Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Au__MO_468407568810_006
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080054298043251
cohesive_energy=3.930314275214028
mass=196.9665
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=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.75048867112048e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06387151295308e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.85714556964586e-19, 1.9324813688654397e-19, 7.75266036189822e-20, -6.80838551911764e-20, -2.52636018179022e-19, -4.88748788731602e-19, -7.943880143166119e-19, -1.195294264735896e-18, -1.72852428335724e-18, -2.44934355099384e-18, -3.4441510448107797e-18, -4.8151175687582395e-18, -6.752565685189079e-18, -9.617385680911799e-18, -1.41069249358749e-17, -2.1760923260651398e-17, -3.64504797294804e-17]
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: -5.96046447753906e-08 eV

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

Energy: 0.014574852910002798
Energy: 0.20607981620041155
Energy: 0.2053591591304111
Energy: 0.4935617520733335
Energy: 0.48976131276891066
Energy: 0.17822668001220143
Energy: 0.015227491454037106
Energy: 0.05868913966419904
Energy: 0.40698948170013016
Energy: 0.14006718092259915
Energy: 0.20489850944771626
Energy: 0.3619440286885249
Energy: 0.015762342080015056
Energy: 0.05973910397179493
Energy: 0.01503590284958191
Energy: 0.40721793018895347
Energy: 0.13820674911473646
Energy: 0.20515542815285365
Energy: 0.3615694285777827
Energy: 0.05846155061863533
Energy: 0.05972625049185843
Energy: 0.01653029485646423
Energy: 0.20522193473996703
Energy: 0.20581606692904802
Energy: 0.6273624737602513
Energy: 0.5154031648447558
Energy: 0.05887785608227687
Energy: 0.015251042467686061
Energy: 0.059500610867071306
Energy: 0.49508674488473753
Energy: 0.14264022400718607
Energy: 0.20489151591686755
Energy: 0.36211792329586906
Energy: 0.015463611966454262
Energy: 0.05925573713140411
Energy: 0.014981623600116109
Energy: 0.36128339077517235
Energy: 0.2078565013086338
Energy: 0.20521227239503678
Energy: 0.20508683149799728
Energy: 0.058529186920780366
Energy: 0.05949229676003429

minimum gb energy = 0.014574852910002798 eV
minimum distance =  2.85699337842636 Angstroms
sigma value = 5


