Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_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=3.614960119128228
cohesive_energy=3.540273420316517
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, 2.1520917200878197e-19, 1.2810571777772818e-19, 1.8460279176947998e-20, -1.210229755318044e-19, -3.02069576044458e-19, -5.43416657660316e-19, -8.71540830126882e-19, -1.3221818476187938e-18, -1.9495926153165598e-18, -2.8463148556000197e-18, -4.2011795043757795e-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: 0.016723938847060003
Energy: 0.017892674842900785
Energy: 0.26409869693638693
Energy: 0.6597803408005873
Energy: 0.6588492067847813
Energy: 0.22567141047402525
Energy: 0.01784006150087982
Energy: 0.01738196653698478
Energy: 0.5539990557309522
Energy: 0.17383465214179192
Energy: 0.2641036135457978
Energy: 0.5271108623224172
Energy: 0.018038985557200363
Energy: 0.08427629010756248
Energy: 0.017370158861038335
Energy: 0.5561000417037961
Energy: 0.18692467898460094
Energy: 0.2641687443171759
Energy: 0.563324020230291
Energy: 0.08340013447418711
Energy: 0.08435924370335582
Energy: 0.019152337657302697
Energy: 0.5279811785806166
Energy: 0.26438517771526066
Energy: 0.6584535049265977
Energy: 0.5552139231494426
Energy: 0.08368178402001339
Energy: 0.017804753134610548
Energy: 0.08407677413068924
Energy: 0.6619511745733355
Energy: 0.1741432056822808
Energy: 0.26447663819812534
Energy: 0.5271912508344044
Energy: 0.017661152743655338
Energy: 0.0837953273195948
Energy: 0.017112669345760487
Energy: 0.5563703917921363
Energy: 0.268210662956016
Energy: 0.2643788259920247
Energy: 0.5645407202176128
Energy: 0.08328330872734487
Energy: 0.08433960758220907

minimum gb energy = 0.016723938847060003 eV
minimum distance =  2.53379919061066 Angstroms
sigma value = 5


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

Energy: 0.9221751104692965
Energy: 0.7810307118977116
Energy: 0.9441462524200607
Energy: 0.8751831214667539
Energy: 0.9098990228929913
Energy: 0.8758772894296013
Energy: 0.780876606500471
Energy: 0.777828461236649
Energy: 0.8480276121953962
Energy: 0.7814597979630824
Energy: 0.8472426510098545
Energy: 0.8022382396647996
Energy: 0.7894492757466451
Energy: 0.8602909452921619
Energy: 0.7858051407242234
Energy: 0.8639023748082509
Energy: 0.797240008576221
Energy: 0.8361665932416431
Energy: 0.8492771113531538
Energy: 0.9198654870618475
Energy: 0.8677766401324233
Energy: 0.7993476053236896
Energy: 0.8558097708774313
Energy: 0.7946676979156874
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Energy: 0.8304748731721555
Energy: 0.7848652077862802
Energy: 0.8224377337793591
Energy: 0.8914174917995185
Energy: 0.7902674235119321
Energy: 0.8410063777656502
Energy: 0.8228264476730944
Energy: 0.877628594910197
Energy: 0.8421510062141196
Energy: 0.8781507725304896
Energy: 0.8252321753167251
Energy: 0.8574287115713465
Energy: 0.7869967349653473
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Energy: 0.7993831036698948
Energy: 0.848994879885178
Energy: 0.8632062139835999
Energy: 0.8231247406392405
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Energy: 0.8043413082652464
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Energy: 0.8642642142746847
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Energy: 0.8456369089481381
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Energy: 0.8387618241110091
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Energy: 0.796996747105245
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Energy: 0.8428884777461886
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Energy: 0.8567289842085353
Energy: 0.8939313029298367
Energy: 0.8226808520775273
Energy: 0.8738343198477857
Energy: 0.7930537623352103
Energy: 0.8307961008712521
Energy: 0.8162782324253214
Energy: 0.7907800847704182
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Energy: 0.8222129936113491
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Energy: 0.8411515518929443
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Energy: 0.8351232709802316
Energy: 0.8092505576507625
Energy: 0.8072728676005656
Energy: 0.8778374177537467
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Energy: 0.8835067643295103
Energy: 0.8733158673786686
Energy: 0.9034724087310495
Energy: 0.7960958527035357
Energy: 0.8384507883489648
Energy: 0.8893454543242489
Energy: 0.8449058639797791
Energy: 0.8405777088345915
Energy: 0.8621904893395734
Energy: 0.8632084771597917
Energy: 0.8649117350233522
Energy: 0.8846905570370568
Energy: 0.8331999748482513
Energy: 0.8098628077364858
Energy: 0.8201163371750713
Energy: 0.8335891976913841
Energy: 0.9196518016856464
Energy: 0.8546232902499228
Energy: 0.8433739540858106
Energy: 0.8516800901018314
Energy: 0.7780690397509068
Energy: 0.7887535059317471
Energy: 0.796441459446596
Energy: 0.7958958917453514
Energy: 0.8370190942924046
Energy: 0.9145676338839273
Energy: 0.795372967135732
Energy: 0.8765406556066335
Energy: 0.8867269033796751
Energy: 0.8841768195922096
Energy: 0.8172231259273601
Energy: 0.8572139806334262
Energy: 0.8029302728945922
Energy: 0.8939433989031325
Energy: 0.7772919142090278
Energy: 0.8095417102047558
Energy: 0.8144462543183031
Energy: 0.811108882090911
Energy: 0.823987345742221
Energy: 0.9983560356047853
Energy: 0.8107143630536688
Energy: 0.8677411045025222
Energy: 0.882774071210001
Energy: 0.8630987725406902
Energy: 0.8426908226137879
Energy: 0.8001481945334216
Energy: 0.8077581361590094
Energy: 0.8601388214435904
Energy: 0.7978948816845568
Energy: 0.8076934093271108
Energy: 0.7781374584483867
Energy: 0.781200259876926
Energy: 0.8219036349411878
Energy: 0.794446524101307
Energy: 0.8286868151229075
Energy: 0.8925504830418998
Energy: 0.8534095846273169
Energy: 0.8764856290777662
Energy: 0.8536327150898358
Energy: 0.8370893058221752

minimum gb energy = 0.7772919142090278 eV
minimum distance =  2.29403052805042 Angstroms
sigma value = 401


