Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuTa__MO_950828638160_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=3.6149601638317113
cohesive_energy=3.540273359423524
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, -1.9495926153165598e-18, -2.8463148556000197e-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: 0.016722186394541077
Energy: 0.2638968511492766
Energy: 0.2640949649649547
Energy: 0.6597788207292475
Energy: 0.6588479187844002
Energy: 0.22566977422258103
Energy: 0.017838306499078638
Energy: 0.08365327303176837
Energy: 0.5539985687572899
Energy: 0.17383304478003406
Energy: 0.2641020543856735
Energy: 0.5271073601179422
Energy: 0.018037231481960823
Energy: 0.08427454401677266
Energy: 0.017368407373581245
Energy: 0.5560969482865985
Energy: 0.1869556961252262
Energy: 0.26416712567818684
Energy: 0.5633222970849493
Energy: 0.08339839042619308
Energy: 0.08435749626460476
Energy: 0.01915058697542222
Energy: 0.5279795768383618
Energy: 0.26438358077032137
Energy: 0.6584520637257699
Energy: 0.5552123786427622
Energy: 0.08368003970454932
Energy: 0.017803001312538702
Energy: 0.0840749573870132
Energy: 0.661949586883246
Energy: 0.17414160032952264
Energy: 0.26447498231519195
Energy: 0.52718953405097
Energy: 0.01765940532206707
Energy: 0.08379357374605671
Energy: 0.017110917336095318
Energy: 0.5563688590620782
Energy: 0.2682121903583523
Energy: 0.26437719191205916
Energy: 0.5645379969483332
Energy: 0.08328156560123144
Energy: 0.08433792777757199

minimum gb energy = 0.016722186394541077 eV
minimum distance =  2.53379989988805 Angstroms
sigma value = 5


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

Energy: 0.9221722914709515
Energy: 0.850385800094759
Energy: 0.944143455255873
Energy: 0.8751957543199972
Energy: 0.9098942610462503
Energy: 0.8758745715370407
Energy: 0.7808659259363021
Energy: 0.7815685652683186
Energy: 0.8480249778347982
Energy: 0.7814571890136893
Energy: 0.8472833862994645
Energy: 0.8022359644901326
Energy: 0.7894465267395514
Energy: 0.860288041889506
Energy: 0.7858891116931042
Energy: 0.8638993973287263
Energy: 0.7972610119889332
Energy: 0.8361640127377516
Energy: 0.8492745349862141
Energy: 0.919862726467086
Energy: 0.867773852758816
Energy: 0.7993409273686002
Energy: 0.8558038581000545
Energy: 0.7946650248675431
Energy: 0.853915106674979
Energy: 0.8304867138517481
Energy: 0.7848624598495838
Energy: 0.8224347906761325
Energy: 0.8914147664807583
Energy: 0.7900847005892452
Energy: 0.8410035989075229
Energy: 0.8228232033106216
Energy: 0.8776258341300792
Energy: 0.8421533444633211
Energy: 0.8781506218125742
Energy: 0.8252291110710641
Energy: 0.8574258987281475
Energy: 0.7869939510808313
Energy: 0.79090718237786
Energy: 0.7993804769572218
Energy: 0.8489919926782284
Energy: 0.8640381958893858
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Energy: 0.8375647797923087
Energy: 0.8043391641666212
Energy: 0.857166738428584
Energy: 0.8412884372512269
Energy: 0.8642566973114846
Energy: 0.86121685428527
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Energy: 0.8456342149894746
Energy: 0.8411998001917693
Energy: 0.8337782747477089
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Energy: 0.8232706645284722
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Energy: 0.7848641904793635
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Energy: 0.7986004627285742
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Energy: 0.8720803853584355
Energy: 0.7969940369522215
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Energy: 0.8298253030808138
Energy: 0.8428859090582856
Energy: 0.8356536169459013
Energy: 0.8567258875946534
Energy: 0.8939285477679413
Energy: 0.822674077339133
Energy: 0.8737718030788912
Energy: 0.7930633297773432
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Energy: 0.816229175287332
Energy: 0.7907773005390045
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Energy: 0.8381245544266362
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Energy: 0.8181476261252798
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Energy: 0.8199861343843521
Energy: 0.8398001877298135
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Energy: 0.7899664051161883
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Energy: 0.7940310312490255
Energy: 0.8562701486843759
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Energy: 0.8030886130736249
Energy: 0.8351206766763272
Energy: 0.8092478842637489
Energy: 0.8072666899805838
Energy: 0.8778346902104555
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Energy: 0.8835041216792885
Energy: 0.8733299080753091
Energy: 0.903469649339248
Energy: 0.796142589450298
Energy: 0.8384480369636965
Energy: 0.8893423782665997
Energy: 0.8449031573538189
Energy: 0.8405748997897703
Energy: 0.8621877738134645
Energy: 0.8632054759160941
Energy: 0.8649082010146507
Energy: 0.8802601242647835
Energy: 0.8331972771643783
Energy: 0.8098601461933799
Energy: 0.820113342069454
Energy: 0.8335866696103064
Energy: 0.9196491379928449
Energy: 0.8546261736892273
Energy: 0.8433973875942493
Energy: 0.851681161030428
Energy: 0.778066327965492
Energy: 0.7894254019367796
Energy: 0.7964387643897979
Energy: 0.7958929209004731
Energy: 0.8370213792344817
Energy: 0.914569211567917
Energy: 0.7953714955557559
Energy: 0.8765374208216518
Energy: 0.8867242542933581
Energy: 0.8841740980761205
Energy: 0.8172216507941473
Energy: 0.8572112081134172
Energy: 0.802928133368154
Energy: 0.8939405984996355
Energy: 0.7772888516544217
Energy: 0.8194292122683218
Energy: 0.8145341450181248
Energy: 0.8111063021704426
Energy: 0.8239854648062427
Energy: 0.9983532908570824
Energy: 0.8107115847136026
Energy: 0.8677328608655258
Energy: 0.8827510861411518
Energy: 0.8630977790445169
Energy: 0.8426736334526305
Energy: 0.8001474958232416
Energy: 0.8077554011145383
Energy: 0.8601360992972131
Energy: 0.797891442065411
Energy: 0.8076903492824715
Energy: 0.7781233030679696
Energy: 0.7811971593397073
Energy: 0.8219008595775231
Energy: 0.7944448033230497
Energy: 0.8286841094789829
Energy: 0.8925479972876434
Energy: 0.8531979107037002
Energy: 0.8764819969737199
Energy: 0.8536299319385663
Energy: 0.8370879918160092

minimum gb energy = 0.7772888516544217 eV
minimum distance =  2.2936222998901 Angstroms
sigma value = 401


