Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuAgAu__MO_318213562153_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614960163831712
cohesive_energy=3.540273359443754
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4503143217463098e-19, 2.16689583218598e-19, 2.71519271987346e-19, 3.1480047157822197e-19, 3.5145987514077595e-19, 3.8389113456620394e-19, 4.1236982423555394e-19, 4.36995279100134e-19, 4.58172849848346e-19, 4.76381587293756e-19, 4.920412617144719e-19, 5.05497943263438e-19, 5.1704002373477395e-19, 5.26912636153482e-19, 5.35336880895054e-19, 5.42503416978936e-19, 5.485740642451619e-19, 5.536769968244519e-19, 5.579019366083099e-19, 5.61301755425658e-19, 5.639036902792739e-19, 5.65733375995302e-19, 5.66814845223252e-19, 5.671689262593659e-19, 5.667908125737419e-19, 5.65577964861804e-19, 5.63434252525512e-19, 5.60266749320094e-19, 5.557069546197299e-19, 5.4941040044811e-19, 5.410550493017999e-19, 5.30285217968052e-19, 5.16698760111732e-19, 4.998310445089799e-19, 4.7913893328087e-19, 4.53949512241122e-19, 4.23389595124206e-19, 3.8624953857145196e-19, 3.40835841880722e-19, 2.84831757639252e-19, 2.15207569832148e-19, 1.2810571777772818e-19, 1.84601189592846e-20, -1.210229755318044e-19, -3.02069576044458e-19, -5.43416657660316e-19, -8.71540830126882e-19, -1.3221818476187938e-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: 0.016722186383359535
Energy: 0.2638968160243793
Energy: 0.2640981798307149
Energy: 0.6597786891370452
Energy: 0.6588479250266832
Energy: 0.22566976475301653
Energy: 0.017838312776756026
Energy: 0.08365300835330605
Energy: 0.5539965544143164
Energy: 0.17383294642216773
Energy: 0.26410189720795896
Energy: 0.5271088359949101
Energy: 0.018037228448578496
Energy: 0.08427454620425624
Energy: 0.017368407735259765
Energy: 0.5561056145278457
Energy: 0.18695170724884083
Energy: 0.2641670680848077
Energy: 0.5633222787157371
Energy: 0.08339839134285124
Energy: 0.0843575027163214
Energy: 0.0191505873651257
Energy: 0.5279796100678606
Energy: 0.2643835571570552
Energy: 0.6584517820100922
Energy: 0.5552122865604961
Energy: 0.08368002536057584
Energy: 0.01780300109562262
Energy: 0.0840751491866265
Energy: 0.6619493815206593
Energy: 0.1741415198109545
Energy: 0.2644750709689661
Energy: 0.5271894819669289
Energy: 0.017659402457090596
Energy: 0.08379362135549225
Energy: 0.01711091821055956
Energy: 0.5563687083336618
Energy: 0.26820525780562215
Energy: 0.26437715180438015
Energy: 0.5645389593520729
Energy: 0.08328156722739063
Energy: 0.08433772808922989

minimum gb energy = 0.016722186383359535 eV
minimum distance =  2.53379783500466 Angstroms
sigma value = 5


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

Energy: 0.9221722511668644
Energy: 0.8504313428787412
Energy: 0.9441434186604677
Energy: 0.8751697963410364
Energy: 0.9098988415120739
Energy: 0.8758744530627723
Energy: 0.7808753053518835
Energy: 0.7815686571543101
Energy: 0.8480247603972596
Energy: 0.7814571351509596
Energy: 0.8472724280055663
Energy: 0.8022341515887368
Energy: 0.7894464569578257
Energy: 0.8602884837082734
Energy: 0.7858964436985811
Energy: 0.8638996667096666
Energy: 0.7972347027685773
Energy: 0.8361637707443845
Energy: 0.8492742067767975
Energy: 0.9198626609138193
Energy: 0.8677738608122472
Energy: 0.7993443962049708
Energy: 0.8561496403065222
Energy: 0.7946645945497763
Energy: 0.8538958240062017
Energy: 0.8304793920191318
Energy: 0.7848623891414246
Energy: 0.8224350650254326
Energy: 0.8914149817732838
Energy: 0.7901525367659338
Energy: 0.8410035547326365
Energy: 0.8228232719971218
Energy: 0.8776257537854092
Energy: 0.8421487769518831
Energy: 0.8781413387762256
Energy: 0.8252289200903279
Energy: 0.8577194214511482
Energy: 0.7869920449609653
Energy: 0.7862127015041963
Energy: 0.7993802152463032
Energy: 0.84899252266563
Energy: 0.8640510327041268
Energy: 0.8231210208039209
Energy: 0.8375648477199986
Energy: 0.8043291162708853
Energy: 0.857166674848702
Energy: 0.841289756762516
Energy: 0.8642620586565218
Energy: 0.8612216394477513
Energy: 0.8270723106569886
Energy: 0.8456340768013807
Energy: 0.8423688341907316
Energy: 0.8337771629733228
Energy: 0.8327164460432639
Energy: 0.7898305168711446
Energy: 0.8530804599906704
Energy: 0.8425345843641031
Energy: 0.8232707778655882
Energy: 0.8130617205836885
Energy: 0.8330862458437986
Energy: 0.8454716776303511
Energy: 0.8309003532801515
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Energy: 0.8506121467783729
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Energy: 0.8053667831536659
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Energy: 0.7809700604653977
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Energy: 0.8970960523183031
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Energy: 0.7896219188965599
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Energy: 0.8058019511958077
Energy: 0.7983423351948754
Energy: 0.8011804776511432
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Energy: 0.8924491377300339
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Energy: 0.783898950778904
Energy: 0.8236830145389935
Energy: 0.8772640444233778
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Energy: 0.8247598264717636
Energy: 0.8406824743687802
Energy: 0.8894435927731598
Energy: 0.802034901695446
Energy: 0.7830560789790251
Energy: 0.8623559551118393
Energy: 0.8186014127458978
Energy: 0.8663618315349109
Energy: 0.7986980072218638
Energy: 0.8063457488802418
Energy: 0.8589094272716619
Energy: 0.84623333022157
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Energy: 0.811066123470477
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Energy: 0.8967700253640593
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Energy: 0.8432056759804993
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Energy: 0.8724013739407444
Energy: 0.7969939025051217
Energy: 0.8420562733344787
Energy: 0.8231645043679682
Energy: 0.8329154542009077
Energy: 0.8299982857755582
Energy: 0.842885918593243
Energy: 0.8356534839847216
Energy: 0.8567258424316008
Energy: 0.8939284497365544
Energy: 0.8226764376800072
Energy: 0.8738043266185259
Energy: 0.7930598369085913
Energy: 0.8307932852655352
Energy: 0.8164898686113103
Energy: 0.7907771893653641
Energy: 0.8234408451431035
Energy: 0.8222101790277784
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Energy: 0.841148686663348
Energy: 0.8224156341009244
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Energy: 0.9143669356398498
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Energy: 0.8398000478081465
Energy: 0.8732907077203278
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Energy: 0.8193329823908718
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Energy: 0.8046685698133812
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Energy: 0.9025513477660232
Energy: 0.9097202101484161
Energy: 0.8837894533363497
Energy: 0.7880641042146017
Energy: 0.8407116508169153
Energy: 0.7940206389355686
Energy: 0.856269301461385
Energy: 0.8003579737254493
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Energy: 0.8351201469603815
Energy: 0.8092473778745415
Energy: 0.8072715980933898
Energy: 0.8778345822698223
Energy: 0.8644134344963826
Energy: 0.8835039441452421
Energy: 0.8733067367613369
Energy: 0.9034695700047676
Energy: 0.7960882829890772
Energy: 0.8384479537223782
Energy: 0.8893431078293575
Energy: 0.844903163135547
Energy: 0.8405748973835898
Energy: 0.8621876555556494
Energy: 0.8632063516396242
Energy: 0.8649088125777029
Energy: 0.8799195353530433
Energy: 0.8331971263948518
Energy: 0.809859979816023
Energy: 0.8201134598600471
Energy: 0.8335863667275413
Energy: 0.919648774993062
Energy: 0.8546082972333626
Energy: 0.8435378626390455
Energy: 0.8516500389403974
Energy: 0.7780662350357187
Energy: 0.7887185023263455
Energy: 0.7964385449758157
Energy: 0.795891968300698
Energy: 0.8369845170567117
Energy: 0.9145657572685107
Energy: 0.7953587687272754
Energy: 0.8765377470505642
Energy: 0.8867240982043744
Energy: 0.8841739887742561
Energy: 0.8172212474896662
Energy: 0.8572112356037116
Energy: 0.8029271073494922
Energy: 0.8939404828328088
Energy: 0.7772887450284701
Energy: 0.8095633933245701
Energy: 0.8145663525811262
Energy: 0.8111052487949064
Energy: 0.8239842087178338
Energy: 0.9983531792033737
Energy: 0.8107115237019625
Energy: 0.8677441370261857
Energy: 0.8827766228604608
Energy: 0.8631011001468244
Energy: 0.8426874272722941
Energy: 0.8001456409826244
Energy: 0.807755299842803
Energy: 0.8601360337636339
Energy: 0.797884035030939
Energy: 0.807690670428012
Energy: 0.7781353078313071
Energy: 0.7811977089560661
Energy: 0.821900813541316
Energy: 0.7944438642501055
Energy: 0.8286839709055889
Energy: 0.8925476366592257
Energy: 0.8534193250999199
Energy: 0.8764847515836506
Energy: 0.8536299002167534
Energy: 0.8370858649515743