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

Energy: 0.6876722630535967
Energy: 0.7334080515902117
Energy: 0.6997815499809585
Energy: 0.644820689471884
Energy: 0.6461642247670886
Energy: 0.6455114115195123
Energy: 0.6132923142548368
Energy: 0.6068541232305485
Energy: 0.6365659069263339
Energy: 0.6106336990063165
Energy: 0.659102903588421
Energy: 0.6294072170754443
Energy: 0.6156061891292629
Energy: 0.6540604626143569
Energy: 0.6016348922796365
Energy: 0.6643536889377318
Energy: 0.6720266687375419
Energy: 0.622395354310305
Energy: 0.6402296712192089
Energy: 0.6631316060047867
Energy: 0.6342215913430865
Energy: 0.6103269784431729
Energy: 0.6359505206793202
Energy: 0.6195250615853529
Energy: 0.6243443629670299
Energy: 0.6254907858775586
Energy: 0.6129149750827699
Energy: 0.6532317611121699
Energy: 0.6455419654278215
Energy: 0.6187623333964514
Energy: 0.6405789079510512
Energy: 0.6244863779916584
Energy: 0.6494055910908896
Energy: 0.6487201672390517
Energy: 0.6376162476226629
Energy: 0.6320770792990157
Energy: 0.644811861721099
Energy: 0.6094710418506203
Energy: 0.6085705951365568
Energy: 0.6398652505691695
Energy: 0.6106009179291102
Energy: 0.6322073915149063
Energy: 0.6622759427297976
Energy: 0.6403019970877954
Energy: 0.6775280562489489
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Energy: 0.6431664750888386
Energy: 0.6772451573001023
Energy: 0.6266425101816281
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Energy: 0.6402811753746452
Energy: 0.6393292034737756
Energy: 0.6260524676211322
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Energy: 0.6487828080679999
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Energy: 0.6237200284592962
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Energy: 0.604447100744916
Energy: 0.6188923024055212
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Energy: 0.6399860891116752
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Energy: 0.630015412259089
Energy: 0.6152730756694098
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Energy: 0.6418956599001069
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Energy: 0.627386222828138
Energy: 0.6309091735384829
Energy: 0.6793609330508968
Energy: 0.635982569568756
Energy: 0.6380180980794006
Energy: 0.6258820844759453
Energy: 0.6847527955712294
Energy: 0.644860668521774
Energy: 0.603543866023919
Energy: 0.6433643344166904
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Energy: 0.6438172706643678
Energy: 0.6272614158292892
Energy: 0.661934921703695
Energy: 0.6412498396670787
Energy: 0.6312625403667587
Energy: 0.6204087327546439
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Energy: 0.6244268291815934
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Energy: 0.6380104220638037
Energy: 0.6366716562116922
Energy: 0.6302285404865366
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Energy: 0.6137202669836203
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Energy: 0.6128605439348505
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Energy: 0.6069438782658628
Energy: 0.6090536883887957
Energy: 0.6397602504295906
Energy: 0.6785436581123786
Energy: 0.617638847964103
Energy: 0.6432213609860168
Energy: 0.6350966223304192
Energy: 0.6442136054583415
Energy: 0.6391452720748944
Energy: 0.6553399049900306
Energy: 0.6320343693561652
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Energy: 0.606551438463799
Energy: 0.6214378493288101
Energy: 0.6241350469709024
Energy: 0.6069958308316822
Energy: 0.6326928576574086
Energy: 0.6983317346126987
Energy: 0.6829096799503637
Energy: 0.6065195716787455
Energy: 0.6437210699264662
Energy: 0.6082844141687144
Energy: 0.6374470071853552
Energy: 0.6229814714955261
Energy: 0.616242517460485
Energy: 0.6400373475559412
Energy: 0.6959979081708138
Energy: 0.6603986390709194
Energy: 0.696912111110962
Energy: 0.6576267764516149
Energy: 0.6608543956527365
Energy: 0.6614073327712727
Energy: 0.631750230617931
Energy: 0.6190902912794795
Energy: 0.6928054508620556
Energy: 0.615256796204617
Energy: 0.6394512712786545
Energy: 0.6304065202915086
Energy: 0.6259510012909157
Energy: 0.6669310892893053
Energy: 0.7247426374053249
Energy: 0.6245638365205358
Energy: 0.6737231410537794
Energy: 0.6389259112967361
Energy: 0.6575320667270449
Energy: 0.6345602319297989
Energy: 0.6098962571995658
Energy: 0.6240586505289626
Energy: 0.6382325532909345
Energy: 0.6684336726997916
Energy: 0.6329779352621211
Energy: 0.6694309917977249
Energy: 0.6052718316275361
Energy: 0.606576571033745
Energy: 0.6130728978544653
Energy: 0.6649180699455051
Energy: 0.6673612376045898
Energy: 0.63126637256554
Energy: 0.6327997648411496
Energy: 0.6610817165400082
Energy: 0.6332414897905322

minimum gb energy = 0.6016348922796365 eV
minimum distance =  2.59289559200078 Angstroms
sigma value = 401