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

Energy: 0.9769282414456587
Energy: 0.8411054781113377
Energy: 0.8260693918602571
Energy: 0.8221852916259871
Energy: 0.8576466764405587
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Energy: 0.9123710247345681
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Energy: 0.9070307391017784
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Energy: 0.9156800002908521
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Energy: 0.8077918443676458
Energy: 0.8172063702801974
Energy: 0.8007714551132363
Energy: 0.8171597171707442
Energy: 0.8848154146408465
Energy: 0.8215742519683388
Energy: 0.8324281486010904
Energy: 0.8060528137788316
Energy: 0.8146119537738296
Energy: 0.7998426050781924
Energy: 0.8211064919291502
Energy: 0.8614594912200643
Energy: 0.8763841983207319
Energy: 0.8804322727313724
Energy: 0.8044600116075609
Energy: 0.8126075157579288
Energy: 0.7998550410058578
Energy: 0.9847131703101683
Energy: 0.8781802057724597
Energy: 0.7987703083633636
Energy: 0.8315066755368177
Energy: 0.8176015202419749
Energy: 0.8136094750909281
Energy: 0.8224374050234359
Energy: 0.9079942712574678
Energy: 0.8549524516387946
Energy: 0.8164940749788784
Energy: 0.8471952075025357
Energy: 0.8055051603060247
Energy: 0.8373051300604547
Energy: 0.7956882892159696
Energy: 0.806448395622225
Energy: 0.7938295565044163
Energy: 0.7972775700531062
Energy: 0.8069577029752211
Energy: 0.839315340809336
Energy: 0.8049038056771168
Energy: 0.799553397097095
Energy: 0.8707159000659079
Energy: 0.802754696171834
Energy: 0.7995977479789605
Energy: 0.8097830477093865
Energy: 0.8371217631032845
Energy: 0.8195268902526849
Energy: 0.8480891439675086
Energy: 0.8560286891222155
Energy: 0.8025862710012822
Energy: 0.8116280987156533
Energy: 0.8098017276571798
Energy: 0.817281298107292
Energy: 0.8101234270228868
Energy: 0.8133782070523283
Energy: 0.9023285891129844
Energy: 0.8103079855066645
Energy: 1.0360114150765327
Energy: 0.8877264850357192
Energy: 0.7951707087339491
Energy: 0.834404119745737
Energy: 0.8119898802883981
Energy: 0.8295233540393195
Energy: 0.8746664386548363
Energy: 0.8094671525312521
Energy: 0.8404967674991256
Energy: 0.8094071184678553
Energy: 0.8136841447996054
Energy: 0.8221897916301703
Energy: 0.807793526527268
Energy: 0.8749000551633979
Energy: 0.9458302812042737
Energy: 0.8187491447555115
Energy: 0.8123696533723495
Energy: 0.8340244987927835
Energy: 0.8025761840255037
Energy: 0.8141945513242524
Energy: 0.9735321683384986
Energy: 0.8205393077880325
Energy: 0.8204585247913475
Energy: 0.8015749218123239
Energy: 0.8194304948787231
Energy: 0.8236983055789946
Energy: 0.8014138874893151
Energy: 0.8847224083029896
Energy: 0.8466183252008883
Energy: 0.9036233125075923
Energy: 0.7955072732073853
Energy: 0.8314398081364127
Energy: 0.8073081530009567
Energy: 0.8470221189151281
Energy: 0.8782150448929702
Energy: 0.852173119622196
Energy: 0.8241578933934517
Energy: 0.8093312834747483
Energy: 0.8004492103383963
Energy: 0.8079323738617706
Energy: 0.8657667155945861
Energy: 0.8324859651207666
Energy: 0.8007954297780961
Energy: 0.8319639386396901
Energy: 0.8114778485004264
Energy: 0.8462951272073002
Energy: 0.8239399100478746
Energy: 0.8228996149796171
Energy: 0.8375399989314705
Energy: 0.8088008282100556
Energy: 0.8105300709749411
Energy: 0.8266579466588739
Energy: 0.7959039574375139
Energy: 0.8183021338574308
Energy: 0.8892563498201216
Energy: 0.8255705284883443

minimum gb energy = 0.793496000203281 eV
minimum distance =  2.27319333455339 Angstroms
sigma value = 311