minimum gb energy = 0.7772887450284701 eV
minimum distance =  2.29410544989104 Angstroms
sigma value = 401


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

Energy: 0.9262718093658353
Energy: 0.8088476750024658
Energy: 0.8543595914291675
Energy: 0.8479988404281472
Energy: 0.8192127313231341
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Energy: 0.8323210068359601
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Energy: 0.8631999247807858
Energy: 0.8992918002381918
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Energy: 0.8982182775165027
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Energy: 0.8057790441430747
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Energy: 0.9070629334712044
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Energy: 0.7950687614898736
Energy: 0.822164716345768
Energy: 0.8084368255568503
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Energy: 0.8216148193328504
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Energy: 0.7960412237824654
Energy: 0.7900572097976016
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Energy: 0.850915831946442
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Energy: 0.8616976631822147
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Energy: 1.0024627638099508
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Energy: 0.9955135499783252
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Energy: 0.8005880674402253
Energy: 0.8164394111059635
Energy: 0.8722899558512077
Energy: 0.8437154382347963
Energy: 0.8312994658297936
Energy: 0.8093746409675514
Energy: 0.8063381023861107
Energy: 0.7992132488673386
Energy: 0.8061467025181764
Energy: 0.8478303884447965
Energy: 0.8995316906193932
Energy: 0.8978043745240553
Energy: 0.8021441372088483
Energy: 0.8197037157393638
Energy: 0.8036429641093672
Energy: 0.8642682874044932
Energy: 0.8752474985443449
Energy: 0.7974625552722601
Energy: 0.8321796918073264
Energy: 0.8581705438424244
Energy: 0.8300076176070312
Energy: 0.864786988474578
Energy: 0.8318802644837568
Energy: 0.8527577320032842
Energy: 0.8282862741841226
Energy: 0.8553213506199127
Energy: 0.8378557351082466
Energy: 0.826049088261299
Energy: 0.8051506338631238
Energy: 0.7997170031622364
Energy: 0.8136760507520701
Energy: 0.7942424687858252
Energy: 0.8043943749705204
Energy: 0.8415268012680639
Energy: 0.8417900548054608
Energy: 0.8009748547157279
Energy: 0.8440264595795781
Energy: 0.801912886772664
Energy: 0.7921312487922888
Energy: 0.8276519252558
Energy: 0.8415216523341481
Energy: 0.8374940194977635
Energy: 0.8519528348361282
Energy: 0.8521142014861387
Energy: 0.801840943724578
Energy: 0.8089461373376625
Energy: 0.831430650306957
Energy: 0.8329039497226205
Energy: 0.8079852642395225
Energy: 0.8305371841046177
Energy: 0.8860861706979742
Energy: 0.8225113968122482
Energy: 1.0025833667570248
Energy: 0.8800776095282639
Energy: 0.7983054500471444
Energy: 0.8390938467158104
Energy: 0.825238445663414
Energy: 0.8161903129636457
Energy: 0.9053488699100207
Energy: 0.8057030336466743
Energy: 0.8432827003135714
Energy: 0.8469468469913174
Energy: 0.8151090283566644
Energy: 0.8340524019731432
Energy: 0.8126527450144937
Energy: 0.8455617532831341
Energy: 0.9530586575569909
Energy: 0.816277659763526
Energy: 0.83239239747357
Energy: 0.8345470601715725
Energy: 0.8026034468685851
Energy: 0.8041626481342141
Energy: 0.8756866320637818
Energy: 0.8202039345754104
Energy: 0.8316651582695517
Energy: 0.8062518253237617
Energy: 0.8178471511674396
Energy: 0.8081218400792467
Energy: 0.8013473879505445
Energy: 0.8817364378896482
Energy: 0.8128073655494947
Energy: 0.9212822213391684
Energy: 0.7963678976002337
Energy: 0.8296288262691024
Energy: 0.8107373441546454
Energy: 0.8434141889981792
Energy: 0.8874955508477629
Energy: 0.8352892623763176
Energy: 0.8188668405391037
Energy: 0.8110264443151108
Energy: 0.7985749766828769
Energy: 0.8242414868538004
Energy: 0.9015738235661155
Energy: 0.8656117149111107
Energy: 0.7992530701513005
Energy: 0.8439360152949444
Energy: 0.8375603725255263
Energy: 0.8332741434095183
Energy: 0.8324610967004327
Energy: 0.8326224763045879
Energy: 0.8192829929089598
Energy: 0.8071710075118718
Energy: 0.8089390917102194
Energy: 0.8329195379121116
Energy: 0.7982495495835065
Energy: 0.8196064251422825
Energy: 0.8612579750212688
Energy: 0.8303975194323762