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

Energy: 0.6843955218847179
Energy: 0.7269877129506697
Energy: 0.6492134733456257
Energy: 0.6398181918484159
Energy: 0.6294919438195076
Energy: 0.6460552030338486
Energy: 0.6156391017926269
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Energy: 0.6824514999340494
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Energy: 0.6143534964028635
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Energy: 0.7133751863852611
Energy: 0.6326889629760731
Energy: 0.6108325893416032
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Energy: 0.6643999011008375
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Energy: 0.6348092193889935
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Energy: 0.6194489492385956
Energy: 0.6134000513873252
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Energy: 0.6285986178599
Energy: 0.6108922966300002
Energy: 0.5989128228185725
Energy: 0.6042572896491033
Energy: 0.6747187449342212
Energy: 0.6788452105108429
Energy: 0.6127053230660946
Energy: 0.6216340541296044
Energy: 0.6063274678357586
Energy: 0.59823546022593
Energy: 0.6190928353214704
Energy: 0.6648898525684069
Energy: 0.6301411426079393
Energy: 0.6692532741476869
Energy: 0.618469221079944
Energy: 0.6205078801405175
Energy: 0.6148007087191284
Energy: 0.6488942393955831
Energy: 0.6538903698185331
Energy: 0.6116067967474924
Energy: 0.6305846434676855
Energy: 0.6440693582133308
Energy: 0.6412808407669275
Energy: 0.6308603653977201
Energy: 0.699916668615736
Energy: 0.647609624827178
Energy: 0.6514325867023304
Energy: 0.6484916328608832
Energy: 0.641638306283471
Energy: 0.6191614035990456
Energy: 0.6808515140845993
Energy: 0.6184014863547764
Energy: 0.6312056834509375
Energy: 0.6118723228429573
Energy: 0.6270177764793182
Energy: 0.6473192278216204
Energy: 0.6267516271802209
Energy: 0.617889554807097
Energy: 0.623027537887904
Energy: 0.6254854133373893
Energy: 0.6106040536041687
Energy: 0.6210093996327312
Energy: 0.6401911612627534
Energy: 0.628306994890303
Energy: 0.637603237424283
Energy: 0.6271661182536883
Energy: 0.6249879012023649
Energy: 0.6307569328190737
Energy: 0.6281057202927621
Energy: 0.6375789818343442
Energy: 0.6090279086927257
Energy: 0.6031654918650505
Energy: 0.662191384125759
Energy: 0.6364773425002203
Energy: 0.7395798886404603
Energy: 0.6400787915587056
Energy: 0.6160780739684617
Energy: 0.6369895050874356
Energy: 0.6307163546506485
Energy: 0.6192411249858901
Energy: 0.6661968148529839
Energy: 0.6203564917397911
Energy: 0.6382543607549238
Energy: 0.6357890036146974
Energy: 0.6177213016132149
Energy: 0.6192259167964869
Energy: 0.6353974646314244
Energy: 0.6631175535962648
Energy: 0.7165826120640897
Energy: 0.6560126066452135
Energy: 0.6330984646122977
Energy: 0.6269570763511685
Energy: 0.6000429253703052
Energy: 0.6098234804665776
Energy: 0.6498447870727101
Energy: 0.6573582571868167
Energy: 0.6671779053152497
Energy: 0.6225315491863069
Energy: 0.6175303875580997
Energy: 0.5981154597032147
Energy: 0.6202016027324386
Energy: 0.68368667747901
Energy: 0.6215036639106588
Energy: 0.6499097227623973
Energy: 0.6172883066197992
Energy: 0.6259212041118972
Energy: 0.6167913682165577
Energy: 0.6191640939284062
Energy: 0.6669797060547834
Energy: 0.6093846231843619
Energy: 0.6227684610540244
Energy: 0.6205147718519679
Energy: 0.6162768118219939
Energy: 0.6353055623688941
Energy: 0.6814398902170041
Energy: 0.6422990461434062
Energy: 0.6131312324706897
Energy: 0.6341202668059015
Energy: 0.6415113791389458
Energy: 0.6119010783792791
Energy: 0.6484025369189639
Energy: 0.6310729407424356
Energy: 0.6205319974272969
Energy: 0.6179423474822613
Energy: 0.6302329724105101
Energy: 0.626480397003114
Energy: 0.616076558939403
Energy: 0.6236126610645224
Energy: 0.6161665615569561
Energy: 0.6234237558978473

minimum gb energy = 0.5950681407325499 eV
minimum distance =  2.57862986347195 Angstroms
sigma value = 311