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

Energy: 0.9262718753805738
Energy: 0.808848892895143
Energy: 0.8543609576819062
Energy: 0.8480038250211493
Energy: 0.8191717206559419
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Energy: 0.8631943337177024
Energy: 0.8992710390475198
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Energy: 0.8527835247796806
Energy: 0.805783165755221
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Energy: 0.8241550138745503
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Energy: 0.8617462628322662
Energy: 0.9068417344029078
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Energy: 0.7950686103436254
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Energy: 0.8084371521039795
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Energy: 0.8098100029768847
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Energy: 0.7960413634895965
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Energy: 0.866266497353099
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Energy: 0.9955141902310605
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Energy: 0.8117905592768009
Energy: 0.8142027486899314
Energy: 0.8005882020130324
Energy: 0.816439449475741
Energy: 0.8847687720960865
Energy: 0.843795366164909
Energy: 0.8313017558155248
Energy: 0.8091837561250619
Energy: 0.8063382605790426
Energy: 0.7992133664491076
Energy: 0.8061469188877814
Energy: 0.8478265678774086
Energy: 0.8995269191364067
Energy: 0.8978044123108389
Energy: 0.8021737548827599
Energy: 0.8197037721209715
Energy: 0.8036431268314078
Energy: 0.8639980929729548
Energy: 0.8752477486708464
Energy: 0.7974653886927593
Energy: 0.832179915219069
Energy: 0.8581563456843759
Energy: 0.830027395497186
Energy: 0.8647878597627354
Energy: 0.8318785019417153
Energy: 0.8527578060599301
Energy: 0.8282863822496752
Energy: 0.8553213269684764
Energy: 0.8378552055048606
Energy: 0.8260510630092264
Energy: 0.8060653260223247
Energy: 0.7997170492485558
Energy: 0.8136757670419611
Energy: 0.7942523374859563
Energy: 0.804394364481743
Energy: 0.841526900956432
Energy: 0.8417313153218048
Energy: 0.8009769881544204
Energy: 0.8440266054666979
Energy: 0.8019127078048206
Energy: 0.7921312989300219
Energy: 0.8276502156040937
Energy: 0.8415215720917066
Energy: 0.8374945264754294
Energy: 0.8519351703209626
Energy: 0.8521142858554964
Energy: 0.801836203489247
Energy: 0.8089463101148494
Energy: 0.8314302459480957
Energy: 0.8329040511212726
Energy: 0.8079973606515296
Energy: 0.8305355083080362
Energy: 0.8860861220735012
Energy: 0.822800218362271
Energy: 1.0025834297045273
Energy: 0.880077432405358
Energy: 0.7983015352063197
Energy: 0.8390939411115909
Energy: 0.8252382811184054
Energy: 0.8161959405688035
Energy: 0.9053492966030117
Energy: 0.8057030906390524
Energy: 0.8432828142970651
Energy: 0.8469466751092968
Energy: 0.8151091340743958
Energy: 0.8340525069256282
Energy: 0.8126550713274083
Energy: 0.8455622485311007
Energy: 0.9530583210816047
Energy: 0.8162781873572722
Energy: 0.8332281613795938
Energy: 0.8345471946121882
Energy: 0.8026035675766156
Energy: 0.8041622576778804
Energy: 0.8757727601048593
Energy: 0.8202027771081162
Energy: 0.8316653561373841
Energy: 0.8062530851540632
Energy: 0.8178472956899682
Energy: 0.8081219718971787
Energy: 0.8013604876007684
Energy: 0.8817366998760839
Energy: 0.8128167779747582
Energy: 0.9212821947148105
Energy: 0.7963026885798972
Energy: 0.8296298069604467
Energy: 0.8107374631537807
Energy: 0.843415262230455
Energy: 0.8874952825968102
Energy: 0.835289447024865
Energy: 0.81886705195487
Energy: 0.8110788966505618
Energy: 0.7985741966634182
Energy: 0.8242369024706501
Energy: 0.9015739654808589
Energy: 0.8656118284927266
Energy: 0.7992532962415958
Energy: 0.8439361472509391
Energy: 0.8375607462264817
Energy: 0.8330536652961017
Energy: 0.8268119377028942
Energy: 0.8326223758933964
Energy: 0.8192831333618937
Energy: 0.8071711621256563
Energy: 0.8089398730239445
Energy: 0.8329197233252743
Energy: 0.7982461992099906
Energy: 0.8196066092504478
Energy: 0.8612580995077441
Energy: 0.8303881035655869

minimum gb energy = 0.78802211655369 eV
minimum distance =  2.29721502396291 Angstroms
sigma value = 311