minimum gb energy = 0.7880220281515421 eV
minimum distance =  2.2973730451192 Angstroms
sigma value = 311


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

Energy: 0.8260329804163703
Energy: 0.8589930639727381
Energy: 0.8829087113108101
Energy: 0.8092816009352249
Energy: 0.8379360222156179
Energy: 0.8582674717170256
Energy: 0.8272968777490758
Energy: 0.8459257165797243
Energy: 0.8435504925489933
Energy: 0.8654131514090141
Energy: 0.8251368678664857
Energy: 0.8511912130363066
Energy: 0.8345666989572975
Energy: 0.8375664475407228
Energy: 0.8106823365213496
Energy: 0.8190047124888961
Energy: 0.8339585111086456
Energy: 0.8426420943789449
Energy: 0.8530280782961759
Energy: 0.8136840801042141
Energy: 0.8289939057008471
Energy: 0.8580404630890293
Energy: 0.8178649466049964
Energy: 0.8030667806377041
Energy: 0.815193109542338
Energy: 0.8592903300210605
Energy: 0.8802234711689669
Energy: 0.8749061651940345
Energy: 0.8480313396283549
Energy: 0.8281260370528474
Energy: 0.8296745630720513
Energy: 0.82629986601272
Energy: 0.8520699093283487
Energy: 0.8235542073532374
Energy: 0.8604593383813436
Energy: 0.8270211579189801
Energy: 0.8096432353786243
Energy: 0.8166428630516313
Energy: 0.8085286942054358
Energy: 0.8591396852842142
Energy: 0.8163360616695382
Energy: 0.8164672793105215
Energy: 0.8902001374059418
Energy: 0.8243921690636844
Energy: 0.8168970637928655
Energy: 0.8352745375188922
Energy: 0.8064071670408371
Energy: 0.8146820501962766
Energy: 0.8665308613452948
Energy: 0.8158162383980729
Energy: 0.84278319504598
Energy: 0.8180517269558645
Energy: 0.8243996278581533
Energy: 0.8550794177002088
Energy: 0.8149025441807934
Energy: 0.8391847640246153
Energy: 0.8304374172977259
Energy: 0.8071349505187907
Energy: 0.8275343170319054
Energy: 0.8506785302314944
Energy: 0.8380778427493336
Energy: 0.7968994843006008
Energy: 0.8373335110360823
Energy: 0.8253604051787726
Energy: 0.8657100749214142
Energy: 0.825965186662217
Energy: 0.8093197995837674
Energy: 0.86205387612881
Energy: 0.8150195606314037
Energy: 0.8433373787564513
Energy: 0.8509981262957917
Energy: 0.7961354433854589
Energy: 0.8362105625983096
Energy: 0.8466678419360256
Energy: 0.8490073284973257
Energy: 0.8232715761298767
Energy: 0.8478557852332681
Energy: 0.8432383140711904
Energy: 0.8228017271823943
Energy: 0.809922464673337
Energy: 0.8163798046934224
Energy: 0.8423509880448251
Energy: 0.8296158963998133
Energy: 0.880421753486728
Energy: 0.816397700517593
Energy: 0.8619234184859351
Energy: 0.8728041381999622
Energy: 0.8225799004907319
Energy: 0.9048914605597038
Energy: 0.826710198296457
Energy: 0.8603309334861851
Energy: 0.8518742178518627
Energy: 0.8687474683640795
Energy: 0.8371611827832622
Energy: 0.8733844290120191
Energy: 0.8261918579984517
Energy: 0.8907869602507137
Energy: 0.8770265899054434
Energy: 0.8373777979626209
Energy: 0.8468613390222991
Energy: 0.8531129268033473
Energy: 0.8154144436558785
Energy: 0.8575140758560906
Energy: 0.8441632684244749
Energy: 0.8183124938173151
Energy: 0.8237818639439416
Energy: 0.8788222329414482
Energy: 0.8444436143282187
Energy: 0.8843335950578037
Energy: 0.8518897206741112
Energy: 0.8341082783102488
Energy: 0.828903605550828
Energy: 0.8632248500160372
Energy: 0.8392199884518767
Energy: 0.8465346114502649
Energy: 0.8381821089072438
Energy: 0.8564754354316871
Energy: 0.8427056917006066
Energy: 0.8257504506658079
Energy: 0.7964695881318039
Energy: 0.8802190822986631
Energy: 0.8261774327667647
Energy: 0.8133370776092019
Energy: 0.84709790731223
Energy: 0.816942052295104
Energy: 0.8644539108552249
Energy: 0.8496867973347149
Energy: 0.828211721179005
Energy: 0.8480489611237165
Energy: 0.8494301157051104
Energy: 0.8454359720656957
Energy: 0.8470672083618678
Energy: 0.85367756463622
Energy: 0.8052438739250493
Energy: 0.8747702109971361
Energy: 0.8549019259992158
Energy: 0.8789031191912768
Energy: 0.8523579172676738
Energy: 0.8920670031795055
Energy: 0.9017991886509131
Energy: 0.8238078859356057
Energy: 0.8249667208710785
Energy: 0.8546207286781425
Energy: 0.8817563983065102
Energy: 0.8634003894998377
Energy: 0.8496108951105396
Energy: 0.8493487439505066
Energy: 0.8323331062236449
Energy: 0.873792857535816
Energy: 0.83204813292139
Energy: 0.8188298994737849
Energy: 0.8350521306427584
Energy: 0.834997634879519
Energy: 0.8824631940932275
Energy: 0.8461264686932357
Energy: 0.8364309197564533
Energy: 0.8318974295111587
Energy: 0.8596559704586795
Energy: 0.8635294380490388
Energy: 0.8429996434552052
Energy: 0.8259962649237068
Energy: 0.8626480230250838
Energy: 0.8733966032315871
Energy: 0.8259227671909856
Energy: 0.8181108762295511
Energy: 0.8172104417803987
Energy: 0.8075449462194131
Energy: 0.8435803667877269
Energy: 0.8436121115239952
Energy: 0.8175894304532727
Energy: 0.8154015177437259
Energy: 0.8153242501411402
Energy: 0.8253340081184579
Energy: 0.8377640722348466
Energy: 0.8591786280966212
Energy: 0.8172723809370042
Energy: 0.8662412081936258
Energy: 0.8334626120146136
Energy: 0.8987525711486648
Energy: 0.8525588118002296
Energy: 0.8676671944308398
Energy: 0.8206039937025951
Energy: 0.8045790788931498
Energy: 0.8499889708844637
Energy: 0.843842132951713
Energy: 0.8019624872133694
Energy: 0.8423208791896014
Energy: 0.820113703240047
Energy: 0.8300455855134233
Energy: 0.8145740272286618
Energy: 0.8689840923882043
Energy: 0.8596204247626251
Energy: 0.8007621767909441
Energy: 0.8518940905140989
Energy: 0.8065582498946458
Energy: 0.81114982827389
Energy: 0.8254314887709925
Energy: 0.8383221916619573
Energy: 0.8456931536341561
Energy: 0.8352842671966376
Energy: 0.8421034633537141
Energy: 0.8109621148816728
Energy: 0.8278125813048645
Energy: 0.8795334940145935
Energy: 0.8447014435563269
Energy: 0.8188793189837464
Energy: 0.8300037264365645
Energy: 0.8407258368141755
Energy: 0.8216122892113117
Energy: 0.8363200243837633
Energy: 0.8049492606996446
Energy: 0.7919574976545735
Energy: 0.8340753748865746
Energy: 0.8174659745986393
Energy: 0.8407419109615172
Energy: 0.8172297398394991
Energy: 0.8096261998234708
Energy: 0.8373756104163916
Energy: 0.8587665148233784
Energy: 0.8293661920162309
Energy: 0.8748585625836688
Energy: 0.8238554993571445
Energy: 0.8301864216162715
Energy: 0.819394245832227
Energy: 0.8280390151764273
Energy: 0.843594094364215
Energy: 0.8149079256784378
Energy: 0.824803702610709
Energy: 0.8547527506687962
Energy: 0.8205401351952745
Energy: 0.8568610918754757
Energy: 0.8052617504930026
Energy: 0.8186670116994356
Energy: 0.828075429542879
Energy: 0.8654218249666676
Energy: 0.8567880410158759
Energy: 0.849661823161847
Energy: 0.8330084139954205
Energy: 0.8302506388780595
Energy: 0.8103268679009555
Energy: 0.8660490239384927
Energy: 0.8509535197989091
Energy: 0.8585368785990933
Energy: 0.8269095137031997
Energy: 0.8481929214638396
Energy: 0.8245995305292378
Energy: 0.8576924979859561
Energy: 0.8817529351520657
Energy: 0.8382649054546549
Energy: 0.8592691141506733
Energy: 0.8565475425040058
Energy: 0.8391886002284514