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

Energy: 0.8515918893642153
Energy: 0.8082809727978664
Energy: 0.889474962410726
Energy: 0.7975044788753924
Energy: 0.8379373937782006
Energy: 0.858268931487179
Energy: 0.8363337412381087
Energy: 0.8246671630257074
Energy: 0.8606294474459184
Energy: 0.8380657485297623
Energy: 0.8322132462823583
Energy: 0.8419425122211522
Energy: 0.8356183348331644
Energy: 0.8673225621345856
Energy: 0.807571073869565
Energy: 0.829968889607025
Energy: 0.827926119557894
Energy: 0.8627584374563214
Energy: 0.8399123095171016
Energy: 0.8342658889428324
Energy: 0.8290747021675365
Energy: 0.8155087157664578
Energy: 0.8419556125733516
Energy: 0.8243760104645308
Energy: 0.8451010365505277
Energy: 0.8571931284081805
Energy: 0.8802254516550435
Energy: 0.8678045809135182
Energy: 0.8457069938292465
Energy: 0.8323105891874961
Energy: 0.829676009409203
Energy: 0.8263501334354488
Energy: 0.842496436326793
Energy: 0.8225012616219961
Energy: 0.8446142881460718
Energy: 0.8272122883968989
Energy: 0.8025296815128808
Energy: 0.8166443353723866
Energy: 0.8263979380683975
Energy: 0.859752317426544
Energy: 0.816145909577602
Energy: 0.8227913149738468
Energy: 0.8902016335519068
Energy: 0.8182667591090939
Energy: 0.856264943358241
Energy: 0.8190400707855738
Energy: 0.82201424476594
Energy: 0.8446058335870623
Energy: 0.8665321477691201
Energy: 0.8272797031501918
Energy: 0.8300872797673862
Energy: 0.8179269351166704
Energy: 0.8236483525481978
Energy: 0.8529124483441015
Energy: 0.8584211680380268
Energy: 0.8369648816960604
Energy: 0.8304388595844294
Energy: 0.8335594914551944
Energy: 0.8391338006911979
Energy: 0.8325683137338997
Energy: 0.8322813763891778
Energy: 0.8139426069052784
Energy: 0.8300501872976075
Energy: 0.8253618464695816
Energy: 0.8737064068457726
Energy: 0.8348576981776946
Energy: 0.8170195419773492
Energy: 0.8795463917293247
Energy: 0.8196614339120968
Energy: 0.8288492681704064
Energy: 0.8518078978762988
Energy: 0.813513365746867
Energy: 0.8366877817139287
Energy: 0.827028946370707
Energy: 0.8490087560040327
Energy: 0.8233051191595168
Energy: 0.844372583059872
Energy: 0.830484430489398
Energy: 0.8184174355633127
Energy: 0.8099239441875208
Energy: 0.8129565131418933
Energy: 0.8384083340531799
Energy: 0.8293735031335945
Energy: 0.8442023292510098
Energy: 0.8364268098819697
Energy: 0.8590682315735887
Energy: 0.8728055626213619
Energy: 0.8225813113355419
Energy: 0.8398369840470372
Energy: 0.8155322629788087
Energy: 0.8728326761839852
Energy: 0.8488435967831824
Energy: 0.8556101075721987
Energy: 0.8268090208988841
Energy: 0.8696023564321882
Energy: 0.904025995999224
Energy: 0.8888279356419875
Energy: 0.8829360445134226
Energy: 0.8185335614424958
Energy: 0.8307713568075792
Energy: 0.8531149659029753
Energy: 0.8357838473918242
Energy: 0.8403031092375856
Energy: 0.8054073185928396
Energy: 0.8613310863127428
Energy: 0.829522085191458
Energy: 0.8625416036832172
Energy: 0.8444449578815197
Energy: 0.8303307169654616
Energy: 0.8624598643025041
Energy: 0.8210791447366872
Energy: 0.8339431404502183
Energy: 0.8632262824424405
Energy: 0.817078744085554
Energy: 0.8285450140014903
Energy: 0.8294554987098137
Energy: 0.8485401415350438
Energy: 0.8366586410785071
Energy: 0.8442115993632023
Energy: 0.8090290754555477
Energy: 0.9028338949773937
Energy: 0.8207200545353383
Energy: 0.8123542890219638
Energy: 0.8353426773261118
Energy: 0.8127752207415303
Energy: 0.8655428594622262
Energy: 0.833734859218503
Energy: 0.8275848424833597
Energy: 0.8671129692303965
Energy: 0.850231398924051
Energy: 0.8404730761242902
Energy: 0.8396036051839644
Energy: 0.8607368218798719
Energy: 0.8250575652519211
Energy: 0.8915131384454811
Energy: 0.8544983799870466
Energy: 0.8690690629698197
Energy: 0.9126209896935635
Energy: 0.8894575443331441
Energy: 0.93456346828024
Energy: 0.84119055787694
Energy: 0.804433865781259
Energy: 0.8431607944675953
Energy: 0.8773264197161382
Energy: 0.85537127672372
Energy: 0.8496123292955238
Energy: 0.8308964780357588
Energy: 0.8167478670331296
Energy: 0.852394459422353
Energy: 0.8202405069292363
Energy: 0.8022762340780859
Energy: 0.836511671863255
Energy: 0.7950416907696048
Energy: 0.8545025047221787
Energy: 0.8519448359683581
Energy: 0.8377483200871632
Energy: 0.8318988724112261
Energy: 0.859658854877242
Energy: 0.8445465203277049
Energy: 0.8652610876339393
Energy: 0.8238625780675828
Energy: 0.8626494087243396
Energy: 0.8623824800473798
Energy: 0.8329583388321029
Energy: 0.8222197825076865
Energy: 0.819737078890261
Energy: 0.8119511211944627
Energy: 0.8486909220173907
Energy: 0.8436130756036314
Energy: 0.8229993382286528
Energy: 0.8528705122887917
Energy: 0.8181822744411907
Energy: 0.8362386236204626
Energy: 0.825153239967797
Energy: 0.8646081796565337
Energy: 0.8536087099754167
Energy: 0.8631365661412091
Energy: 0.8218625717973507
Energy: 0.8777297008176707
Energy: 0.8436092311167009
Energy: 0.8756336023211831
Energy: 0.8362543604222713
Energy: 0.8045804297370495
Energy: 0.8551017405425086
Energy: 0.8381140257763815
Energy: 0.8189844009440025
Energy: 0.8524817955098287
Energy: 0.8472879194237674
Energy: 0.8550668565895707
Energy: 0.8344300036880345
Energy: 0.8902391401126795
Energy: 0.8876555278143644
Energy: 0.8095790124905777
Energy: 0.8523538775276707
Energy: 0.8019149486207717
Energy: 0.8431612287600703
Energy: 0.8445158642847934
Energy: 0.8381206195266219
Energy: 0.8288785486396252
Energy: 0.8193363547043921
Energy: 0.8421041215388736
Energy: 0.8107551205269382
Energy: 0.8275028971714561
Energy: 0.8823797285108124
Energy: 0.8656484405327743
Energy: 0.8188807816084226
Energy: 0.8300050269351508
Energy: 0.8442122755346092
Energy: 0.8160450443848005
Energy: 0.8296416297481193
Energy: 0.8268133782001272
Energy: 0.807615071602546
Energy: 0.8340772876318011
Energy: 0.8174673899247222
Energy: 0.8306342843260165
Energy: 0.8030295672298953
Energy: 0.8186901310362188
Energy: 0.8282153981503121
Energy: 0.8576934577919407
Energy: 0.8287722496534807
Energy: 0.8718492636789326
Energy: 0.848946959146817
Energy: 0.8202208127300287
Energy: 0.8346664752656879
Energy: 0.859289915699376
Energy: 0.855638583909318
Energy: 0.8149095055980621
Energy: 0.8136322595350468
Energy: 0.8787937778769098
Energy: 0.8267794837106649
Energy: 0.8364633674628138
Energy: 0.8052631838235703
Energy: 0.8484541822507043
Energy: 0.8539963767087311
Energy: 0.8349839004251054
Energy: 0.8627786348981353
Energy: 0.8450010035250186
Energy: 0.8207527071052851
Energy: 0.8302520346644889
Energy: 0.805230865028292
Energy: 0.8551495777592856
Energy: 0.831682918471832
Energy: 0.8462500984663853
Energy: 0.8341930491422236
Energy: 0.858290945111203
Energy: 0.8528920631532095
Energy: 0.8733227515670713
Energy: 0.8886129155764242
Energy: 0.8425075752796681
Energy: 0.8592754294967389
Energy: 0.856549994760396
Energy: 0.8693839461070013