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

Energy: 0.6435598432587564
Energy: 0.6156053635998046
Energy: 0.6751386666974045
Energy: 0.6116665826221255
Energy: 0.63743011592508
Energy: 0.6234200277241019
Energy: 0.6227344002163643
Energy: 0.6305067877302836
Energy: 0.6334309405381884
Energy: 0.620253656619944
Energy: 0.6289953071087526
Energy: 0.6150098106856268
Energy: 0.6181475916189679
Energy: 0.6341612134119673
Energy: 0.6056635854573071
Energy: 0.6080818834558626
Energy: 0.6280754880076623
Energy: 0.6351693154268958
Energy: 0.6173984840431015
Energy: 0.6087030928526022
Energy: 0.605192717002107
Energy: 0.638845814716665
Energy: 0.618863108857518
Energy: 0.623691497044905
Energy: 0.6210794328571418
Energy: 0.6481902501079627
Energy: 0.6155571870391612
Energy: 0.6182774476357533
Energy: 0.6286290188977725
Energy: 0.6379494160194675
Energy: 0.6178091486803042
Energy: 0.6183712648275002
Energy: 0.616964171739772
Energy: 0.6077683762484517
Energy: 0.6380904539147109
Energy: 0.6127898617286868
Energy: 0.6255157152042514
Energy: 0.608383672571143
Energy: 0.6103565713324263
Energy: 0.6156111489187925
Energy: 0.610808079605926
Energy: 0.6338643059735822
Energy: 0.6684877186025451
Energy: 0.6068509457514996
Energy: 0.6376857146786791
Energy: 0.6218604301345607
Energy: 0.6037764966072617
Energy: 0.6155732245409634
Energy: 0.6040916229028308
Energy: 0.617075593454347
Energy: 0.6320904939337444
Energy: 0.6175293482693374
Energy: 0.6185423539609973
Energy: 0.6265545270507392
Energy: 0.6292118886805916
Energy: 0.6337350708205702
Energy: 0.6581792837973827
Energy: 0.6110856563010535
Energy: 0.6155068389382202
Energy: 0.6362724122362693
Energy: 0.629218047261155
Energy: 0.5959254272901362
Energy: 0.6187623893154628
Energy: 0.6346309462941199
Energy: 0.6208676409659338
Energy: 0.6153096096127776
Energy: 0.6332183761911622
Energy: 0.6539648041347849
Energy: 0.6232439108812637
Energy: 0.6285284739060856
Energy: 0.6155283242053022
Energy: 0.621927678105034
Energy: 0.616990105445946
Energy: 0.6210024298544378
Energy: 0.6276918752128755
Energy: 0.6345691556809548
Energy: 0.6423171764537619
Energy: 0.6093751625822814
Energy: 0.6357728781664672
Energy: 0.6229884945820361
Energy: 0.6107797180161934
Energy: 0.6198036347051636
Energy: 0.6120824841737984
Energy: 0.6309277974470857
Energy: 0.646747439428608
Energy: 0.5970805601768545
Energy: 0.6413041348099493
Energy: 0.596079689839344
Energy: 0.7151345944515468
Energy: 0.6403532267399954
Energy: 0.6445604956983991
Energy: 0.6312232071810057
Energy: 0.6705315180716197
Energy: 0.6283932454398835
Energy: 0.667642357414196
Energy: 0.6732416273238386
Energy: 0.6596354350310738
Energy: 0.6813885641875645
Energy: 0.6129149675237135
Energy: 0.6162739043152266
Energy: 0.6076639460100801
Energy: 0.6070861606680207
Energy: 0.616448061815266
Energy: 0.6270448665912014
Energy: 0.6164413542844477
Energy: 0.6167119664497476
Energy: 0.6128305728456965
Energy: 0.6381025678893805
Energy: 0.6186390746361375
Energy: 0.6433969641737236
Energy: 0.6020211119871787
Energy: 0.6248080344590359
Energy: 0.6214022489584524
Energy: 0.6302382802711174
Energy: 0.6279808925998448
Energy: 0.6348704807187372
Energy: 0.6164157649944381
Energy: 0.6248367400705795
Energy: 0.6465891897852875
Energy: 0.6136433930745074
Energy: 0.6460003118626777
Energy: 0.619058468328365
Energy: 0.6094618449728926
Energy: 0.6221736270839
Energy: 0.6193236849187189
