967
Energy: 0.8616059475662387
Energy: 0.907660461444083
Energy: 0.9345706433639263
Energy: 0.9499730901089423
Energy: 0.9635712251868287
Energy: 0.8595374054954392
Energy: 0.9408170258537287
Energy: 0.9375603461988954
Energy: 0.9380797459326375
Energy: 0.8802539741166289
Energy: 0.835998747848427
Energy: 0.8983808605878991
Energy: 0.8810399375564781
Energy: 0.9355522262116089
Energy: 0.8819073827807786
Energy: 0.8349129881057649
Energy: 0.8903999963345279
Energy: 0.8806145007069603
Energy: 0.8838346748458897
Energy: 0.8974603898168636
Energy: 1.0027312552130687
Energy: 0.8382169324523032
Energy: 0.9084930545298541
Energy: 0.9209003494888547
Energy: 0.8940719791250685
Energy: 1.0113621717219075
Energy: 0.9894850287052436
Energy: 0.8653800396384835
Energy: 1.0163855188005317
Energy: 1.0206548380535014
Energy: 0.8870401014868672
Energy: 0.9013054602290804
Energy: 0.8892454734982407
Energy: 1.018008153907071
Energy: 1.0143842718996647
Energy: 0.8899187356646442
Energy: 0.8939805116701063
Energy: 0.8377869682141916
Energy: 0.8815230575987542
Energy: 0.9390896599652294
Energy: 0.9179453069459936
Energy: 0.8988286817095998
Energy: 0.941790655390241
Energy: 0.8815873436558254
Energy: 0.94239710430878
Energy: 0.9748255121745861
Energy: 0.8780136654031336
Energy: 0.9038571305009525
Energy: 0.8688274705373839
Energy: 1.0017560232836398
Energy: 1.1866220187439012
Energy: 0.8825797302384164
Energy: 0.8634213630303549
Energy: 0.8794762910516916
Energy: 1.0016828329552114
Energy: 0.8405188720659342
Energy: 0.8827003738745438
Energy: 0.8737807303825933
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Energy: 0.8700326244763237
Energy: 0.8968081932074862
Energy: 0.8685751560171324
Energy: 0.8607372290385046
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Energy: 0.8696516398121266
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Energy: 0.889768540433455
Energy: 0.9571983086310506
Energy: 0.9168267745237776
Energy: 0.8591442617823082
Energy: 0.8723683023247747
Energy: 0.8913281665320197
Energy: 0.9752720927771178
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Energy: 0.8585118085536553
Energy: 0.8721723608578367
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Energy: 0.9064029992776986
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Energy: 0.8992627525167718
Energy: 0.8836104650427973
Energy: 0.9166943175154335
Energy: 0.9053033373864238
Energy: 0.8911742892767167
Energy: 0.8907051016026706
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Energy: 0.9010945269910708
Energy: 0.8598133119524469
Energy: 0.8879454837396706
Energy: 1.0493946817287667
Energy: 0.8760727367940391
Energy: 0.8963050740184866
Energy: 0.8961164251783529
Energy: 0.9016909917644069
Energy: 1.00633608906204
Energy: 0.8992249935517257
Energy: 0.9023400017359583
Energy: 0.9101624362132191
Energy: 0.8792628224165658
Energy: 0.8618949341662465
Energy: 0.8723763175656603
Energy: 0.8989241221083725
Energy: 0.8976777220081438
Energy: 0.8805399897107827
Energy: 0.9233272998748672
Energy: 0.8505407574592213
Energy: 0.8420250214582763
Energy: 0.9070246587009934
Energy: 1.0349576549558845
Energy: 0.9424818861435221
Energy: 0.935293826663567
Energy: 0.8423809115292249
Energy: 0.9162238750899155
Energy: 1.0364756481943724
Energy: 0.9287217431693368
Energy: 0.9218634528359154
Energy: 1.8647570382630112
Energy: 0.9089091840584969
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Energy: 0.988211857696347
Energy: 0.8409678704879464
Energy: 0.8894589797714239