minimum gb energy = 0.7919574976545735 eV
minimum distance =  2.27751123644388 Angstroms
sigma value = 39


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

Energy: 0.7750179626396974
Energy: 0.8555227579355066
Energy: 1.0992135009541752
Energy: 0.9584099960073923
Energy: 0.9324490435909528
Energy: 0.8945197368291322
Energy: 0.7544097318965064
Energy: 0.8227676414059983
Energy: 0.8274358590598608
Energy: 0.8922390147061563
Energy: 0.8953705349677986
Energy: 0.8293503510606852
Energy: 0.8175692012810233
Energy: 0.8311103898845073
Energy: 0.8171211760727308
Energy: 0.8281006231963784
Energy: 0.8458038535779222
Energy: 0.8779630208056803
Energy: 0.829067903053936
Energy: 0.8165941516751678
Energy: 0.8160678910399981
Energy: 0.8312541152708687
Energy: 0.8278498358841033
Energy: 0.9090729374188494
Energy: 0.8395776311365482
Energy: 0.8775659123920794
Energy: 0.8925702547051558
Energy: 0.896425993468324
Energy: 0.8219475585984329
Energy: 0.8285614605028836
Energy: 0.8842485487746105
Energy: 0.817832014509878
Energy: 0.8552744286742738
Energy: 0.8194549542579198
Energy: 0.8159223004996456
Energy: 0.7536001482546595
Energy: 0.8279310006468408
Energy: 0.817897768223937
Energy: 0.8301572159095552
Energy: 0.830925033831398
Energy: 0.8156545663201427
Energy: 0.8470354183076609
Energy: 0.8324939377088705
Energy: 0.8320906350299002
Energy: 0.8152455558010792
Energy: 0.8910326630660801
Energy: 0.7560206224077798
Energy: 0.7546798974505321
Energy: 0.8287267699027866
Energy: 0.7559830951952216
Energy: 0.8284068225854957
Energy: 0.8980885561703962
Energy: 0.8269591635032204
Energy: 0.8950482018981116
Energy: 0.8173227796695792
Energy: 0.8295466253524365
Energy: 0.7546848992251826
Energy: 0.8283474224974882
Energy: 0.9009098262848024
Energy: 0.827285448429975
Energy: 0.8257901670870672
Energy: 0.8166812154591472
Energy: 0.8293253789403001
Energy: 0.8322041670153526
Energy: 0.8343781845997369
Energy: 0.8949211459441742
Energy: 0.8781772279070389
Energy: 0.8215101179975202
Energy: 0.8164293899521642
Energy: 0.8157191201838332
Energy: 0.8336969754951358
Energy: 0.8264161650837347
Energy: 0.8418797833471122
Energy: 0.8258996060956632
Energy: 0.8313481689959471
Energy: 0.8309497444347188
Energy: 0.820581537834388
Energy: 0.8299360644733521
Energy: 0.8272988194301925
Energy: 0.8227136922493011
Energy: 0.8258775839674948
Energy: 0.8975450358921232
Energy: 0.8165504988827995
Energy: 0.8205151474366
Energy: 0.7560723795301247
Energy: 0.8278198303531354
Energy: 0.8957931916217
Energy: 0.8191260763451149
Energy: 0.8862411026293058
Energy: 0.8949001389785101
Energy: 0.8162723212647
Energy: 0.8307414969724854
Energy: 0.8264955595951168
Energy: 0.8180811022566833
Energy: 0.8944932415256786
Energy: 0.7557333272518865
Energy: 0.7551333981402946
Energy: 0.8290039942197424
Energy: 0.7534980794194442
Energy: 0.8319372777913565
Energy: 0.8157003339667898
Energy: 0.8874052382912331
Energy: 0.753974913175371
Energy: 0.7545155157495959
Energy: 0.8306380593072075
Energy: 0.7539611187817185
Energy: 0.8280492313606714
Energy: 0.8462470536081803
Energy: 0.8204353819993151
Energy: 0.9336552425210234
Energy: 0.8956340406565843
Energy: 0.7544523832786922
Energy: 0.8227181483565833
Energy: 0.8276256280886498
Energy: 0.8921329524591147
Energy: 0.8960120321061633
Energy: 0.8292711068671161
Energy: 0.8176438842337316
Energy: 0.8306565093680945
Energy: 0.817166541542957
Energy: 0.8265523379196595
Energy: 0.8458864355024492
Energy: 0.8786981428925345
Energy: 0.8289550339577176
Energy: 0.8220892391665735
Energy: 0.81613240874159
Energy: 0.8310475629131495
Energy: 0.8290324709630899
Energy: 0.9090630545227204
Energy: 0.8385575455548054
Energy: 0.8774009726744297
Energy: 0.8925788717642893
Energy: 0.9360246332326333
Energy: 0.8219486282221281
Energy: 0.828590340565044
Energy: 0.8844014066083629
Energy: 0.8178235292996852
Energy: 0.8722012548422148
Energy: 0.8200678156072108
Energy: 0.8161339744996038
Energy: 0.753498357324359
Energy: 0.8281876680032634
Energy: 0.8167217977690682
Energy: 0.8303118039529135
Energy: 0.830852160452541
Energy: 0.7542073544469808
Energy: 0.8443639778941492
Energy: 0.8332138671278201
Energy: 0.8308849295879521
Energy: 0.8153470992165976
Energy: 0.8881870528583009
Energy: 0.756084992570628
Energy: 0.7547443157119661
Energy: 0.8288911980162074
Energy: 0.7558591491693363
Energy: 0.8283422096625271
Energy: 0.8988000248890503
Energy: 0.8271680237389573
Energy: 0.8952620882784255
Energy: 0.9012046018711704
Energy: 0.8289139120928584
Energy: 0.7546099098143392
Energy: 0.8282278578496336
Energy: 0.8837206161307058
Energy: 0.8266194692895966
Energy: 0.8258679913516495
Energy: 0.8180593024101888
Energy: 0.8293992233219151
Energy: 0.8324240763317343
Energy: 0.8351344461846179
Energy: 0.8953295445631105
Energy: 0.8777983129295276
Energy: 0.8217408358251799
Energy: 0.8167269714029645
Energy: 0.8160878121913402
Energy: 0.8333001220826889
Energy: 0.8263926953241527
Energy: 0.8414450585756154
Energy: 0.8264090274149702
Energy: 0.8294846562827638
Energy: 0.8174912765431492
Energy: 0.8691646763111606
Energy: 0.8293282951687189
Energy: 0.8279899137748956
Energy: 0.8232718143997528
Energy: 0.8259265035185429
Energy: 0.8871367164967946
Energy: 0.817882108634225
Energy: 0.8207048750402345
Energy: 0.7552519211345201
Energy: 0.8277284933972646
Energy: 0.8958295135775077
Energy: 0.8198961684833813
Energy: 0.8855940981465484
Energy: 0.8939571155220839
Energy: 0.8165996762634951
Energy: 0.8314214729458062
Energy: 0.8267098797317355
Energy: 0.817487886051727
Energy: 0.8944462455064132
Energy: 0.7557001664763179
Energy: 0.7552757284149518
Energy: 0.8288512416728311
Energy: 0.7533952992630427
Energy: 0.8317536827239591
Energy: 0.8157717286491958
Energy: 0.8286623133717776
Energy: 0.7540411349179271
Energy: 0.7545066149327132
Energy: 0.8309015799309692

minimum gb energy = 0.7533952992630427 eV
minimum distance =  2.36756802093322 Angstroms
sigma value = 21