minimum gb energy = 0.7950416907696048 eV
minimum distance =  2.27881978736269 Angstroms
sigma value = 39


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

Energy: 0.7750198078325857
Energy: 0.777421696691546
Energy: 1.0992153464447674
Energy: 0.9584118795347922
Energy: 0.9324508838460535
Energy: 0.8945216134376905
Energy: 0.7544116029384271
Energy: 0.7536098337287626
Energy: 0.8274377171096678
Energy: 0.8922408438625417
Energy: 0.895372379846487
Energy: 0.8293522088428436
Energy: 0.8175709930363404
Energy: 0.831112220696008
Energy: 0.8171310753431149
Energy: 0.8281025557506518
Energy: 0.8458056762547447
Energy: 0.877964871178077
Energy: 0.8290697581758583
Energy: 0.8165978663081593
Energy: 0.8160697436615162
Energy: 0.8312559770714707
Energy: 0.8278516936632181
Energy: 0.9090748045414289
Energy: 0.8395794894403242
Energy: 0.8775677646403459
Energy: 0.892572095599018
Energy: 0.8964278073232197
Energy: 0.8219248920787341
Energy: 0.828563304035269
Energy: 0.884250380939537
Energy: 0.817833851106778
Energy: 0.8552763323508308
Energy: 0.8194573080701152
Energy: 0.8159241437317782
Energy: 0.7536020023017671
Energy: 0.8279328505788027
Energy: 0.8178996125042093
Energy: 0.8301590364844756
Energy: 0.8309263306917002
Energy: 0.8156564103066318
Energy: 0.8470372545145093
Energy: 0.8324957843596735
Energy: 0.8320906967771992
Energy: 0.8153094118860582
Energy: 0.8910348214060887
Energy: 0.7560224755674326
Energy: 0.7546817513176576
Energy: 0.8287285450386737
Energy: 0.7559849518864662
Energy: 0.8284086248714564
Energy: 0.8980901152430317
Energy: 0.8269610227751657
Energy: 0.8950500572627649
Energy: 0.8173287373754641
Energy: 0.8295485333852586
Energy: 0.7546867484868167
Energy: 0.828349268960697
Energy: 0.9009119249807473
Energy: 0.8272874246518741
Energy: 0.8257920241914379
Energy: 0.8165546200066212
Energy: 0.8293272219283409
Energy: 0.8322060130753615
Energy: 0.834380362954412
Energy: 0.894922959313936
Energy: 0.8781791578986828
Energy: 0.8215119842710986
Energy: 0.816431236682042
Energy: 0.8157210687696624
Energy: 0.833698805979345
Energy: 0.8264180488815274
Energy: 0.8418816499935027
Energy: 0.8259014812360435
Energy: 0.8313500232642838
Energy: 0.8309196299530649
Energy: 0.820583381525531
Energy: 0.8299379128681673
Energy: 0.8273006755933279
Energy: 0.8227155766749054
Energy: 0.825879474504374
Energy: 0.8975469001911454
Energy: 0.8165520154047389
Energy: 0.8205169777755388
Energy: 0.7560742404371109
Energy: 0.8278216741954256
Energy: 0.8957950294704925
Energy: 0.8201133628566999
Energy: 0.8862429440273424
Energy: 0.8949019681084875
Energy: 0.8160790866832938
Energy: 0.83074130058779
Energy: 0.8264980095482728
Energy: 0.8181007766035276
Energy: 0.894495016890491
Energy: 0.7557351827621284
Energy: 0.7551352558240434
Energy: 0.8290058453327215
Energy: 0.7534999380341549
Energy: 0.8319391349942931
Energy: 0.8157020527556275
Energy: 0.8874083043376095
Energy: 0.7539767723566393
Energy: 0.754517368046695
Energy: 0.8306398963003246
Energy: 0.7539629711691593
Energy: 0.8280511599474766
Energy: 0.8462488649450396
Energy: 0.820437228053012
Energy: 0.9336570209188713
Energy: 0.8956362421885319
Energy: 0.7544542374027111
Energy: 0.822459255342433
Energy: 0.8276273257906677
Energy: 0.892134995686436
Energy: 0.8960138453269312
Energy: 0.829272956486941
Energy: 0.8176464415434198
Energy: 0.830658345451729
Energy: 0.8174950606856034
Energy: 0.8265526979280625
Energy: 0.8458883157167015
Energy: 0.8787000033750314
Energy: 0.8289569609262478
Energy: 0.8220908905613515
Energy: 0.8161342385323043
Energy: 0.8310494171985702
Energy: 0.829034105368417
Energy: 0.909064933097151
Energy: 0.838559417463426
Energy: 0.8774027583511568
Energy: 0.8925823451219552
Energy: 0.936026486549832
Energy: 0.8219504658956911
Energy: 0.8285921856617385
Energy: 0.8844028513230355
Energy: 0.8178253944519621
Energy: 0.87220394014576
Energy: 0.8200707538766464
Energy: 0.8161632897282073
Energy: 0.7535002143386177
Energy: 0.8281895265796285
Energy: 0.816723854984716
Energy: 0.8303136862356705
Energy: 0.8308540377798289
Energy: 0.7542092331963979
Energy: 0.8443657906652695
Energy: 0.8332157194174986
Energy: 0.8308833979542518
Energy: 0.815529710440282
Energy: 0.88818961987817
Energy: 0.7560868431518767
Energy: 0.7547461732143762
Energy: 0.8288930121692513
Energy: 0.7558610109445542
Energy: 0.8283441311366944
Energy: 0.8988022345050353
Energy: 0.8271699826194271
Energy: 0.8952639273470641
Energy: 0.901206662222026
Energy: 0.8289157829135508
Energy: 0.7546117596246246
Energy: 0.828229688345302
Energy: 0.8837110401778637
Energy: 0.8266213572511066
Energy: 0.8258698204169034
Energy: 0.818060884966956
Energy: 0.829401036105538
Energy: 0.832425920049467
Energy: 0.8351363060546251
Energy: 0.8953313882877685
Energy: 0.8778001540833086
Energy: 0.8217423331075168
Energy: 0.8167288528555358
Energy: 0.8160920031832464
Energy: 0.8333019584373609
Energy: 0.8263945624960716
Energy: 0.8414469136754081
Energy: 0.8264108132603145
Energy: 0.8294864711329182
Energy: 0.8174931115510361
Energy: 0.8691662099869087
Energy: 0.8293301489538951
Energy: 0.8279917550168348
Energy: 0.8232736809581734
Energy: 0.825928259016664
Energy: 0.8871385422087682
Energy: 0.817628035082543
Energy: 0.8207067216691257
Energy: 0.7552537806737267
Energy: 0.8277303568337209
Energy: 0.8958313541178291
Energy: 0.819898140246491
Energy: 0.8855959115471603
Energy: 0.893958956996494
Energy: 0.8166016280081858
Energy: 0.8314142948875769
Energy: 0.8267117869353124
Energy: 0.8174900488030381
Energy: 0.8944481110039307
Energy: 0.7557020192402217
Energy: 0.7552775857243339
Energy: 0.8288531330905615
Energy: 0.7533971184861273
Energy: 0.8317555670775456
Energy: 0.8155444048270526
Energy: 0.8286642787984915
Energy: 0.7540429962854355
Energy: 0.7545084770018236
Energy: 0.8309044263954538