Energy: 0.6129781107420936
Energy: 0.6434622486945222
Energy: 0.640139526601787
Energy: 0.6660893682742401
Energy: 0.6323317163405737
Energy: 0.6316274727832464
Energy: 0.6259007941309809
Energy: 0.646216586264034
Energy: 0.673436890140944
Energy: 0.6587801635500452
Energy: 0.6284977526830591
Energy: 0.6761716136921538
Energy: 0.6604061445154052
Energy: 0.6675842547047995
Energy: 0.6841644518376017
Energy: 0.6238498946360149
Energy: 0.6463136292996531
Energy: 0.6341190764146284
Energy: 0.6072792983155406
Energy: 0.6229953377548939
Energy: 0.6217834073652111
Energy: 0.6328998549225295
Energy: 0.6251749374939158
Energy: 0.6472804371583497
Energy: 0.6218397354066667
Energy: 0.6126858683416169
Energy: 0.6327584196466162
Energy: 0.6176743362868244
Energy: 0.6195466983158081
Energy: 0.6321629669083785
Energy: 0.6262339494731279
Energy: 0.6153364960544616
Energy: 0.6193261146949612
Energy: 0.6404640057395411
Energy: 0.6180766457641812
Energy: 0.6125212434397768
Energy: 0.6097325986798515
Energy: 0.6464312109428539
Energy: 0.6249586093334248
Energy: 0.6126826880250735
Energy: 0.6191137404742125
Energy: 0.609442548520686
Energy: 0.6143065324076649
Energy: 0.6665998782012948
Energy: 0.6229590931975123
Energy: 0.6205236739416895
Energy: 0.6536080320605381
Energy: 0.6187218955794527
Energy: 0.6145788791000474
Energy: 0.6349342878761507
Energy: 0.6275122788915612
Energy: 0.662817595650983
Energy: 0.6170856805030606
Energy: 0.6770733934226393
Energy: 0.6732423860268196
Energy: 0.6489564018214173
Energy: 0.6616667761712584
Energy: 0.6292523917782784
Energy: 0.6071932867063626
Energy: 0.6109287698354661
Energy: 0.6043640909756164
Energy: 0.6764001324168503
Energy: 0.6193384321269538
Energy: 0.6516678769074957
Energy: 0.6080578759431524
Energy: 0.6559363715866726
Energy: 0.626496917879458
Energy: 0.6101557964545815
Energy: 0.6426232118627664
Energy: 0.6064940567615708
Energy: 0.6212756807943908
Energy: 0.6173794929084923
Energy: 0.6389892234231126
Energy: 0.6121750658919725
Energy: 0.6363078405462246
Energy: 0.6260347552611665
Energy: 0.6329074761423353
Energy: 0.6240850632532385
Energy: 0.6439433453017945
Energy: 0.6285620392228142
Energy: 0.6287593368425548
Energy: 0.6272629182503319
Energy: 0.620297889395892
Energy: 0.6378757246578033
Energy: 0.6265633186586643
Energy: 0.6457331496318915
Energy: 0.6176488140893698
Energy: 0.615387637695143
Energy: 0.6312876599053351
Energy: 0.6195383280624438
Energy: 0.6045666516594276
Energy: 0.6288883924477018
Energy: 0.6166391976581876
Energy: 0.6289910474589768
Energy: 0.6157674054332577
Energy: 0.6486873664693383
Energy: 0.6727472121770869
Energy: 0.632261680463196
Energy: 0.6142230422436203
Energy: 0.6202992910576156
Energy: 0.6110114454556741
Energy: 0.620984041951551
Energy: 0.6239340495340369
Energy: 0.6239770642480394
Energy: 0.614716471983741
Energy: 0.6406472081051521
Energy: 0.6194170042275977
Energy: 0.6268637966991373
Energy: 0.6140011880800872
Energy: 0.6090930694452301
Energy: 0.6241036982155331
Energy: 0.6266448822137192
Energy: 0.6210032522946379
Energy: 0.6276852568280374
Energy: 0.6520856342621365
Energy: 0.6260513115989753
Energy: 0.634297799467262
Energy: 0.6131810075367888
Energy: 0.6173904526949129
Energy: 0.6673807761111935
Energy: 0.6518601627773714
Energy: 0.6509087508653036
Energy: 0.6703475872287752
Energy: 0.6580228502824835
Energy: 0.6287387034075078
Energy: 0.6228800679221516
Energy: 0.6266426279463896