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

Energy: 1.0722294008510975
Energy: 0.8021628565134014
Energy: 0.8737263343686392
Energy: 0.8251746796618982
Energy: 0.839574967504378
Energy: 0.8423123645784848
Energy: 0.8323349014748187
Energy: 0.8238182790049356
Energy: 0.8264331701281209
Energy: 0.8843290134706611
Energy: 0.8337333414909384
Energy: 0.8617355022791687
Energy: 0.8486577339189436
Energy: 0.8943222583185928
Energy: 0.859287287826941
Energy: 0.8340622152798384
Energy: 0.8561430221314813
Energy: 0.8786423449384463
Energy: 0.8504069703237457
Energy: 0.8197074603320259
Energy: 0.8454076383084417
Energy: 0.9667776845583784
Energy: 0.8850736448291865
Energy: 0.8251917879899825
Energy: 0.8394112430948298
Energy: 0.782772695495244
Energy: 0.8087430833563388
Energy: 0.8716067394810072
Energy: 0.763852132563109
Energy: 0.8058726323841687
Energy: 0.8232517070560775
Energy: 0.7941973543340989
Energy: 0.8074119720153178
Energy: 0.8326643774104996
Energy: 0.8218784931615193
Energy: 0.7806846298894785
Energy: 0.7960669672642293
Energy: 0.8469141867751206
Energy: 0.7472402097518622
Energy: 0.8538799413703664
Energy: 0.8360509688082013
Energy: 0.8224057834780014
Energy: 0.9225687439533958
Energy: 0.8172899041113866
Energy: 0.7935302168226284
Energy: 0.8487599754197009
Energy: 0.8061876589572434
Energy: 0.8039102540915491
Energy: 0.8252260852542616
Energy: 0.8122707498896617
Energy: 0.8234856859425633
Energy: 0.8409688573273596
Energy: 0.831423851569453
Energy: 0.8217055279706779
Energy: 0.8365321111419163
Energy: 0.8278480427250396
Energy: 0.8202180794028668
Energy: 0.8442026377705297
Energy: 0.8511638422129237
Energy: 0.8498399367019992
Energy: 0.8527125462144464
Energy: 0.8893034670934644
Energy: 0.8354380512106565
Energy: 0.8951314377430221
Energy: 0.8036771446734168
Energy: 0.7624343213056944
Energy: 0.8296445236488442
Energy: 0.7970140411005274
Energy: 0.8350627141305739
Energy: 0.8485532355268584
Energy: 0.8271666822628795
Energy: 0.8573528402457473
Energy: 0.8211816242928309
Energy: 0.8753796489235536
Energy: 0.8095179353762131
Energy: 0.8257601084821325
Energy: 0.857603576109767
Energy: 0.8269578493185299
Energy: 0.8520382768736887
Energy: 0.8864525307749316
Energy: 0.8043055511931241
Energy: 0.796156735615839
Energy: 0.9106456959325155
Energy: 0.853744344000855
Energy: 0.9770141890507883
Energy: 0.8278377183365326
Energy: 0.7726967707501904
Energy: 0.7801516811269
Energy: 0.8183281648265189
Energy: 0.8024411503285932
Energy: 0.7758507956234348
Energy: 0.7596248396037648
Energy: 0.7872346054097057
Energy: 0.8160206089329883
Energy: 0.8926029765087102
Energy: 0.8300496404930833
Energy: 0.8349493706965451
Energy: 0.7872018416909469
Energy: 0.8256107120207116
Energy: 0.8572133218211871
Energy: 0.8643158876159885
Energy: 0.8301317408430763
Energy: 0.9403988909390503
Energy: 0.8454936211777979
Energy: 0.8537274939411666
Energy: 0.924602511074445
Energy: 0.8481512302363478
Energy: 0.802545526646318
Energy: 0.8502739909106328
Energy: 0.816295432916737
Energy: 0.8627747966438782
Energy: 0.8443611123910472
Energy: 0.7642466590506084
Energy: 0.8886558394284484
Energy: 0.793444531125753
Energy: 0.746930866631169
Energy: 0.7889526504195866
Energy: 0.8424056023659322
Energy: 0.8676292826511028
Energy: 0.779260001851093
Energy: 0.8190813725285254
Energy: 0.8801493825896505
Energy: 0.7959127462208062
Energy: 0.8297686954171852
Energy: 0.8403034088333136
Energy: 0.8052963832306207
Energy: 0.7782523864256036
Energy: 0.7921388825601601
Energy: 0.81130781052471
Energy: 0.8139215949717441
Energy: 0.7917181007400186
Energy: 0.7812192589540263
Energy: 0.833046062654582
Energy: 0.8140837590364178
Energy: 0.8405576957673696
Energy: 0.8013983949592773
Energy: 0.8124940454033353
Energy: 0.7726180666674015
Energy: 0.824215125914376
Energy: 0.8224142530003762
Energy: 0.8132173151836725
Energy: 0.8254640110978064
Energy: 0.8272735728737668
Energy: 0.8186901243547227
Energy: 0.8632805550228548
Energy: 0.831320959397224
Energy: 0.8405132034653695
Energy: 0.7634654929908944
Energy: 0.7867688822661311
Energy: 0.8299107741841156
Energy: 0.8263631425061974
Energy: 0.7948876740061508
Energy: 0.8036303733983893
Energy: 0.7884222354125262
Energy: 0.8103654345921297
Energy: 0.8417218893848867
Energy: 0.8476426052384045
Energy: 0.8407959111129572
Energy: 0.8498382193084655
Energy: 0.9001067970084782
Energy: 0.7955071202078174
Energy: 0.8127476066954966
Energy: 0.8269807891591247
Energy: 0.7996280751685169
Energy: 0.8794108718048782
Energy: 0.8048911115073629
Energy: 1.0111017536047398
Energy: 0.8972533700828609
Energy: 0.790813533240562
Energy: 0.8643714872186399
Energy: 0.8447084691749834
Energy: 0.8657197097372931
Energy: 0.8183637651327653
Energy: 0.8381771886004228
Energy: 0.8191608888401225

minimum gb energy = 0.746930866631169 eV
minimum distance =  2.32453473923132 Angstroms
sigma value = 113