minimum gb energy = 0.7533971184861273 eV
minimum distance =  2.36726991266053 Angstroms
sigma value = 21


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

Energy: 1.0722308859493908
Energy: 0.8899014161197578
Energy: 0.873727007140955
Energy: 0.8249959344698985
Energy: 0.8395764697622403
Energy: 0.8423130232892795
Energy: 0.8324201695159247
Energy: 0.8620199517590279
Energy: 0.8264265564335748
Energy: 0.8842296121261175
Energy: 0.8337348671981057
Energy: 0.8617154811217659
Energy: 0.8486070380547583
Energy: 0.8943331983799383
Energy: 0.8592888548731716
Energy: 0.8338757576008359
Energy: 0.8561444743166817
Energy: 0.8786439432483382
Energy: 0.8504068092708014
Energy: 0.8197099209115544
Energy: 0.845409235960165
Energy: 0.9667744663501389
Energy: 0.8851207707763462
Energy: 0.8251933382222396
Energy: 0.8394125696309228
Energy: 0.7827792942387899
Energy: 0.8087029470530148
Energy: 0.8716084775098856
Energy: 0.763853644011422
Energy: 0.805874075629823
Energy: 0.823252359942748
Energy: 0.7941988783407686
Energy: 0.8074127067152301
Energy: 0.8326641685469971
Energy: 0.8218800070301957
Energy: 0.7806860655820564
Energy: 0.7960682533970533
Energy: 0.847033485173254
Energy: 0.7475118139527597
Energy: 0.8538803541330118
Energy: 0.8360525091957743
Energy: 0.8224067692642553
Energy: 0.9227031827460052
Energy: 0.8172918862290989
Energy: 0.7935317026656938
Energy: 0.8487614653384697
Energy: 0.8061891592494047
Energy: 0.8039117840824732
Energy: 0.8252250123185597
Energy: 0.812272192976149
Energy: 0.8234870779960731
Energy: 0.8409675617959925
Energy: 0.8314377687269761
Energy: 0.8215496325161259
Energy: 0.836533634665558
Energy: 0.8278496226497812
Energy: 0.8202196500066653
Energy: 0.8442043266609118
Energy: 0.8511461879402895
Energy: 0.8498402971284148
Energy: 0.7957737000563797
Energy: 0.8893047490202823
Energy: 0.835439513070423
Energy: 0.8951360597622765
Energy: 0.8036583339568333
Energy: 0.7624297999019536
Energy: 0.8297091975216225
Energy: 0.7970137326800794
Energy: 0.8350642188215872
Energy: 0.8487231784398037
Energy: 0.827168073767208
Energy: 0.8573537690953842
Energy: 0.8211832064559084
Energy: 0.8753801532073737
Energy: 0.8097197439948167
Energy: 0.8257617818533615
Energy: 0.8576051188205868
Energy: 0.8269593521215277
Energy: 0.8520394913899645
Energy: 0.8864546842457564
Energy: 0.8043975759994195
Energy: 0.7960312185996102
Energy: 0.9106471102807092
Energy: 0.8535786241773724
Energy: 0.9770153897838696
Energy: 0.8278387858248063
Energy: 0.7727098915917168
Energy: 0.7805305889279
Energy: 0.8183462782020053
Energy: 0.8024474243352057
Energy: 0.7758522065571638
Energy: 0.7596255970131046
Energy: 0.7873743334075199
Energy: 0.8160232852060895
Energy: 0.8926042098256041
Energy: 0.8300511694005884
Energy: 0.8349489266591782
Energy: 0.7873258845866035
Energy: 0.8256122068602979
Energy: 0.8571401879711664
Energy: 0.8643173680167007
Energy: 0.8301315156439375
Energy: 0.9404098207219767
Energy: 0.8454951739725443
Energy: 0.8538412045269764
Energy: 0.9246040320315311
Energy: 0.8481526633036647
Energy: 0.8025470590286856
Energy: 0.8502757585648646
Energy: 0.8162969253945944
Energy: 0.8627762570156188
Energy: 0.844361503012909
Energy: 0.7643692268578033
Energy: 0.888657330109429
Energy: 0.7934458154319272
Energy: 0.7469308908828107
Energy: 0.7889541589793203
Energy: 0.8424028405875051
Energy: 0.8676307834010112
Energy: 0.7792614903280765
Energy: 0.8190828993995733
Energy: 0.8801508290301842
Energy: 0.7959269546102705
Energy: 0.8297701558460567
Energy: 0.8403047367476053
Energy: 0.8052979416269503
Energy: 0.7782540495079939
Energy: 0.7921403029148463
Energy: 0.8113089718792136
Energy: 0.8139236559798323
Energy: 0.7917197178768982
Energy: 0.7812206844944283
Energy: 0.8330474628453689
Energy: 0.8140854082308028
Energy: 0.8405591833927976
Energy: 0.8014000152156445
Energy: 0.8124700997555807
Energy: 0.77261960625835
Energy: 0.8242166200448647
Energy: 0.8224163059944791
Energy: 0.8132188012551426
Energy: 0.8254631914579589
Energy: 0.8272843295391602
Energy: 0.8186253325265871
Energy: 0.8086220671820995
Energy: 0.8313226926133924
Energy: 0.8405146178947699
Energy: 0.7634665775812564
Energy: 0.785081646969273
Energy: 0.8299116980402768
Energy: 0.8263593791020175
Energy: 0.7950083964082847
Energy: 0.8035081998009211
Energy: 0.7884211134084276
Energy: 0.8103624863270503
Energy: 0.8417236871924183
Energy: 0.8476342963866045
Energy: 0.8407988482376699
Energy: 0.8498397298351116
Energy: 0.900109143211972
Energy: 0.7955236852760006
Energy: 0.8127531262033142
Energy: 0.8268484376670874
Energy: 0.7997971028872252
Energy: 0.8794159982312021
Energy: 0.8049022990500847
Energy: 1.0111032684693577
Energy: 0.8414302480445788
Energy: 0.790689860548085
Energy: 0.8632660460982161
Energy: 0.844711481552681
Energy: 0.8657289706719957
Energy: 0.8184071845506197
Energy: 0.8381789109186161
Energy: 0.8191634781909549