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

Energy: 0.8260329721075303
Energy: 0.8590173539236061
Energy: 0.8829087901135101
Energy: 0.8092804662180338
Energy: 0.838075384356735
Energy: 0.8582675682286047
Energy: 0.8272970087858899
Energy: 0.8459263335490966
Energy: 0.8435472402825811
Energy: 0.8654120396147941
Energy: 0.8251149783085628
Energy: 0.8511915024541202
Energy: 0.8345669847495792
Energy: 0.8375651991959634
Energy: 0.8106825877835491
Energy: 0.819172273589487
Energy: 0.8339589041610986
Energy: 0.8426421072513642
Energy: 0.8530275834588262
Energy: 0.8136835502591026
Energy: 0.8289661350651758
Energy: 0.8580405552181006
Energy: 0.8178645515001913
Energy: 0.80306685853352
Energy: 0.8151931663422178
Energy: 0.859290384897757
Energy: 0.8802239518054639
Energy: 0.8749052728436177
Energy: 0.8480195090709707
Energy: 0.8281265059046614
Energy: 0.8296747564372682
Energy: 0.8263477693882137
Energy: 0.8520700757191381
Energy: 0.8235448941270649
Energy: 0.8604594915123149
Energy: 0.8270156988490281
Energy: 0.8096447098382278
Energy: 0.8166430250146088
Energy: 0.808529020030737
Energy: 0.8591393617224796
Energy: 0.8163352540279029
Energy: 0.8164831291502646
Energy: 0.8902002497881759
Energy: 0.8243957822453856
Energy: 0.8168972183208292
Energy: 0.8352737375093783
Energy: 0.8064775429473525
Energy: 0.814682031667222
Energy: 0.8665308705837631
Energy: 0.8158162265911214
Energy: 0.8427825700479031
Energy: 0.8180542078171548
Energy: 0.8243996666181752
Energy: 0.8550801748459805
Energy: 0.8149028831464387
Energy: 0.8391851911005316
Energy: 0.8304371400580094
Energy: 0.8071346684160072
Energy: 0.8273839008022735
Energy: 0.8506785758041544
Energy: 0.8380784527754038
Energy: 0.7968997558299953
Energy: 0.8373335101621837
Energy: 0.8253605602481621
Energy: 0.865709255167689
Energy: 0.8259652597531724
Energy: 0.8092062734122656
Energy: 0.8620537814837396
Energy: 0.8150196845393619
Energy: 0.8433375747148276
Energy: 0.8509991615547059
Energy: 0.7961344831511444
Energy: 0.8362112788747397
Energy: 0.8465848750011864
Energy: 0.8490074922243939
Energy: 0.8232267609872794
Energy: 0.8476685524709873
Energy: 0.8433713738310727
Energy: 0.8227989553936771
Energy: 0.8099225738054836
Energy: 0.8163817362096598
Energy: 0.8423512269665554
Energy: 0.829605704595492
Energy: 0.8804224366693222
Energy: 0.8163978216320039
Energy: 0.8619237676814169
Energy: 0.8728042530647377
Energy: 0.8225799780262653
Energy: 0.9048915364991328
Energy: 0.8267100273651246
Energy: 0.8603363331617871
Energy: 0.8518739521731878
Energy: 0.8687488790261219
Energy: 0.8371612929240543
Energy: 0.8733844980934329
Energy: 0.8261921341139494
Energy: 0.8907644847370563
Energy: 0.8771150550785048
Energy: 0.8373780738272876
Energy: 0.8468613967494737
Energy: 0.853111995441021
Energy: 0.8154144719873523
Energy: 0.857514105623847
Energy: 0.8441641426695388
Energy: 0.8184381112713853
Energy: 0.8237819653185512
Energy: 0.8788219595027215
Energy: 0.8444433560640743
Energy: 0.8843337141107498
Energy: 0.8518900912376088
Energy: 0.8340247666985761
Energy: 0.8289196172832776
Energy: 0.8632249291004757
Energy: 0.8392245243263806
Energy: 0.846533366051403
Energy: 0.8381808705310297
Energy: 0.8564756034322488
Energy: 0.8425471397841866
Energy: 0.8257502904102462
Energy: 0.7964697218916394
Energy: 0.8802228825674069
Energy: 0.826177475385509
Energy: 0.8133370159316772
Energy: 0.8470966534620548
Energy: 0.8169402949068559
Energy: 0.8644548186508472
Energy: 0.8496869425987341
Energy: 0.8282124706862405
Energy: 0.8480466182197995
Energy: 0.849430257789568
Energy: 0.845372610922879
Energy: 0.847067473196495
Energy: 0.8536802976452351
Energy: 0.8051806207573196
Energy: 0.87480869749199
Energy: 0.8549024470599222
Energy: 0.8789030078625194
Energy: 0.852359889084309
Energy: 0.8920671482126669
Energy: 0.9017999413043608
Energy: 0.8237896988200805
Energy: 0.8249669238172593
Energy: 0.8546208727876174
Energy: 0.8817549770834707
Energy: 0.8634004360743275
Energy: 0.8496110496365349
Energy: 0.8494792833647586
Energy: 0.8323329092800964
Energy: 0.8737928027955796
Energy: 0.8320482668683464
Energy: 0.8188300809906087
Energy: 0.8350517440373043
Energy: 0.8352862710937256
Energy: 0.8824634478756915
Energy: 0.8461297785735448
Energy: 0.8364617259664772
Energy: 0.831897659382891
Energy: 0.859660401093583
Energy: 0.8635294999075258
Energy: 0.8427577897365922
Energy: 0.8259967701998838
Energy: 0.8626481538510861
Energy: 0.8733961938037933
Energy: 0.8259194878143065
Energy: 0.8181142039216668
Energy: 0.8172105431289121
Energy: 0.8075296778701256
Energy: 0.8435523094378011
Energy: 0.8436247939887452
Energy: 0.8175895770120493
Energy: 0.8154046867134755
Energy: 0.8153242643111234
Energy: 0.8253327379311742
Energy: 0.8377643310290466
Energy: 0.8591775526818243
Energy: 0.8172724489176335
Energy: 0.8662413278953721
Energy: 0.8334790950189109
Energy: 0.8987526823162165
Energy: 0.8525712493305592
Energy: 0.867664859578627
Energy: 0.8205910173541335
Energy: 0.8045790004080898
Energy: 0.8499934109139388
Energy: 0.8438422129170119
Energy: 0.8019632074795503
Energy: 0.8422506023121971
Energy: 0.820113841836051
Energy: 0.8300456001502613
Energy: 0.814573996783495
Energy: 0.8689831968911742
Energy: 0.8596205835212569
Energy: 0.8007486013912344
Energy: 0.851893786142393
Energy: 0.8065583172048254
Energy: 0.8111499587540429
Energy: 0.8254316155082163
Energy: 0.8383262465674552
Energy: 0.8456895313121413
Energy: 0.835284225208471
Energy: 0.8421024803147369
Energy: 0.8108753300438553
Energy: 0.8278167250118952
Energy: 0.8795335880984481
Energy: 0.844701655694359
Energy: 0.8188793857861774
Energy: 0.8300027117412001
Energy: 0.8407259325683414
Energy: 0.8216131203656746
Energy: 0.8363166894047206
Energy: 0.804946402380432
Energy: 0.7919575515462427
Energy: 0.8340759406513628
Energy: 0.8174659839012184
Energy: 0.8407609184839427
Energy: 0.8172299503689618
Energy: 0.8096261080000484
Energy: 0.837366620573289
Energy: 0.858766799909528
Energy: 0.829366265462184
Energy: 0.8748586375327854
Energy: 0.8238464434138436
Energy: 0.8301865310297557
Energy: 0.8194013887908255
Energy: 0.8280390313698243
Energy: 0.8435968053655625
Energy: 0.8149082699339486
Energy: 0.8248038538012572
Energy: 0.8547506299065188
Energy: 0.8205401410647275
Energy: 0.8568612887431781
Energy: 0.8052617892081578
Energy: 0.8186683879616954
Energy: 0.8280753208265982
Energy: 0.8654816870269096
Energy: 0.8567900255456549
Energy: 0.8496654773524467
Energy: 0.8330070841125843
Energy: 0.8302507400787423
Energy: 0.8103279122062231
Energy: 0.8660490842757749
Energy: 0.850922722003934
Energy: 0.8585383667549362
Energy: 0.827084262246437
Energy: 0.8481930464810379
Energy: 0.8245995206811152
Energy: 0.8576906369157599
Energy: 0.8817529938999863
Energy: 0.8382647960545845
Energy: 0.8593121352247266
Energy: 0.8565225067683859
Energy: 0.8391887485941807