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

Energy: 1.005478656926529
Energy: 1.1361875939530772
Energy: 1.0246206791459793
Energy: 0.9150188794548504
Energy: 0.8134229347224161
Energy: 0.9499404667037615
Energy: 0.9792057445316288
Energy: 0.8357724046583895
Energy: 0.9010199287872978
Energy: 0.8458300010020867
Energy: 0.8092003425144412
Energy: 0.8187993930893219
Energy: 0.8367566886269358
Energy: 0.9166307639700823
Energy: 1.0117911259012278
Energy: 0.8993891377390397
Energy: 0.9460087260558039
Energy: 0.8354542462620059
Energy: 0.7801832677322597
Energy: 0.8899132270424722
Energy: 0.8968728235230551
Energy: 0.9074504174674789
Energy: 0.8737816716883456
Energy: 0.9144702700397314
Energy: 0.8960159547495914
Energy: 1.0196461915343469
Energy: 0.9493223871793486
Energy: 0.8843564666947136
Energy: 0.7728485293554862
Energy: 0.8443898645969089
Energy: 0.8482888256108388
Energy: 0.9074286216774741
Energy: 0.8640042329144744
Energy: 0.8846828119640984
Energy: 0.8701244295747673
Energy: 0.8636370870941399
Energy: 0.8710175828540792
Energy: 0.8939641548155912
Energy: 0.8654838182316972
Energy: 0.9023823498124924
Energy: 0.7988659740484336
Energy: 0.8777893793809097
Energy: 0.8824311347543213
Energy: 0.847397419808002
Energy: 0.9178312538811191
Energy: 0.8046812387699759
Energy: 0.851908643559674
Energy: 0.9466157687185327
Energy: 0.8381148370798133
Energy: 0.8441333246374714
Energy: 0.8376084529726446
Energy: 0.8054160472503792
Energy: 0.7816827567419229
Energy: 0.8184781433981935
Energy: 0.8076905107154335
Energy: 0.8125017207962505
Energy: 0.7798918870814415
Energy: 0.8628818311401035
Energy: 0.8847864530002406
Energy: 0.8669303218828516
Energy: 0.9279228811532338
Energy: 0.9309666905122277
Energy: 0.8147693703024551
Energy: 0.8616254772402159
Energy: 0.8693057481024037
Energy: 0.8145565598661783
Energy: 0.7992985951655329
Energy: 0.8151378065288607
Energy: 0.817066380899475
Energy: 0.8436994908049305
Energy: 0.8668843120742373
Energy: 0.8416274032063655
Energy: 0.8302016563216617
Energy: 0.8732374147212554
Energy: 0.8256648568678244
Energy: 0.8013834360586335
Energy: 0.9019819009587194
Energy: 0.8001211042729636
Energy: 0.8164496307924466
Energy: 0.9320946831753322
Energy: 0.8760100077595775
Energy: 0.9415046115580403
Energy: 0.975595785133719
Energy: 0.8118341122075955
Energy: 0.8821006807570575
Energy: 0.8368615784028524
Energy: 0.8574766248743936
Energy: 0.7720814090998971
Energy: 0.8216492646936324
Energy: 0.8235928949104026
Energy: 0.8555198038667392
Energy: 0.9638902715278319
Energy: 0.812705431307034
Energy: 0.8344590530591875
Energy: 0.8279966508495922
Energy: 0.8447438338258084
Energy: 0.904523108231957
Energy: 0.8510538359417166
Energy: 0.8163163631447604
Energy: 0.9389878929107458
Energy: 0.9045800309625377
Energy: 0.850218138342433
Energy: 0.8573493344612607
Energy: 0.8650076734061913
Energy: 0.8623525290386965
Energy: 0.7693811716383281
Energy: 0.8197346490126294
Energy: 0.8840250488912396
Energy: 0.8818034607128951
Energy: 0.8197750840056774
Energy: 0.899599941759355
Energy: 0.8479249484038844
Energy: 0.9036117035247679
Energy: 0.8393917921630102
Energy: 0.8451872078940039
Energy: 0.8731999746959715
Energy: 0.867379802925062
Energy: 1.000631844436422
Energy: 0.80440006727822
Energy: 0.8840409424910802
Energy: 0.9221772129655502
Energy: 0.9568804993279808
Energy: 0.930120165520252
Energy: 0.9880070044357536
Energy: 0.8249263934082293
Energy: 0.8681601109286589
Energy: 0.8732948953793209
Energy: 0.929709790213234
Energy: 0.8743850646153456
Energy: 0.8962545825722551
Energy: 0.8731128032281731
Energy: 0.7780960701283475
Energy: 0.812801648800682
Energy: 0.9286569864138419
Energy: 0.8776434954220442
Energy: 0.9247704482573305
Energy: 0.8643978378771707
Energy: 0.8112488257765443
Energy: 0.9482955857692817
Energy: 0.8512585314202996
Energy: 0.9528055584127877
Energy: 0.9096187135388331
Energy: 0.8615731911549607
Energy: 0.9028184929990323
Energy: 0.8621304645018947
Energy: 0.7689448507282406
Energy: 0.9122536631084815
Energy: 0.8584400026555306
Energy: 0.8882629143021424
Energy: 0.8676130298813419
Energy: 0.8634723539277076
Energy: 0.8611892904114271
Energy: 0.7691537520611914
Energy: 0.9171097768437072
Energy: 0.9819747050177369
Energy: 0.9010641672473757