minimum gb energy = 0.5959254272901362 eV
minimum distance =  2.58740001822962 Angstroms
sigma value = 39


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

Energy: 0.5756055517964507
Energy: 0.6795634885347848
Energy: 0.7931466261653719
Energy: 0.7077670835044667
Energy: 0.6464149165970241
Energy: 0.6716927517349909
Energy: 0.5626343561095113
Energy: 0.6221312402447876
Energy: 0.6278341510754435
Energy: 0.673085589315455
Energy: 0.6508077743242356
Energy: 0.6106008390564022
Energy: 0.6201522355694375
Energy: 0.6138669011092978
Energy: 0.6197461508556498
Energy: 0.6009826627226732
Energy: 0.607947140410551
Energy: 0.6460378342326374
Energy: 0.6108689641453957
Energy: 0.6193692928879012
Energy: 0.6170963303432904
Energy: 0.6174784851379169
Energy: 0.5991566310867581
Energy: 0.6099309452792586
Energy: 0.6093412757226853
Energy: 0.6517606871527251
Energy: 0.6090047042211088
Energy: 0.6622943904237201
Energy: 0.6370744507292159
Energy: 0.6092519386456571
Energy: 0.6648955873667207
Energy: 0.6093912446208011
Energy: 0.6454624831477964
Energy: 0.6123609466428427
Energy: 0.6176616981954005
Energy: 0.5621595555745645
Energy: 0.6102756887524876
Energy: 0.6076754888893506
Energy: 0.6014409659134363
Energy: 0.6289688263959199
Energy: 0.620760063590414
Energy: 0.627671483157815
Energy: 0.6182679091871294
Energy: 0.6175461276845547
Energy: 0.6053193511899438
Energy: 0.7797005507020481
Energy: 0.5638117385738245
Energy: 0.5646414165454017
Energy: 0.6127420516354353
Energy: 0.5636681193875047
Energy: 0.6302160919478739
Energy: 0.6743021623371346
Energy: 0.6013145252997311
Energy: 0.6742176871917107
Energy: 0.6084970563427299
Energy: 0.6673764900448866
Energy: 0.5638167881477606
Energy: 0.6296567509176186
Energy: 0.6745524339007154
Energy: 0.6007491465500023
Energy: 0.6090899625422381
Energy: 0.6077499904317717
Energy: 0.6252759187324174
Energy: 0.6179393593057066
Energy: 0.6184978061840735
Energy: 0.609363712362877
Energy: 0.6438620508374805
Energy: 0.6100660518562929
Energy: 0.617655364505368
Energy: 0.6170353368273892
Energy: 0.6196211681662918
Energy: 0.5992892318197636
Energy: 0.6110936846322583
Energy: 0.5988424420272056
Energy: 0.6091240652899954
Energy: 0.6267436382788265
Energy: 0.6648030239452449
Energy: 0.6278328173285297
Energy: 0.6110353812096552
Energy: 0.5973689385064128
Energy: 0.5994596353287572
Energy: 0.6508863245373373
Energy: 0.6089972781242999
Energy: 0.6237587468604003
Energy: 0.5636950589904381
Energy: 0.6098764657345415
Energy: 0.6752643624002889
Energy: 0.6103363262770833
Energy: 0.6645100982867627
Energy: 0.6088728573262302
Energy: 0.6179280537409602
Energy: 0.6185870614410661
Energy: 0.600744846473623
Energy: 0.6075033154686581
Energy: 0.6645391435294468
Energy: 0.5630622229536889
Energy: 0.5648541003319864
Energy: 0.6145370075812614
Energy: 0.5619724521556444
Energy: 0.6154818123300843
Energy: 0.6111235443096136
Energy: 0.6517626339427877
Energy: 0.5624551852292098
Energy: 0.5624749118211108
Energy: 0.6144284125083109
Energy: 0.575827968300711
Energy: 0.6480923751725546
Energy: 0.6299511414904256
Energy: 0.608184126928189
Energy: 0.6460649060864022
Energy: 0.6718960968346234
Energy: 0.5625379962534562
Energy: 0.6229304354073715
Energy: 0.6262307658705812
Energy: 0.6733997602653582
Energy: 0.6512982498299268
Energy: 0.6102175959121613
Energy: 0.6198616687145949
Energy: 0.6142537869128284
Energy: 0.6179161345965042
Energy: 0.6010888845239573
Energy: 0.609170458478123
Energy: 0.645941954242902
Energy: 0.6108781314157938
Energy: 0.6196103149323401
Energy: 0.6171129229560709
Energy: 0.6174343830686108
Energy: 0.5996499765547025
Energy: 0.6097610738626472
Energy: 0.6097951214520666
Energy: 0.6517326522318442
Energy: 0.6084722876268809
Energy: 0.7015473278441103
Energy: 0.6192673290241061
Energy: 0.6096157371054322
Energy: 0.6648485373207896
Energy: 0.609437497454511
Energy: 0.6460505669380048
Energy: 0.6126734383974546
Energy: 0.6174958211141734
Energy: 0.5621618843727442
Energy: 0.6103183298340193
Energy: 0.60719873583962
Energy: 0.601296244093203
Energy: 0.6284364848161522
Energy: 0.5622144547542154
Energy: 0.6159393128746408
Energy: 0.6181843804129706
Energy: 0.6166900918640731
Energy: 0.6053099801932245
Energy: 0.780053943499957
Energy: 0.5638066464923278
Energy: 0.5648289441974356
Energy: 0.612786463922895
Energy: 0.5634055274805435
Energy: 0.6292203210188059
Energy: 0.7068276260350975
Energy: 0.6008057222439644
Energy: 0.6738765307597607
Energy: 0.6086978206833848
Energy: 0.6171554322103807
Energy: 0.5640357994968818
Energy: 0.6294553437360904
Energy: 0.6636585056168901
Energy: 0.6015453975281184
Energy: 0.6089624710305851
Energy: 0.6081313090352882
Energy: 0.6254485065181328
Energy: 0.617986959858452
Energy: 0.618598625575829
Energy: 0.6093980065541054
Energy: 0.6438461010666537
Energy: 0.6098331637414883
Energy: 0.6183282527838786
Energy: 0.6174580876770221
Energy: 0.619207836780274
Energy: 0.5992001317839042
Energy: 0.6110373311975047
Energy: 0.5991544081748637
Energy: 0.6089764311083747
Energy: 0.6072629206277754
Energy: 0.6649790464132134
Energy: 0.6276422873868609
Energy: 0.6108186102828453
Energy: 0.5974525622339177
Energy: 0.5994436865046949
Energy: 0.6511564406447639
Energy: 0.6066150983086961
Energy: 0.6236153713057273
Energy: 0.5641195372260088
Energy: 0.6094999727504706
Energy: 0.6750864518477719
Energy: 0.6106346758620896
Energy: 0.6642025921953263
Energy: 0.608764726510512
Energy: 0.6181595588270512
Energy: 0.6184176138113351
Energy: 0.6004439383046901
Energy: 0.6071634913646233
Energy: 0.6442004992825593
Energy: 0.5633208885545434
Energy: 0.5645504430141767
Energy: 0.6144931683930628
Energy: 0.5617988524947333
Energy: 0.6156423463592063
Energy: 0.6116583137546292
Energy: 0.6009248656980498
Energy: 0.5625627343510382
Energy: 0.5625727219224819
Energy: 0.6143782973966296