minimum gb energy = 0.7919575515462427 eV
minimum distance =  2.27751328351391 Angstroms
sigma value = 39


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

Energy: 0.7750180772877618
Energy: 0.855522852850015
Energy: 1.0992136470182796
Energy: 0.9584100795865478
Energy: 0.9324491935479137
Energy: 0.8945199800102409
Energy: 0.7544098478721424
Energy: 0.8227695906570454
Energy: 0.8274359553491711
Energy: 0.892239071380856
Energy: 0.895370429436934
Energy: 0.8293503793641609
Energy: 0.8175691027612146
Energy: 0.8311105079520051
Energy: 0.817126561149815
Energy: 0.8281006592203564
Energy: 0.8458038611348389
Energy: 0.877963257601386
Energy: 0.8290679873505815
Energy: 0.8165957708382691
Energy: 0.8160680048381294
Energy: 0.831254136235127
Energy: 0.8278498323388085
Energy: 0.9090730567363631
Energy: 0.8395776636512343
Energy: 0.8775659632489159
Energy: 0.8925704024614699
Energy: 0.8964260721514277
Energy: 0.8217482092430092
Energy: 0.8285615373249005
Energy: 0.8842486781173693
Energy: 0.8178321387144534
Energy: 0.8552741910651127
Energy: 0.8194543914090752
Energy: 0.8159224037485231
Energy: 0.7536002688264901
Energy: 0.8279310187605389
Energy: 0.8178978700539651
Energy: 0.8301572699781917
Energy: 0.8309247891014065
Energy: 0.8156546961282806
Energy: 0.8470356726882811
Energy: 0.8324940761759257
Energy: 0.8320873328452818
Energy: 0.8152300784110728
Energy: 0.8910344080872524
Energy: 0.756020707277643
Energy: 0.7546800118195585
Energy: 0.8287268208603213
Energy: 0.7559831964445042
Energy: 0.8284069149833261
Energy: 0.898088561406009
Energy: 0.8269591558777388
Energy: 0.8950483475904374
Energy: 0.8173376738217228
Energy: 0.8295468856724371
Energy: 0.7546850028605067
Energy: 0.8283475096346716
Energy: 0.900911421126756
Energy: 0.8272857406881315
Energy: 0.8257901787903277
Energy: 0.8166243458250112
Energy: 0.8293255763346205
Energy: 0.8322042161956369
Energy: 0.8343786313367185
Energy: 0.8949212856782358
Energy: 0.8781775251870664
Energy: 0.8215102697180956
Energy: 0.8164295113469145
Energy: 0.8157193420143232
Energy: 0.8336970364231144
Energy: 0.8264161881724175
Energy: 0.8418797663798505
Energy: 0.8258996894335905
Energy: 0.8313482507418897
Energy: 0.8307170874455658
Energy: 0.8205816594386214
Energy: 0.8299361500138619
Energy: 0.8272988246795271
Energy: 0.8227138427652417
Energy: 0.8258776230699695
Energy: 0.897545033752042
Energy: 0.8165501698236006
Energy: 0.820515291063002
Energy: 0.7560725005167488
Energy: 0.8278198511229661
Energy: 0.8957933031913108
Energy: 0.8201131552706811
Energy: 0.8862410388343359
Energy: 0.8949002353695511
Energy: 0.816076779295171
Energy: 0.8307347063423686
Energy: 0.8264955904473597
Energy: 0.81809683189153
Energy: 0.8944931741329781
Energy: 0.7557334252845942
Energy: 0.7551335238796018
Energy: 0.8290041103017546
Energy: 0.7534981906944024
Energy: 0.8319373699484751
Energy: 0.8157001564063374
Energy: 0.8874068761086875
Energy: 0.7539750322015439
Energy: 0.7545156297979453
Energy: 0.8306382049380219
Energy: 0.7539612452986075
Energy: 0.8280494199333918
Energy: 0.8462472104282254
Energy: 0.8204354554534736
Energy: 0.9336553151181943
Energy: 0.8956346931190715
Energy: 0.7544524948170741
Energy: 0.8227012065618124
Energy: 0.8276256380817203
Energy: 0.8921332737978983
Energy: 0.8960120862282676
Energy: 0.8292711304831626
Energy: 0.8176457174779141
Energy: 0.8306566522718446
Energy: 0.8174865319814411
Energy: 0.8265504907823679
Energy: 0.8458864612775899
Energy: 0.8786981340038748
Energy: 0.8289552270433556
Energy: 0.8220890513845985
Energy: 0.8161324155445397
Energy: 0.8310476322426869
Energy: 0.829032236658426
Energy: 0.9090632247830999
Energy: 0.838557671915077
Energy: 0.8774008589482205
Energy: 0.8925806983167163
Energy: 0.9360247996720343
Energy: 0.8219487905917521
Energy: 0.8285904088284548
Energy: 0.8844008886609291
Energy: 0.817823667536352
Energy: 0.872199774463921
Energy: 0.8200699621996261
Energy: 0.8161605655125257
Energy: 0.753498474611995
Energy: 0.8281876880962531
Energy: 0.81672229497089
Energy: 0.8303117098296668
Energy: 0.8308523528855124
Energy: 0.7542075795664399
Energy: 0.8443641353284916
Energy: 0.833213968260274
Energy: 0.830870089190436
Energy: 0.8155233236008014
Energy: 0.8881910416914833
Energy: 0.7560850851771239
Energy: 0.7547444332445727
Energy: 0.8288912788801278
Energy: 0.7558592566270582
Energy: 0.8283423348252613
Energy: 0.8988004183770891
Energy: 0.8271680513230933
Energy: 0.8952622252599151
Energy: 0.9011939973789512
Energy: 0.8289142386700503
Energy: 0.7546100156115535
Energy: 0.8282279803056497
Energy: 0.8837003665000072
Energy: 0.8266195611728815
Energy: 0.8258679847543551
Energy: 0.8180585203118398
Energy: 0.8293993729472733
Energy: 0.8324241616164343
Energy: 0.8351345653682688
Energy: 0.895329875896814
Energy: 0.8777983690924779
Energy: 0.8217404572882053
Energy: 0.8167271393161021
Energy: 0.8160909965600566
Energy: 0.833300201293199
Energy: 0.8263927055621936
Energy: 0.8414450963528414
Energy: 0.8264089162053098
Energy: 0.8294846971341849
Energy: 0.8174913763574518
Energy: 0.8691639876833064
Energy: 0.8293283721052419
Energy: 0.827989917976127
Energy: 0.8232717233251934
Energy: 0.8259263451259565
Energy: 0.8871365909212034
Energy: 0.817627153153345
Energy: 0.8207050593180805
Energy: 0.7552520332593684
Energy: 0.8277285116641822
Energy: 0.8958296165559069
Energy: 0.8198963936203043
Energy: 0.8855942487571221
Energy: 0.893957257661587
Energy: 0.8165998788527354
Energy: 0.8314188306079286
Energy: 0.8267099468099545
Energy: 0.8174871856880074
Energy: 0.8944464022379766
Energy: 0.7557002702142326
Energy: 0.755275825840374
Energy: 0.8288512136634925
Energy: 0.7533953564295758
Energy: 0.8317538084935059
Energy: 0.8160613165797704
Energy: 0.8286625373380909
Energy: 0.7540414707920345
Energy: 0.7545067405590199
Energy: 0.8309039669451674