Energy: 1.025786037738466
Energy: 0.9213322858779764
Energy: 0.8127387433053185
Energy: 0.9499592889787299
Energy: 0.9764160068477826
Energy: 0.7656725445851571
Energy: 0.8734824893383317
Energy: 1.0072317023816966
Energy: 0.8681058087136798
Energy: 0.8754617359307558
Energy: 0.8317345731996951
Energy: 0.9167315299735247
Energy: 0.8864938632947974
Energy: 0.874196297065514
Energy: 0.9448426929893381
Energy: 0.9041403333791855
Energy: 1.0258040468504184
Energy: 0.8237848051805007
Energy: 0.9963067787698217
Energy: 0.9078592233988547
Energy: 0.8219429499669123
Energy: 0.8961335626883603
Energy: 0.8005930942471088
Energy: 0.9119748954260266
Energy: 0.9501166018314768
Energy: 0.9235234753761562
Energy: 0.798231076377873
Energy: 0.8462160041460739
Energy: 0.839799020462072
Energy: 0.9082065606561276
Energy: 0.9004255999924456
Energy: 0.8881709696367451
Energy: 0.8499510818394349
Energy: 0.8640156374695988
Energy: 0.9109859878728135
Energy: 0.8903570494721591
Energy: 0.8112469353840772
Energy: 0.9045070633232385
Energy: 0.8860100511129237
Energy: 0.9080487249638649
Energy: 0.8397498654846565
Energy: 0.8316940764436448
Energy: 0.9003710950727926
Energy: 0.820857673430953
Energy: 0.79977100444568
Energy: 0.8939508440262854
Energy: 0.8430202643065838
Energy: 0.891291731587857
Energy: 0.8368605245904824
Energy: 0.8563680421844587
Energy: 0.8488773154496663
Energy: 0.8163174873484937
Energy: 0.8372667819597416
Energy: 0.813509383890804
Energy: 0.782717952442434
Energy: 0.8645900646704215
Energy: 0.8864824330471082
Energy: 0.9230962781486252
Energy: 0.9357443736764394
Energy: 0.9315885216903719
Energy: 0.8792733561101463
Energy: 0.816324170043413
Energy: 0.8373819919246243
Energy: 0.7694211149553198
Energy: 0.8190103789086551
Energy: 0.8106611876601548
Energy: 0.8074957288356531
Energy: 0.8721979302394531
Energy: 0.8641526253656702
Energy: 0.811800343257111
Energy: 0.8359979901202454
Energy: 0.8713306352173963
Energy: 0.8269345470596285
Energy: 0.8238941913417249
Energy: 0.8606334299628088
Energy: 0.7672186365393656
Energy: 0.8155824723730807
Energy: 0.9310465118697901
Energy: 0.8302086316588707
Energy: 0.9802467144167333
Energy: 0.9766216829396218
Energy: 0.8308850596718099
Energy: 0.8183775098646763
Energy: 0.8424377337525093
Energy: 0.8568932080066247
Energy: 0.7753843103494316
Energy: 0.8447740341170826
Energy: 0.8739529426503504
Energy: 0.8102320869350264
Energy: 0.9636247615794273
Energy: 0.8121437459051831
Energy: 0.8993266098990019
Energy: 0.7953030439785596
Energy: 0.8150489208708792
Energy: 0.9039124861455351
Energy: 0.8083490478420161
Energy: 0.8166540450781409
Energy: 0.87028131713945
Energy: 0.8800516478802706
Energy: 0.8119237398130079
Energy: 0.8657106256910329
Energy: 0.877673884373992
Energy: 0.8008330049032742
Energy: 0.7707726387508753
Energy: 0.8472663597232595
Energy: 0.8859293575785755
Energy: 0.8741904898922369
Energy: 0.884278481938969
Energy: 0.8907459973048153
Energy: 0.9071074705346621
Energy: 0.9037747181131925
Energy: 0.8310906814153781
Energy: 0.8944630213816341
Energy: 0.8621066023815236
Energy: 1.0018460934016176
Energy: 0.9371285703477801
Energy: 0.8617670622013119
Energy: 0.8851330046057592
Energy: 0.9205997094413747
Energy: 0.9573837459375373
Energy: 0.9318360122658732
Energy: 0.926753021298013
Energy: 0.8266720394008699
Energy: 0.9235943251017871
Energy: 0.8274709605445962
Energy: 0.9258142874898647
Energy: 0.8788303267721825
Energy: 0.8257151832911375
Energy: 0.8390134801076825
Energy: 0.9255655290577286
Energy: 0.8750236283327261
Energy: 0.9286903842098075
Energy: 0.8461994191130235
Energy: 1.0344042218762268
Energy: 1.0204211931593854
Energy: 0.8113276431102391
Energy: 0.9486488314374041
Energy: 0.9706385471374072
Energy: 0.9537715777582161
Energy: 0.8380143102648461
Energy: 0.8428286240327594
Energy: 0.7961825215316429
Energy: 0.8504117109638863
Energy: 0.7704738560544717
Energy: 0.9161335919329713
Energy: 0.8482962023231924
Energy: 0.911263078945595
Energy: 0.8661835615220537
Energy: 0.7870560569574138
Energy: 0.8549705520887717
Energy: 0.7691691623994854
Energy: 0.9240545006465224
Energy: 0.9799843218661465
Energy: 0.9285186441817418
Energy: 1.0245330591176427
Energy: 0.882723449710089
Energy: 0.8912989803071126
Energy: 0.9476406953010466
Energy: 0.8553533143197781