minimum gb energy = 0.7469308908828107 eV
minimum distance =  2.32451177929447 Angstroms
sigma value = 113


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

Energy: 1.005481392913431
Energy: 0.9355086434201497
Energy: 1.0246207454916283
Energy: 0.9150470557021649
Energy: 0.8104837172989748
Energy: 0.9499431333408959
Energy: 0.9792468366304916
Energy: 0.9132718740292399
Energy: 0.9010818612195488
Energy: 0.8441054535301521
Energy: 0.8094343188770885
Energy: 0.8188019622200501
Energy: 0.8367517835229814
Energy: 0.9167828012057687
Energy: 1.01179143160334
Energy: 0.8992163822408914
Energy: 0.946011411751084
Energy: 0.8354356814764624
Energy: 0.7802119601183851
Energy: 0.88921568733524
Energy: 0.8972420079299847
Energy: 0.9074531163383309
Energy: 0.8738692478559841
Energy: 0.914471972577624
Energy: 0.8960182883656792
Energy: 1.019648928209531
Energy: 0.9493251720593187
Energy: 0.8843327632413615
Energy: 0.7728512412089725
Energy: 0.8443920015615759
Energy: 0.8482910363662501
Energy: 0.9074294924919271
Energy: 0.8640070707211183
Energy: 0.8846855438337198
Energy: 0.8693329702266782
Energy: 0.8636398012315221
Energy: 0.8710300677525448
Energy: 0.8939891653111487
Energy: 0.8653449830973796
Energy: 0.9023846226643328
Energy: 0.7988686636039859
Energy: 0.8777922857770347
Energy: 0.8824338378768751
Energy: 0.8474002807538337
Energy: 0.9178339688074145
Energy: 0.8046832240013475
Energy: 0.8519111292616498
Energy: 0.9466184925612469
Energy: 0.8381175219278117
Energy: 0.8438981310136543
Energy: 0.8376112863051698
Energy: 0.805418747860935
Energy: 0.7816873485001598
Energy: 0.8184808474605976
Energy: 0.8076929830224756
Energy: 0.8125044138771157
Energy: 0.7798947747032604
Energy: 0.855976861424376
Energy: 0.8847892027251217
Energy: 0.8735136240374424
Energy: 0.9279256181264938
Energy: 0.9309695834341402
Energy: 0.8147459532141833
Energy: 0.861628037498563
Energy: 0.86930840750102
Energy: 0.8145606947186784
Energy: 0.7993013710587049
Energy: 0.8152531442546027
Energy: 0.8168617364509497
Energy: 0.8436942118517163
Energy: 0.8668870920119102
Energy: 0.8416303008237154
Energy: 0.8302043874349061
Energy: 0.8732402191061452
Energy: 0.8256670363006529
Energy: 0.8064049075097262
Energy: 0.9016594941210653
Energy: 0.8001240936382715
Energy: 0.8164549261319647
Energy: 0.932097522555629
Energy: 0.8760399962903022
Energy: 0.9415073124180302
Energy: 0.97559853663668
Energy: 0.8118366377765329
Energy: 0.8821029699010391
Energy: 0.8368642570419516
Energy: 0.8574788403640032
Energy: 0.7721215151598666
Energy: 0.821643585115254
Energy: 0.8235955996425905
Energy: 0.8555193318833316
Energy: 0.9638930032768664
Energy: 0.8127062332221312
Energy: 0.834408157478935
Energy: 0.8279993016291323
Energy: 0.8447455794318908
Energy: 0.9045263196917533
Energy: 0.851055945687176
Energy: 0.8163192249980095
Energy: 0.9389830965817768
Energy: 0.9045827403590175
Energy: 0.8502213049831135
Energy: 0.8570649941415933
Energy: 0.8650124796242933
Energy: 0.8623581235490624
Energy: 0.7693838591174263
Energy: 0.8197370530934953
Energy: 0.8840276152469861
Energy: 0.881803797093488
Energy: 0.8197779342150037
Energy: 0.8996005681370877
Energy: 0.8479239968014568
Energy: 0.903614422872299
Energy: 0.8392148384363681
Energy: 0.8451577853783598
Energy: 0.8732026984133395
Energy: 0.8673829295038366
Energy: 1.0006345632530596
Energy: 0.8043961349904654
Energy: 0.8840436676545896
Energy: 0.9221811083350906
Energy: 0.9568831287696337
Energy: 0.9301092477913523
Energy: 0.9880097281808708
Energy: 0.8249289442531887
Energy: 0.868240122857421
Energy: 0.8732976133458048
Energy: 0.9297161694701764
Energy: 0.8743875697917327
Energy: 0.8962596721088255
Energy: 0.8731156824401125
Energy: 0.7781279929238415
Energy: 0.813129750368034
Energy: 0.928657248275688
Energy: 0.877323863336087
Energy: 0.9247726396664945
Energy: 0.8645088781416014
Energy: 0.8112234525852298
Energy: 0.9482813128786536
Energy: 0.8513157860454956
Energy: 0.9528083811526921
Energy: 0.9095084140800762
Energy: 0.8614849722101305
Energy: 0.9028186015463738
Energy: 0.8621552246877779
Energy: 0.7689513477714564
Energy: 0.9123104468861577
Energy: 0.8587145375332716
Energy: 0.8881945053768034
Energy: 0.8675401518399382
Energy: 0.8627456877624455
Energy: 0.8616235678967646
Energy: 0.7691868378046656
Energy: 0.9170953346717765
Energy: 0.9819774601137802