minimum gb energy = 0.7533953564295758 eV
minimum distance =  2.36700003129573 Angstroms
sigma value = 21


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

Energy: 1.0722292934078639
Energy: 0.8020976158258966
Energy: 0.8737229052476924
Energy: 0.8250746569096997
Energy: 0.839575082255996
Energy: 0.8423109345150821
Energy: 0.8323991382841277
Energy: 0.8238076061154268
Energy: 0.8264558012849125
Energy: 0.8842318740706782
Energy: 0.8337334755561944
Energy: 0.8617322223297373
Energy: 0.8485900945446013
Energy: 0.894344717778393
Energy: 0.8592876561257495
Energy: 0.8338755873679344
Energy: 0.8561430691844543
Energy: 0.8786431601548157
Energy: 0.8504022522033544
Energy: 0.8197081836219605
Energy: 0.845407761520037
Energy: 0.9667893423897238
Energy: 0.8849642963683546
Energy: 0.8251912460008055
Energy: 0.83941153424394
Energy: 0.7827799145853475
Energy: 0.8087756315071034
Energy: 0.8716081705446248
Energy: 0.7638521615856022
Energy: 0.805872710527084
Energy: 0.8232537008860564
Energy: 0.7941974482137565
Energy: 0.8074122201213185
Energy: 0.8326661734962321
Energy: 0.821878641898475
Energy: 0.7806847028496053
Energy: 0.7960680858274136
Energy: 0.8470168766742437
Energy: 0.7474900616685926
Energy: 0.8538790400878828
Energy: 0.8360510877085303
Energy: 0.8224049169009188
Energy: 0.922684758873317
Energy: 0.8172846288323216
Energy: 0.7935302630597177
Energy: 0.848760056605006
Energy: 0.8061877410198666
Energy: 0.8039101020659173
Energy: 0.8252250079526066
Energy: 0.8122714708560945
Energy: 0.8234865262513519
Energy: 0.8409446207665965
Energy: 0.8314926580584325
Energy: 0.8217479788455092
Energy: 0.8365323197501631
Energy: 0.8278484084200389
Energy: 0.8202185962566239
Energy: 0.8442019994213824
Energy: 0.8512618878766963
Energy: 0.8498374150074013
Energy: 0.8530483327751834
Energy: 0.8892953464981412
Energy: 0.8354382176668976
Energy: 0.8949550127919087
Energy: 0.8037344042019678
Energy: 0.7625744354658401
Energy: 0.8297299484673011
Energy: 0.7970140760677512
Energy: 0.8350632985032148
Energy: 0.8474898920233966
Energy: 0.8271670893021208
Energy: 0.857348823641991
Energy: 0.8211819524347089
Energy: 0.8753803150045169
Energy: 0.8097184550501281
Energy: 0.8257594690030875
Energy: 0.857605889474025
Energy: 0.8269579622908644
Energy: 0.8520357643424215
Energy: 0.8864511447743036
Energy: 0.8043620314388273
Energy: 0.796140613195262
Energy: 0.9106458081061725
Energy: 0.8537173569083278
Energy: 0.9770131370666393
Energy: 0.8278345330803182
Energy: 0.7727039589524621
Energy: 0.7803237415278388
Energy: 0.818366233943471
Energy: 0.8024634205294501
Energy: 0.7758505070798056
Energy: 0.7596246685710156
Energy: 0.787369903894658
Energy: 0.816021914056113
Energy: 0.892603051671793
Energy: 0.8300495860055692
Energy: 0.8349757543376463
Energy: 0.787324254668511
Energy: 0.8256108198039392
Energy: 0.8570754941530752
Energy: 0.8643159367588651
Energy: 0.8301419226713125
Energy: 0.9405172441595155
Energy: 0.8454936721642125
Energy: 0.8538424982963743
Energy: 0.9246025835614486
Energy: 0.8481502186468002
Energy: 0.8025456244508532
Energy: 0.8502745334659345
Energy: 0.8162959933480831
Energy: 0.8627750310663045
Energy: 0.8443573913762543
Energy: 0.7644202416205197
Energy: 0.8886555562105813
Energy: 0.7934431764114338
Energy: 0.7469306493125594
Energy: 0.788952782666526
Energy: 0.842392475002177
Energy: 0.8676294294514679
Energy: 0.7792600832155588
Energy: 0.8190814906428658
Energy: 0.8801494081230269
Energy: 0.7959129814297692
Energy: 0.8297689947111361
Energy: 0.8403030538593417
Energy: 0.8052961406742944
Energy: 0.778241650140074
Energy: 0.792139982171944
Energy: 0.8112965479161203
Energy: 0.8139228691931734
Energy: 0.7917186976106454
Energy: 0.7812192851115409
Energy: 0.8330460909478739
Energy: 0.814082344101755
Energy: 0.8405577905157035
Energy: 0.8013998803680628
Energy: 0.8124429775007415
Energy: 0.772617616588524
Energy: 0.8242152304817447
Energy: 0.8224153182846103
Energy: 0.813217484963107
Energy: 0.8254355131768237
Energy: 0.8272697869989374
Energy: 0.8186293568124048
Energy: 0.8632770037179677
Energy: 0.8313213128761112
Energy: 0.8405134806770985
Energy: 0.7634443579133416
Energy: 0.785006625617525
Energy: 0.8299105240542946
Energy: 0.8263580583188046
Energy: 0.7950457575676638
Energy: 0.8036440300209136
Energy: 0.7884205765866303
Energy: 0.8102365805925068
Energy: 0.8417219625155059
Energy: 0.847800234157194
Energy: 0.8407941332489288
Energy: 0.8498380184311005
Energy: 0.9001031920927938
Energy: 0.7954942497493539
Energy: 0.8127508923967653
Energy: 0.8267820637376914
Energy: 0.7997993200987839
Energy: 0.8793346465616166
Energy: 0.8049312663359252
Energy: 1.0111019133767885
Energy: 0.8973871825033766
Energy: 0.7909034818128213
Energy: 0.8641945085238721
Energy: 0.8446984697889431
Energy: 0.8657316938054649
Energy: 0.8186093484516489
Energy: 0.8381783156070054
Energy: 0.8191628060262934