minimum gb energy = 0.7656725445851571 eV
minimum distance =  2.31496600406034 Angstroms
sigma value = 365


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

Energy: 0.8951200026149208
Energy: 1.1580284144322255
Energy: 0.8472395013466753
Energy: 0.8166470412875189
Energy: 0.8174153829594203
Energy: 0.8159562285167089
Energy: 0.9024018678260848
Energy: 0.8692897742155842
Energy: 0.9968934695281971
Energy: 0.8151880956091122
Energy: 0.8209581882782397
Energy: 0.8173535265105644
Energy: 0.8158900282395103
Energy: 0.9965728183501509
Energy: 0.8676331463785683
Energy: 1.1005557708585063
Energy: 0.8659658595641039
Energy: 0.8167693104157857
Energy: 0.8175384131689697
Energy: 0.8167068659053311
Energy: 0.8144207086076897
Energy: 0.8671506383236669
Energy: 1.0999787356547819
Energy: 0.8650893803855408
Energy: 0.8166635304265915
Energy: 0.8158193339899964
Energy: 0.8162813655135206
Energy: 0.9043043406149796
Energy: 0.8873480204641205
Energy: 0.9983603203534149
Energy: 0.874366220714458
Energy: 0.9962317169292331
Energy: 0.8162744405895511
Energy: 0.8734184993951617
Energy: 0.9965681500043024
Energy: 0.8713720654696789
Energy: 1.0999304870784825
Energy: 0.8500356005990446
Energy: 0.8176087207326931
Energy: 0.8182804012290734
Energy: 0.8466456782517887
Energy: 0.9026075327870049
Energy: 0.8698822684944475
Energy: 0.996516798811336
Energy: 0.8677951023358675
Energy: 0.8166946101174664
Energy: 0.8158357533938616
Energy: 0.8162747202255555
Energy: 0.9967317057369571
Energy: 0.868779569375602
Energy: 0.995514357122057
Energy: 0.867381334982006
Energy: 0.817035237025731
Energy: 0.8157350166567113
Energy: 0.8163388759406857
Energy: 0.9979351532836143
Energy: 0.8687397780325934
Energy: 1.1003088127095735
Energy: 0.8650543347880848
Energy: 0.8166075672996155
Energy: 0.8158847116938457
Energy: 0.8164527982947273
Energy: 0.9038512104829108
Energy: 0.8870515560062052
Energy: 0.9986265105927402
Energy: 0.8744221916467726
Energy: 0.9955091777661026
Energy: 1.1292136901937024
Energy: 0.8733082119476598
Energy: 0.999157818240423
Energy: 0.8677298346026876
Energy: 1.100478750390513
Energy: 0.8653367248865083
Energy: 0.8168497665197463
Energy: 0.8159574109714813
Energy: 0.8165097749350947
Energy: 0.9040711053050018
Energy: 0.86844198725399
Energy: 0.9953479181151919
Energy: 0.8662609968474424
Energy: 0.8170340890672219
Energy: 0.8155119384090027
Energy: 0.8650045032897481
Energy: 0.9973641623642477
Energy: 0.8691239182702516
Energy: 0.9958648957455459
Energy: 0.8160434897775278
Energy: 0.8168373106600842
Energy: 0.8181265690306488
Energy: 0.8160708030072062
Energy: 0.9972586552380667
Energy: 0.8710331091094495
Energy: 1.1005666350082508
Energy: 0.8552714959135488
Energy: 0.8181639821738923
Energy: 0.8179167953700874
Energy: 0.8506602974040577
Energy: 0.9027201008290364
Energy: 0.8876651048641467
Energy: 0.9984028634882872
Energy: 0.8748872016107507
Energy: 0.8169742851078884
Energy: 0.816238132885726
Energy: 0.8146808139276668
Energy: 0.998129171084988
Energy: 0.8673099646735223
Energy: 1.1004140285047193
Energy: 0.8653823017415506
Energy: 0.8159329271298987
Energy: 0.81747168655415
Energy: 0.8169951703431664
Energy: 0.8158332860140748
Energy: 0.8673466989228901
Energy: 1.1001761456381605
Energy: 0.8655194306413072
Energy: 0.8166913804976306
Energy: 0.8155464515612232
Energy: 0.8165821979130056
Energy: 0.8148852132421827
Energy: 0.8880250382621526
Energy: 0.9975657325905191
Energy: 0.8643543327351426
Energy: 0.8169406676756394
Energy: 0.8155411273359165
Energy: 0.8168135098714991
Energy: 0.9968612062606115
Energy: 0.8875894514554178
Energy: 1.1004435312301448
Energy: 0.8531740762990264
Energy: 0.8181008932810038
Energy: 0.8191472645560772
Energy: 0.8505077633991511
Energy: 0.902535038061067
Energy: 0.8692084967563412
Energy: 0.9963780782399686
Energy: 0.8160474392216459
Energy: 0.8179616151852884
Energy: 0.8170061195173589
Energy: 0.8146024036449736
Energy: 0.9969031534078435

minimum gb energy = 0.8144207086076897 eV
minimum distance =  2.36577712736497 Angstroms
sigma value = 23