Energy: 0.901024935610449
Energy: 1.0258714945020142
Energy: 0.9213361954187834
Energy: 0.8118788247246264
Energy: 0.949964267553969
Energy: 0.97671749444262
Energy: 0.7661008502800721
Energy: 0.8732367228224989
Energy: 1.0072344279338894
Energy: 0.8681063046165008
Energy: 0.8754644984807761
Energy: 0.8317365024993717
Energy: 0.916228488201991
Energy: 0.8864867862285558
Energy: 0.8742036784125929
Energy: 0.9448454297996648
Energy: 0.9041429449181181
Energy: 1.0258067644456346
Energy: 0.8235663087950668
Energy: 0.9964293539818067
Energy: 0.9082202302511558
Energy: 0.8219539365846402
Energy: 0.8961362669188926
Energy: 0.8006335051505126
Energy: 0.9116710960030859
Energy: 0.9501192844592893
Energy: 0.9235267779858852
Energy: 0.7982337689170014
Energy: 0.846219404250959
Energy: 0.8398171173936901
Energy: 0.9082089017271547
Energy: 0.9004276627281219
Energy: 0.8881712389470443
Energy: 0.8496726262079535
Energy: 0.8640183568585822
Energy: 0.9109893231800869
Energy: 0.8903596238015327
Energy: 0.8109795055706853
Energy: 0.9045096139189954
Energy: 0.8860129204447349
Energy: 0.9080395710238234
Energy: 0.8397526224958424
Energy: 0.8316959351625748
Energy: 0.9003604634349404
Energy: 0.8208169337457173
Energy: 0.7997737346411744
Energy: 0.8939535422137186
Energy: 0.8429645614050312
Energy: 0.8912986207218848
Energy: 0.8368631279412376
Energy: 0.8563707616036281
Energy: 0.8488800595120477
Energy: 0.8163179198742363
Energy: 0.8372695168718283
Energy: 0.8135122359268863
Energy: 0.782720626874874
Energy: 0.8645926998945296
Energy: 0.8864849713298758
Energy: 0.9231012161638463
Energy: 0.9357477518354145
Energy: 0.9315911907237419
Energy: 0.8790661129856026
Energy: 0.816327299734748
Energy: 0.8373846482938738
Energy: 0.7694231553291139
Energy: 0.8190129496370906
Energy: 0.8106683862580997
Energy: 0.8075007651134286
Energy: 0.8721952308984978
Energy: 0.8641553394963354
Energy: 0.8118031191134387
Energy: 0.8360006153240375
Energy: 0.8713399619677403
Energy: 0.8269868020225438
Energy: 0.8239037203586873
Energy: 0.8606359788868134
Energy: 0.7672218831207375
Energy: 0.8155851983806294
Energy: 0.9310487940981543
Energy: 0.8301799594352509
Energy: 0.9802496219016833
Energy: 0.9766243539277819
Energy: 0.8308878930975961
Energy: 0.8180277347495976
Energy: 0.84244045211874
Energy: 0.8568959197836804
Energy: 0.7752721633109599
Energy: 0.8447772810366353
Energy: 0.8739556660961355
Energy: 0.810234972708205
Energy: 0.9636275020920662
Energy: 0.8121335109809769
Energy: 0.8993185335925317
Energy: 0.795360554163444
Energy: 0.8150502926141507
Energy: 0.9036485068495291
Energy: 0.8083354881211645
Energy: 0.8166567814335275
Energy: 0.8702839393249883
Energy: 0.8800730275870532
Energy: 0.8119336275249178
Energy: 0.8657136709754554
Energy: 0.8776754116203248
Energy: 0.8008347641407108
Energy: 0.7707753524819934
Energy: 0.8472692830536203
Energy: 0.8859321117152353
Energy: 0.874184362206473
Energy: 0.8842809989643124
Energy: 0.8907487200333799
Energy: 0.9071072084722714
Energy: 0.9037774265893537
Energy: 0.8309633551518285
Energy: 0.894463390241891
Energy: 0.8620020137871088
Energy: 1.0018489527314265
Energy: 0.9371312942316612
Energy: 0.8617690537998554
Energy: 0.8851355897489424
Energy: 0.9206030477772674
Energy: 0.9573864232382856
Energy: 0.9318389754812233
Energy: 0.9267557450164986
Energy: 0.8266748153624917
Energy: 0.9236341259275661
Energy: 0.827380111074967
Energy: 0.9257960695137667
Energy: 0.8788286360092535
Energy: 0.8257174754109627
Energy: 0.8390425885744175
Energy: 0.9253595789303417
Energy: 0.8761211772970335
Energy: 0.92869498714856
Energy: 0.8463271062137779
Energy: 1.0344069160766447
Energy: 1.0204229472762785
Energy: 0.8114294228661165
Energy: 0.9486492124829037
Energy: 0.9709379327626148
Energy: 0.953754048671928
Energy: 0.8380148933079247
Energy: 0.8428324148624177
Energy: 0.7962291247721097
Energy: 0.8504140672970265
Energy: 0.7704807846848304
Energy: 0.9158964879884326
Energy: 0.8482998928666813
Energy: 0.9113482875723373
Energy: 0.8662143157526484
Energy: 0.7870712527422047
Energy: 0.855005603031499
Energy: 0.7691684629942379
Energy: 0.9240184857608839
Energy: 0.9799870252659528
Energy: 0.9351029741982355
Energy: 1.0245358058295893
Energy: 0.8806964494357026
Energy: 0.8914078416178546
Energy: 0.9476432957316973
Energy: 0.8553582004658977