minimum gb energy = 0.7469306493125594 eV
minimum distance =  2.32449648096124 Angstroms
sigma value = 113


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

Energy: 1.0054788088729976
Energy: 1.1361896592080682
Energy: 1.0246178264805148
Energy: 0.9151185881856025
Energy: 0.8135478376504538
Energy: 0.9502210156708181
Energy: 0.9792246784723426
Energy: 0.8359344510344779
Energy: 0.9011295283404506
Energy: 0.844083140652148
Energy: 0.8093774361286077
Energy: 0.8188003680413801
Energy: 0.8367475127355527
Energy: 0.9165489921566113
Energy: 1.0117793209149004
Energy: 0.899107478950776
Energy: 0.946008759446195
Energy: 0.8353285239490446
Energy: 0.7802073444722364
Energy: 0.889169440313458
Energy: 0.89743813040786
Energy: 0.9074503990942314
Energy: 0.8738994526663953
Energy: 0.9144689919071669
Energy: 0.8960156013458275
Energy: 1.0196462624939402
Energy: 0.9493222453584333
Energy: 0.8844739776524173
Energy: 0.7728486140179323
Energy: 0.8443893977050311
Energy: 0.8482890657947803
Energy: 0.9074257573155923
Energy: 0.864004661165447
Energy: 0.8846829407902195
Energy: 0.8701218865501081
Energy: 0.8636372216860825
Energy: 0.8709222086796671
Energy: 0.8939825231562903
Energy: 0.8655073493427582
Energy: 0.9023823190995256
Energy: 0.798866078406461
Energy: 0.877789744145015
Energy: 0.8824307450022126
Energy: 0.847397840072575
Energy: 0.9178314142201821
Energy: 0.8046811299987697
Energy: 0.851596217385553
Energy: 0.9466158959815412
Energy: 0.8381149305021719
Energy: 0.8438949994100077
Energy: 0.837608620696363
Energy: 0.8054161410072409
Energy: 0.7816861096798652
Energy: 0.8184781163675001
Energy: 0.8076903450601678
Energy: 0.8125018080631461
Energy: 0.779892478855813
Energy: 0.8559899669496815
Energy: 0.8847864699691471
Energy: 0.8548415007407044
Energy: 0.9279232506225893
Energy: 0.9309656850979491
Energy: 0.8147014789515016
Energy: 0.8616247111797117
Energy: 0.8693059851576718
Energy: 0.8145542690407597
Energy: 0.7992989236364322
Energy: 0.8150609445681367
Energy: 0.8168647577707207
Energy: 0.8436914477651676
Energy: 0.8668843545205753
Energy: 0.8416277788669715
Energy: 0.8302014207881822
Energy: 0.8732377318008061
Energy: 0.825664046285478
Energy: 0.8071828093693811
Energy: 0.9019124038893163
Energy: 0.8001208699072434
Energy: 0.8164461226826087
Energy: 0.9320947614247496
Energy: 0.8760288452847163
Energy: 0.9415046041505373
Energy: 0.975595832761387
Energy: 0.8118332327583548
Energy: 0.8820996375288341
Energy: 0.8368617055857176
Energy: 0.857475820376401
Energy: 0.7720401036171501
Energy: 0.8215802842061067
Energy: 0.8235930036473954
Energy: 0.8555148194730776
Energy: 0.9638903699065949
Energy: 0.812711909318238
Energy: 0.8343351781083304
Energy: 0.8279965263504463
Energy: 0.8447418287108481
Energy: 0.9045238135462587
Energy: 0.8510534767977186
Energy: 0.8163165710146778
Energy: 0.9390250583893136
Energy: 0.9045801782935163
Energy: 0.8502194504655012
Energy: 0.8573506836177667
Energy: 0.8650091071371312
Energy: 0.862415972141022
Energy: 0.7693812327427575
Energy: 0.8197346609943565
Energy: 0.8840285797481624
Energy: 0.8818094180323625
Energy: 0.8197753612634489
Energy: 0.8995982618697567
Energy: 0.8479200134815331
Energy: 0.9036118166658477
Energy: 0.8393237284460959
Energy: 0.8451499876261744
Energy: 0.8732001433951054
Energy: 0.867380874872699
Energy: 1.0006319930669443
Energy: 0.8043797005262031
Energy: 0.8840410733224712
Energy: 0.922179378005802
Energy: 0.956880516551364
Energy: 0.9301091799436212
Energy: 0.9880071368218059
Energy: 0.8249255865326944
Energy: 0.8682733916377496
Energy: 0.8732950753974119
Energy: 0.9297154155526968
Energy: 0.87438540532612
Energy: 0.8962583290230911
Energy: 0.8731119692864484
Energy: 0.778156924106079
Energy: 0.8129462761312356
Energy: 0.9286544192441681
Energy: 0.8772984433880363
Energy: 0.9247698422897471
Energy: 0.8645774683755716
Energy: 0.8115896874341368
Energy: 0.9482696336114328
Energy: 0.8512199091417957
Energy: 0.9528054359894378
Energy: 0.9095689680502782
Energy: 0.8617118242328613
Energy: 0.902815159510414
Energy: 0.8621533334929177
Energy: 0.7690207452254284
Energy: 0.9117825804143046
Energy: 0.8587117919861689
Energy: 0.8882394674287981
Energy: 0.8675501445866662
Energy: 0.862715991674917
Energy: 0.8611068581070103
Energy: 0.7691756606946677
Energy: 0.9170415735441162
Energy: 0.9819748198711413