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Energy: 0.9883076422053143
Energy: 0.8706878560511824
Energy: 0.9009702354706981
Energy: 0.8980665633888104
Energy: 0.8937778717535877
Energy: 0.9419750922854684
Energy: 0.952551420114204
Energy: 0.8503583607537311
Energy: 0.8949749290481829
Energy: 0.893762894975538
Energy: 0.9734105489530744
Energy: 0.9374645915912891
Energy: 0.8875618030100415
Energy: 0.8984854056468371
Energy: 0.9288145134239378
Energy: 0.9283721410736232
Energy: 0.905580790004927
Energy: 0.8918779465064997
Energy: 0.8965821443774463
Energy: 0.89240803338666
Energy: 0.9266245225137959
Energy: 0.8988455716530517
Energy: 0.9021544355678102
Energy: 0.8731401178756667
Energy: 0.9118382744954897
Energy: 1.02124370266455
Energy: 1.0194092929887082
Energy: 0.9028544609773429
Energy: 0.8980270035954581
Energy: 0.9768278806920773
Energy: 1.0119099830216232
Energy: 1.1812980684789267
Energy: 0.9293323473943637
Energy: 0.8673681240513846
Energy: 0.8555530791641458
Energy: 0.910735749984661
Energy: 0.920856096967315
Energy: 0.9380853303883403
Energy: 0.9357224839735
Energy: 0.8662361915171256
Energy: 0.9320966337495723
Energy: 0.9211032194356702
Energy: 0.8823561873239025
Energy: 0.8598490532203321
Energy: 0.8743197613702439
Energy: 1.0080616986478657
Energy: 1.005305306701736
Energy: 0.9017382091536363
Energy: 0.8593644778347844
Energy: 0.8605535326843042
Energy: 1.001955562959533
Energy: 1.0004419879137783
Energy: 0.8591424736770764
Energy: 0.8642943515032545
Energy: 0.8636545687673409
Energy: 0.8860315310149103
Energy: 0.9302469202873175
Energy: 0.8586257165494916
Energy: 0.8613223710740087
Energy: 0.8574521258593621
Energy: 0.8930221574397348
Energy: 0.9397442699332776
Energy: 0.8596448667738306
Energy: 0.8624952433780447
Energy: 0.8891965114861281
Energy: 0.8894583593143333
Energy: 0.8794312576583436
Energy: 0.8602627710922671
Energy: 0.8608565411901894
Energy: 0.8896586901614626
Energy: 0.9098203471216856
Energy: 0.8938073444071961
Energy: 0.8945883655458383
Energy: 0.9345066923398898
Energy: 0.9131629271330113
Energy: 0.8903358272424743
Energy: 0.8920666274001219
Energy: 0.8780953890982592
Energy: 0.9494406208005172
Energy: 0.8940160054448142
Energy: 0.9350278801668788
Energy: 0.8637929715305763
Energy: 0.8823286451828226
Energy: 0.8741904569718162
Energy: 0.8976775279685306
Energy: 0.847610353754247
Energy: 0.8812331117128018
Energy: 0.881740550895328
Energy: 0.8705671565297292
Energy: 0.8927289794797
Energy: 0.8597785738181489
Energy: 0.8759209273691289
Energy: 0.9532387128829846
Energy: 0.8738303335630617
Energy: 0.8431282593844122
Energy: 0.8819754914198352
Energy: 0.8638492195030181
Energy: 0.944883232922311
Energy: 0.8943052396043856
Energy: 0.834295320353056
Energy: 0.8926188799279601
Energy: 0.8776990909293555
Energy: 1.0667759411965336
Energy: 0.879209148281081
Energy: 0.9233618616497375
Energy: 0.8447596979978529
Energy: 0.8792018891742013
Energy: 1.0605697817399302
Energy: 0.8812019397467068
Energy: 0.8446200013948825
Energy: 0.8363559415803087
Energy: 0.8801464326301085
Energy: 0.9314604955032957
Energy: 0.9069269227788789
Energy: 0.8994330300758102
Energy: 0.8604704105425821
Energy: 0.8793250928976459
Energy: 0.942820170682282
Energy: 0.8845779765643383
Energy: 0.8632643158069255
Energy: 0.8625300490153185
Energy: 0.883820024088899
Energy: 0.9435552332213879
Energy: 0.9219807794286109
Energy: 0.8342147906664511
Energy: 0.8678040349606473
Energy: 0.9161685037243417
Energy: 0.9310556224991403
Energy: 0.9094791936314964
Energy: 0.9086855069461272