minimum gb energy = 0.5617988524947333 eV
minimum distance =  2.64379640181267 Angstroms
sigma value = 21


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

Energy: 0.7855692675416445
Energy: 0.6656669387444856
Energy: 0.607728373595827
Energy: 0.8383222325452261
Energy: 0.6245172668839908
Energy: 0.6220095210641731
Energy: 0.6950351632835514
Energy: 0.6515460577342306
Energy: 0.6433696228892354
Energy: 0.6291828424795113
Energy: 0.6221011099722259
Energy: 0.5406951012466247
Energy: 0.6134210582295785
Energy: 0.6690268045069577
Energy: 0.6335391760330223
Energy: 0.5852514090683142
Energy: 0.6290078798822544
Energy: 0.6233655552007911
Energy: 0.5667308992940464
Energy: 0.6332982267299357
Energy: 0.6083886275410859
Energy: 0.5792166629382415
Energy: 0.5975228970996077
Energy: 0.6703408736906756
Energy: 0.645257930754915
Energy: 0.5669888930175262
Energy: 0.66722096938459
Energy: 0.6703847736826033
Energy: 0.6080479654019448
Energy: 0.589859540291064
Energy: 0.6047089180462765
Energy: 0.5833040835850466
Energy: 0.5815496110705557
Energy: 0.6128390686102688
Energy: 0.6136002384262419
Energy: 0.5808643612210739
Energy: 0.5907138382343011
Energy: 0.6150029285664138
Energy: 0.6044176736016293
Energy: 0.6220065878838628
Energy: 0.5981842740358089
Energy: 0.6085772742286453
Energy: 0.6731729346147491
Energy: 0.6030383824465303
Energy: 0.5899945069969601
Energy: 0.6261396563631022
Energy: 0.594324967032243
Energy: 0.5937417617167421
Energy: 0.6109615668344249
Energy: 0.604220700102746
Energy: 0.603264418244945
Energy: 0.6217224163706344
Energy: 0.6304908822623486
Energy: 0.5616757546034841
Energy: 0.6143936034317514
Energy: 0.6164239468946744
Energy: 0.6283783745045773
Energy: 0.6215007113932802
Energy: 0.6563598834954971
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Energy: 0.6352091954409722
Energy: 0.6001855993939339
Energy: 0.7195989959498964
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Energy: 0.6022023400716104
Energy: 0.6374079704359343
Energy: 0.6315800608294119
Energy: 0.6683438795056899
Energy: 0.591836793136133
Energy: 0.6120686092539462
Energy: 0.6195319716013074
Energy: 0.5987861365431675
Energy: 0.6343376709027987
Energy: 0.6038716536532429
Energy: 0.5889649609904136
Energy: 0.6311225596782258
Energy: 0.6984691006339602
Energy: 0.6235175267903701
Energy: 0.6888157675451717
Energy: 0.6480899379037909
Energy: 0.6655695051473455
Energy: 0.7208515644728264
Energy: 0.6241418365455679
Energy: 0.7190815776571133
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Energy: 0.5656179536527302
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Energy: 0.6045587744520913
Energy: 0.5701983667772039
Energy: 0.6097524372370331
Energy: 0.6067561684130928
Energy: 0.6169988060918897
Energy: 0.6112504424562711
Energy: 0.6045708370047473
Energy: 0.6757807642846292
Energy: 0.6208913463747684
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Energy: 0.6012860399635466
Energy: 0.6215886302461708
Energy: 0.7121617990111562
Energy: 0.6224396351115993
Energy: 0.5962937643956246
Energy: 0.6324464196641524
Energy: 0.5676743462284386
Energy: 0.626310688868541
Energy: 0.6221613329853971
Energy: 0.5853910866893554
Energy: 0.6333921556226362
Energy: 0.5963042234031314
Energy: 0.5374596513228307
Energy: 0.5751745329582518
Energy: 0.6224220326957906
Energy: 0.640161213368711
Energy: 0.602455483236257
Energy: 0.5883456815702022
Energy: 0.6489637340312728
Energy: 0.5789378306411931
Energy: 0.5620253511692422
Energy: 0.6184951008110308
Energy: 0.6093587979893931
Energy: 0.5839792712797703
Energy: 0.6013668281488841
Energy: 0.6011687066181207
Energy: 0.5964617894151729
Energy: 0.5930943057440888
Energy: 0.6102313602153158
Energy: 0.606431509348117
Energy: 0.5998317976258833
Energy: 0.614361988444353
Energy: 0.6177065298395898
Energy: 0.6266768254429402
Energy: 0.6227506787977815
Energy: 0.6454232728469634
Energy: 0.6008691965598174
Energy: 0.6675682508280989
Energy: 0.6065224517043074
Energy: 0.6370916221472882
Energy: 0.5820280161107088
Energy: 0.6223938875970261
Energy: 0.6129279416691663
Energy: 0.6264281659953487
Energy: 0.5791577849199065
Energy: 0.590277807342392
Energy: 0.6138627922650506
Energy: 0.6206178227895112
Energy: 0.612773900887131
Energy: 0.6015983523454299
Energy: 0.6132119166966035
Energy: 0.7585894852263406
Energy: 0.6137098204914232
Energy: 0.6096020897159558
Energy: 0.6151433301152875
Energy: 0.6151292569823458
Energy: 0.6324234071649157
Energy: 0.6017283486800101
Energy: 0.6034392161295578
Energy: 0.6060723608864463
Energy: 0.5718888518138157
Energy: 0.6227794739939547
Energy: 0.7380311014474437
Energy: 0.7417305154657587
Energy: 0.6563616017968699
Energy: 0.5795575217520641
Energy: 0.6038468577787998
Energy: 0.5885312766956446
Energy: 0.6313749079655826
Energy: 0.6098350228408815
Energy: 0.6582395367276316
Energy: 0.6119381994656278