Energy: 0.9010224786516396
Energy: 1.0258668317353
Energy: 0.9213747203951972
Energy: 0.813579402244771
Energy: 0.9499884758687431
Energy: 0.9767176170723771
Energy: 0.7656746423997889
Energy: 0.8730132826296747
Energy: 1.0072318570197523
Energy: 0.8681014954551448
Energy: 0.8754619824900148
Energy: 0.8317378693413564
Energy: 0.9167400303909755
Energy: 0.8864595599075833
Energy: 0.8742042370181174
Energy: 0.9448428012803269
Energy: 0.9041409876182056
Energy: 1.0258041703958323
Energy: 0.8236079875458366
Energy: 0.9964538563228392
Energy: 0.9082207813110829
Energy: 0.8215154562844327
Energy: 0.8961338819174386
Energy: 0.8005796732102138
Energy: 0.9116552837497701
Energy: 0.9501166298995444
Energy: 0.9235231408411874
Energy: 0.7982311318735031
Energy: 0.8462175752076379
Energy: 0.8397558765335147
Energy: 0.9082063760762289
Energy: 0.9004213763801551
Energy: 0.888167618860921
Energy: 0.8496781162547167
Energy: 0.8640156593277059
Energy: 0.9109868196309722
Energy: 0.8903565524976766
Energy: 0.8112248960987318
Energy: 0.9045070689406643
Energy: 0.8860099250334125
Energy: 0.9080331895572629
Energy: 0.8397498716820856
Energy: 0.8316922968636752
Energy: 0.9003464507009535
Energy: 0.8207725058080645
Energy: 0.7997712525333714
Energy: 0.8939509357247205
Energy: 0.8429624301192645
Energy: 0.8912843807477061
Energy: 0.836860424716394
Energy: 0.8563681872211857
Energy: 0.8488826617564343
Energy: 0.8163106884983544
Energy: 0.8372669037158347
Energy: 0.8135094376053905
Energy: 0.7827181135710969
Energy: 0.8645896743485676
Energy: 0.8864802413468621
Energy: 0.9230985887667887
Energy: 0.9357476605045297
Energy: 0.9315887003242299
Energy: 0.8790498413117515
Energy: 0.8163234562021686
Energy: 0.8373818264456152
Energy: 0.7694225639662721
Energy: 0.8190103268299229
Energy: 0.8106655602993709
Energy: 0.8074997889616735
Energy: 0.8721939389109672
Energy: 0.8641527870345855
Energy: 0.8118003054823931
Energy: 0.8359982825567865
Energy: 0.8713381502408023
Energy: 0.826981837565798
Energy: 0.8239069918148935
Energy: 0.8606339570556841
Energy: 0.7672185752893969
Energy: 0.8155829524620066
Energy: 0.9310484129003765
Energy: 0.8301959711911278
Energy: 0.9802473043632576
Energy: 0.976621654131848
Energy: 0.8308848811608194
Energy: 0.8176712840693858
Energy: 0.8424381419080006
Energy: 0.8568933708015662
Energy: 0.775361877103265
Energy: 0.8447738703267343
Energy: 0.873953045711224
Energy: 0.8102351832485419
Energy: 0.9636248236694723
Energy: 0.8123857089931383
Energy: 0.8993905605246353
Energy: 0.795365884626895
Energy: 0.8150478761788623
Energy: 0.9036679172082988
Energy: 0.8085685892665055
Energy: 0.8166542046495778
Energy: 0.8702811221711875
Energy: 0.8801443617047127
Energy: 0.8119257432102237
Energy: 0.8657104759669503
Energy: 0.877675743357733
Energy: 0.800845000844819
Energy: 0.7707728300429852
Energy: 0.8472671655424786
Energy: 0.885929534730688
Energy: 0.874182392795866
Energy: 0.8842785971934971
Energy: 0.8907461213935707
Energy: 0.9071053848892057
Energy: 0.903774886249692
Energy: 0.8307678857925004
Energy: 0.8944621328764468
Energy: 0.8620066653657338
Energy: 1.001846132887204
Energy: 0.9371286651794348
Energy: 0.8617659504623799
Energy: 0.885132149658593
Energy: 0.9206007144721907
Energy: 0.9573836742286789
Energy: 0.9318362475824715
Energy: 0.9267532789454171
Energy: 0.8266720813166308
Energy: 0.9235395917036449
Energy: 0.8278195238978426
Energy: 0.9257909768539331
Energy: 0.8788229552322416
Energy: 0.825723282654658
Energy: 0.8389416814986782
Energy: 0.9253712741174731
Energy: 0.8761168340259146
Energy: 0.9286944200279625
Energy: 0.8462354888829281
Energy: 1.0344042577146864
Energy: 1.020419084813998
Energy: 0.811199415851764
Energy: 0.9486432210644343
Energy: 0.9709961615771228
Energy: 0.9537432255688703
Energy: 0.8379471810256407
Energy: 0.8428317744869315
Energy: 0.7955998689918293
Energy: 0.8504117925521566
Energy: 0.7704879462178436
Energy: 0.9158949090480926
Energy: 0.8483478119296068
Energy: 0.9111663885166902
Energy: 0.8662108916811949
Energy: 0.787061063618875
Energy: 0.8550341375769785
Energy: 0.7691666363070706
Energy: 0.9247996880420796
Energy: 0.9799844472745542
Energy: 0.9280105156233728
Energy: 1.0245334542483802
Energy: 0.8825691857530198
Energy: 0.8905108100559976
Energy: 0.9476404602861375
Energy: 0.85535633461891