Energy: 0.8697424673476005
Energy: 0.8981144576797998
Energy: 0.9311828765124347
Energy: 0.9087451689009192
Energy: 0.8845261465383579
Energy: 0.8485907555697432
Energy: 0.8965790828266159
Energy: 0.9224932195435179
Energy: 0.9266427974901937
Energy: 0.8545331947108186
Energy: 0.8727351733119052
Energy: 0.9250011240442013
Energy: 0.9391517357395643
Energy: 1.0272110036839308
Energy: 0.8923415201825767
Energy: 0.9033565055149646
Energy: 0.8770320355168677
Energy: 0.9416533571869576
Energy: 1.0208278746010029
Energy: 0.9011545949678516
Energy: 0.8549803148890179
Energy: 0.8832642087918244
Energy: 0.8391008071878179
Energy: 0.9208009257942834
Energy: 0.9271292080605452
Energy: 0.9154110501203048
Energy: 0.9408819183770508
Energy: 0.83923727778777
Energy: 0.9046785571005801
Energy: 0.9108752768644722
Energy: 0.8785747131348073
Energy: 0.913466982585524
Energy: 0.8915546613899233
Energy: 0.8821887173437429
Energy: 1.023841170477101
Energy: 0.9129371708020395
Energy: 0.8762831605831246
Energy: 0.8935941770161789
Energy: 0.9161703394135617
Energy: 1.1520481574724009
Energy: 0.8854677359329741
Energy: 0.8707624726068112
Energy: 0.8600973429584227
Energy: 0.8813706533434267
Energy: 0.8844372430723295
Energy: 0.8624124369127569
Energy: 0.8631318630613595
Energy: 0.8637683343347283
Energy: 0.8499912572655439
Energy: 0.8827957268474464
Energy: 0.8630081768454952
Energy: 0.8646769713290416
Energy: 0.8946298095678065
Energy: 0.9573992649146978
Energy: 0.8597055682162338
Energy: 0.8576284246087794
Energy: 0.8714041698031681
Energy: 0.8807679483002703
Energy: 0.8885376684585181
Energy: 0.9049751608225041
Energy: 0.8604969573400084
Energy: 0.8766727939104365
Energy: 0.8805183485335291
Energy: 0.8775255965871498
Energy: 0.9410802363191221
Energy: 0.9253675792426214
Energy: 0.9270728969951432
Energy: 0.8456232990232756
Energy: 0.8985901775355135
Energy: 0.9340655963263431
Energy: 0.9167107045149224
Energy: 0.9238048045276533
Energy: 0.8751848357756636
Energy: 0.8613889541725165
Energy: 0.8721056324681516
Energy: 1.0497975254883298
Energy: 0.8745184564812989
Energy: 0.8681573677582033
Energy: 0.8437993392003167
Energy: 0.8712519961077633
Energy: 1.0511896020468028
Energy: 0.8956556691935208
Energy: 0.8656125979619124
Energy: 0.8679390390200498
Energy: 0.8707009040419972
Energy: 0.9257436917886871
Energy: 0.8568608724766391
Energy: 0.8767000516448586
Energy: 0.8798541756487621
Energy: 0.8904838583087427
Energy: 0.8672355031574849
Energy: 0.862164218927984
Energy: 0.8622947686388109
Energy: 0.8809788963227126
Energy: 0.8753178878751239
Energy: 1.0353031430239723
Energy: 0.9305252154363889
Energy: 0.8459784303495101
Energy: 0.9166171945626304
Energy: 0.8809528750845669
Energy: 0.9593752567013876
Energy: 0.933263263284663
Energy: 0.9405337281702879
Energy: 0.9064367120034771
Energy: 0.9282983343276787
Energy: 0.9016347151711808
Energy: 0.8382228864309874
Energy: 0.8815651369943798
Energy: 0.8628606876785299
Energy: 0.9153465599360128
Energy: 0.9473028957748596
Energy: 0.8434438469909448

minimum gb energy = 0.8342147906664511 eV
minimum distance =  2.29927398172224 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.2606748350481782
Energy: 0.9692880098447902
Energy: 0.893992036473301
Energy: 0.9527941073789639
Energy: 0.8986893786797336
Energy: 0.842618836889783
Energy: 0.8372501526972408
Energy: 0.893968920271224
Energy: 0.948118555812101
Energy: 0.8100357337126203
Energy: 0.7993622613746937
Energy: 0.8429069648208448
Energy: 0.8264166912179646