minimum gb energy = 0.7661008502800721 eV
minimum distance =  2.31525827676399 Angstroms
sigma value = 365


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

Energy: 0.8951269054559965
Energy: 0.9028600116526864
Energy: 0.8472377066620894
Energy: 0.8166486645264057
Energy: 0.817415733352196
Energy: 0.8159356605103648
Energy: 0.9024035093839955
Energy: 0.8887104045434239
Energy: 0.9968989718595879
Energy: 0.8151897259230327
Energy: 0.820965085302278
Energy: 0.8173557960386
Energy: 0.8158912634734773
Energy: 0.9965748454559412
Energy: 0.8676362449128473
Energy: 1.100556717921759
Energy: 0.8659671854658195
Energy: 0.8167709121156951
Energy: 0.8175399485452817
Energy: 0.8167085364712839
Energy: 0.8144223110904567
Energy: 0.8671522977797034
Energy: 1.099973722034893
Energy: 0.8650910939433171
Energy: 0.8166647969863636
Energy: 0.8158209263576418
Energy: 0.8162829754936514
Energy: 0.9043059952587047
Energy: 0.8873496412591837
Energy: 0.9977687366946058
Energy: 0.8743677672376761
Energy: 0.9962348658540839
Energy: 0.8163696260476334
Energy: 0.8734200728972491
Energy: 0.9966043367904981
Energy: 0.8713737171987631
Energy: 1.0999318673862704
Energy: 0.8500372478717361
Energy: 0.8176104482500655
Energy: 0.8182819235083613
Energy: 0.8466474248902902
Energy: 0.9026091884890515
Energy: 0.869883936628944
Energy: 0.9965184032454246
Energy: 0.8677967117138456
Energy: 0.8166961371271345
Energy: 0.815837214900128
Energy: 0.8162765795476911
Energy: 0.9967552597528209
Energy: 0.8687812502109272
Energy: 0.9955159217994646
Energy: 0.8673830081890841
Energy: 0.8170368374643121
Energy: 0.8157365033935166
Energy: 0.8163404141756885
Energy: 0.9979149557418777
Energy: 0.8687415874558995
Energy: 1.1003109307496937
Energy: 0.8650559760356679
Energy: 0.8166091333469326
Energy: 0.8158865133808307
Energy: 0.8164543931285958
Energy: 0.9038528596378409
Energy: 0.887053177541643
Energy: 0.9986252136798552
Energy: 0.874423916554519
Energy: 0.99562050613223
Energy: 1.1292152533713653
Energy: 0.8733098366261269
Energy: 0.99928105583737
Energy: 0.8677315717920885
Energy: 1.1004796595658317
Energy: 0.8653383750907911
Energy: 0.8168513678170907
Energy: 0.815959011304689
Energy: 0.816511301353564
Energy: 0.9040727183601842
Energy: 0.8684435878044658
Energy: 0.9953494760559668
Energy: 0.8662622342382291
Energy: 0.8170360139813678
Energy: 0.8155099105563235
Energy: 0.8650061432970716
Energy: 0.9973660410043936
Energy: 0.869125549534512
Energy: 0.9958664726207997
Energy: 0.8160453280894547
Energy: 0.8168386407066033
Energy: 0.818128196978976
Energy: 0.8160721328975069
Energy: 0.9972612808972946
Energy: 0.8710349634630274
Energy: 1.100567419407721
Energy: 0.8552731670366968
Energy: 0.818165403352041
Energy: 0.8179177342754357
Energy: 0.8506620144382829
Energy: 0.9027220037715891
Energy: 0.8876667337707641
Energy: 0.9984048944379953
Energy: 0.8748887815392495
Energy: 0.8166698022203349
Energy: 0.8162421625433719
Energy: 0.8146810677854442
Energy: 0.9977738274197406
Energy: 0.867311627799921
Energy: 1.1004149292250356
Energy: 0.8653848170834783
Energy: 0.8159345580662148
Energy: 0.8174732780740477
Energy: 0.8170133622900488
Energy: 0.8158348784420224
Energy: 0.8673483744604762
Energy: 1.1001774816816907
Energy: 0.8655210916998589
Energy: 0.8166929215653832
Energy: 0.8155480330434586
Energy: 0.8165833372783268
Energy: 0.8148868240489321
Energy: 0.8880266543751254
Energy: 0.9975673177322206
Energy: 0.8643559497466937
Energy: 0.8169403376760084
Energy: 0.8155429895766926
Energy: 0.8168152270171806
Energy: 0.9968701498587289
Energy: 0.8875911669762884
Energy: 1.1004451223587643
Energy: 0.8531757801074046
Energy: 0.8181025699558016
Energy: 0.8191487747615557
Energy: 0.8505095898172623
Energy: 0.9025366761530349
Energy: 0.8692101622386538
Energy: 0.9963818900846179
Energy: 0.8160498087492881
Energy: 0.8179631321062133
Energy: 0.817008987132518
Energy: 0.8146068847033775
Energy: 0.996904273829945

minimum gb energy = 0.8144223110904567 eV
minimum distance =  2.36576932219792 Angstroms
sigma value = 23