minimum gb energy = 0.7656746423997889 eV
minimum distance =  2.31534813236101 Angstroms
sigma value = 365


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

Energy: 0.8951281161620561
Energy: 1.1580280257026685
Energy: 0.8472372003574786
Energy: 0.8166471836905457
Energy: 0.8174140515239429
Energy: 0.8159281612439964
Energy: 0.9024019787237744
Energy: 0.8692897507071856
Energy: 0.9968945615705576
Energy: 0.8151882220199704
Energy: 0.8209629934527087
Energy: 0.8173547471094276
Energy: 0.8158898449662649
Energy: 0.9965733603440169
Energy: 0.8676351580425192
Energy: 1.100555079995867
Energy: 0.8659655866672521
Energy: 0.8167695292822652
Energy: 0.8175383601238986
Energy: 0.8167070467896868
Energy: 0.8144209243553452
Energy: 0.8671507439366499
Energy: 1.0999622490168597
Energy: 0.8650895518007385
Energy: 0.8166632866676399
Energy: 0.8158195058191776
Energy: 0.8162815928579429
Energy: 0.9043044955496451
Energy: 0.8873480934411874
Energy: 0.9977780695881844
Energy: 0.874366204867698
Energy: 0.9962363269748062
Energy: 0.8163671726400263
Energy: 0.8734185286625368
Energy: 0.996590628590255
Energy: 0.8713721646420141
Energy: 1.0999301430837698
Energy: 0.850035724412
Energy: 0.8176090195491422
Energy: 0.8182804626302356
Energy: 0.8466459060109174
Energy: 0.9026076843362426
Energy: 0.869882361207343
Energy: 0.9965170900658236
Energy: 0.8677951495813242
Energy: 0.8166948388005597
Energy: 0.8158360091269659
Energy: 0.816274856161192
Energy: 0.9967701732156817
Energy: 0.8687796789165183
Energy: 0.9955145767506332
Energy: 0.8673814655382859
Energy: 0.8170354489732851
Energy: 0.815735145824482
Energy: 0.8163388827419638
Energy: 0.9979214305407881
Energy: 0.8687400528831953
Energy: 1.100309762609795
Energy: 0.8650544687211194
Energy: 0.8166077597865198
Energy: 0.8158851583965928
Energy: 0.8164529248674205
Energy: 0.9038513349720844
Energy: 0.8870516541028596
Energy: 0.9985220032866549
Energy: 0.8744224379693291
Energy: 0.9955279088696828
Energy: 1.1292136613874892
Energy: 0.8733083361088924
Energy: 0.9995125550029846
Energy: 0.8677300380072495
Energy: 1.100478351971451
Energy: 0.8653368444030483
Energy: 0.8168499622721314
Energy: 0.8159576121075928
Energy: 0.8165101101283269
Energy: 0.9040712111390543
Energy: 0.8684420008520779
Energy: 0.9953480257321898
Energy: 0.8662605587565159
Energy: 0.8170348845357942
Energy: 0.8153149947920209
Energy: 0.8650046424605419
Energy: 0.9973646511222305
Energy: 0.8691240001420708
Energy: 0.9958652072784988
Energy: 0.8160439547936894
Energy: 0.8168371701717778
Energy: 0.8181267362317943
Energy: 0.8160706941275606
Energy: 0.9972389587508957
Energy: 0.87103388191405
Energy: 1.1005657999987022
Energy: 0.8552716394840812
Energy: 0.8181639379167016
Energy: 0.8179160899024746
Energy: 0.8506605483466011
Energy: 0.9027205597766131
Energy: 0.8876651887422802
Energy: 0.9984038301645228
Energy: 0.8748872275729257
Energy: 0.8166811960900002
Energy: 0.8162407479626421
Energy: 0.8146822318869493
Energy: 0.9977694958200156
Energy: 0.8673100655320503
Energy: 1.1004130627583955
Energy: 0.8653819008676944
Energy: 0.8159331538125584
Energy: 0.8174718322421723
Energy: 0.8170063337211422
Energy: 0.815833456651932
Energy: 0.8673467911214023
Energy: 1.100177037595681
Energy: 0.8655195359537488
Energy: 0.8166914623983275
Energy: 0.8155465787053984
Energy: 0.8165819791363804
Energy: 0.8148854204533509
Energy: 0.8880251106186219
Energy: 0.9975662280708663
Energy: 0.8643545000569253
Energy: 0.8169363433665898
Energy: 0.8155414126945614
Energy: 0.8168136692340584
Energy: 0.9968687050862038
Energy: 0.8875896064363407
Energy: 1.1004436929709505
Energy: 0.8531742556936847
Energy: 0.8181011962342015
Energy: 0.819147290544929
Energy: 0.8505080186525324
Energy: 0.9025351771942769
Energy: 0.8692085932519915
Energy: 0.9963813812066347
Energy: 0.8160487602923865
Energy: 0.8179616896953206
Energy: 0.8170071285653712
Energy: 0.8146065763061613
Energy: 0.9969022510623269

minimum gb energy = 0.8144209243553452 eV
minimum distance =  2.36575790583702 Angstroms
sigma value = 23