Energy: 0.992559482409525
Energy: 0.8048421134141373
Energy: 0.8104639132318169
Energy: 0.8424013154291564
Energy: 0.8250238674188317
Energy: 0.9158953979804226
Energy: 0.808552003567726
Energy: 0.8020521994621679
Energy: 0.8820630241445265
Energy: 0.8212309845100879
Energy: 0.8003863752651099
Energy: 0.8043478832127997
Energy: 0.803079236596888
Energy: 0.8840280696151176
Energy: 0.9851300830139819
Energy: 0.7994872579250343
Energy: 0.8135921975197447
Energy: 0.8068886545904345
Energy: 0.8209052707204104
Energy: 0.9282716128477774
Energy: 0.8094836499048853
Energy: 0.8991089357332332
Energy: 0.8073399067442999
Energy: 0.8068325393682761
Energy: 0.9277027591740321
Energy: 0.8032536640932343
Energy: 0.8180084426401585
Energy: 0.9022981977893065
Energy: 0.9202809722487815
Energy: 0.8195727026865339
Energy: 0.824137182454336
Energy: 0.8364024994768702
Energy: 0.795917213016536
Energy: 0.9187687993738476
Energy: 0.8148136681043928
Energy: 0.8231899444300474
Energy: 0.8526625634827353
Energy: 0.8027475553975281
Energy: 0.8176171882360423
Energy: 0.7988307207080314
Energy: 0.8078843976994083
Energy: 1.4695512363314622
Energy: 0.823875727821435
Energy: 0.8179244993192495
Energy: 0.7999096262808292
Energy: 0.8111259919485628
Energy: 1.4752651077853791
Energy: 0.8826236178777399
Energy: 0.8051617742775483
Energy: 0.8064034579501623
Energy: 0.8014932802880256
Energy: 0.8228372315037398
Energy: 0.8813447180423217
Energy: 0.8060421249862761
Energy: 0.805700290757208
Energy: 0.8082821304996105
Energy: 0.8264487565841556
Energy: 0.8838891751013992
Energy: 0.7935498460933137
Energy: 0.8051289512342324
Energy: 0.8215020819606947
Energy: 0.8324631019389935
Energy: 0.8829028185396022
Energy: 0.7933475311528125
Energy: 0.805734728078791
Energy: 0.8222138876591826
Energy: 0.8325999552410953
Energy: 0.8182882340696277
Energy: 0.9834648605692522
Energy: 0.8022536868003273
Energy: 0.8953310235510843
Energy: 0.8062687633263489
Energy: 0.8197957840770812
Energy: 0.984234202920188
Energy: 0.8323421660050845
Energy: 0.8945441005758388
Energy: 0.8025542403718224
Energy: 0.8014213238300102
Energy: 0.806269143252738
Energy: 0.8121771896171207
Energy: 0.812326323698215
Energy: 0.8818037652628011
Energy: 0.7983220180798163
Energy: 0.8056664291470089
Energy: 0.8118833596921715
Energy: 0.8127243832840917
Energy: 0.8347023121251507
Energy: 0.8080485192992645
Energy: 0.8078921628611813
Energy: 0.796848897823968
Energy: 0.9470713335919755
Energy: 0.8116277437498333
Energy: 0.8071964131473278
Energy: 0.8181739673872666
Energy: 0.8865092951066289
Energy: 1.4651732161375237
Energy: 0.8198903868509481
Energy: 0.7971092706211007
Energy: 0.7939290024548153
Energy: 0.7978976482234442
Energy: 0.9142669636889722
Energy: 0.7951514457618019
Energy: 0.7950652474261983
Energy: 0.7932943524823017
Energy: 0.798748883978287
Energy: 0.9124188713116116
Energy: 0.7941603251914676
Energy: 0.8077897821484495
Energy: 0.8071152103651413
Energy: 0.8065388765672931
Energy: 0.8324687040950897
Energy: 0.7945243766315246
Energy: 0.8085855386978912
Energy: 0.8178165673727437
Energy: 0.8202710851478184
Energy: 0.8326076490111101
Energy: 0.7948151153093332
Energy: 0.8240713108390034
Energy: 0.8002237723550996
Energy: 0.8863491684563228
Energy: 0.8366217859505899
Energy: 0.8086739802471145
Energy: 0.9934414129490556
Energy: 0.8021770467975022
Energy: 0.8880105573515851
Energy: 0.7964355642090961
Energy: 0.817190920965501

minimum gb energy = 0.7932943524823017 eV
minimum distance =  2.37404028017211 Angstroms
sigma value = 33