minimum gb energy = 0.5374596513228307 eV
minimum distance =  2.61867627916917 Angstroms
sigma value = 113


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

Energy: 0.729021908677868
Energy: 0.8218441321840628
Energy: 0.7961453890191267
Energy: 0.6594358742518929
Energy: 0.7326675845402013
Energy: 0.7295720583503842
Energy: 0.607260010032398
Energy: 0.6309892091098736
Energy: 0.714637988054485
Energy: 0.6651275371733075
Energy: 0.6159516401466374
Energy: 0.7113529015382339
Energy: 0.5857891956959157
Energy: 0.7317052483052483
Energy: 0.7346264960044403
Energy: 0.6660241978370401
Energy: 0.6993982191551328
Energy: 0.6600123825219163
Energy: 0.7145416503970147
Energy: 0.6080560601269207
Energy: 0.7024799308725083
Energy: 0.7222837275454068
Energy: 0.6676282655209147
Energy: 0.6943218822273839
Energy: 0.7496905018109894
Energy: 0.7387679394586826
Energy: 0.6913755225860948
Energy: 0.7023594691606097
Energy: 0.5779668498067795
Energy: 0.6146434420328832
Energy: 0.6367332162846999
Energy: 0.6630937694060144
Energy: 0.6415674157013211
Energy: 0.6849973760226867
Energy: 0.7182106765465722
Energy: 0.6383490573765596
Energy: 0.6688252238261434
Energy: 0.6771649479468047
Energy: 0.6687935872651348
Energy: 0.6686457573874404
Energy: 0.6774408254832679
Energy: 0.6774857442019423
Energy: 0.662664080815121
Energy: 0.5912390551300227
Energy: 0.7001324181431736
Energy: 0.6192822849038567
Energy: 0.6960189049182023
Energy: 0.6690540120666899
Energy: 0.6707198536134595
Energy: 0.6455858640521971
Energy: 0.6190422080421325
Energy: 0.5964260462945626
Energy: 0.6177249438917396
Energy: 0.6530479079966868
Energy: 0.5941150172702819
Energy: 0.5816188319733766
Energy: 0.5820375154841742
Energy: 0.6580875204791765
Energy: 0.647137913755437
Energy: 0.5900577180225277
Energy: 0.6842267168087968
Energy: 0.7550314194732952
Energy: 0.642148946892298
Energy: 0.714389218752434
Energy: 0.628885098004093
Energy: 0.5922282280547316
Energy: 0.6235567442660249
Energy: 0.6064108320115197
Energy: 0.6092214001721549
Energy: 0.6067547797149634
Energy: 0.63706646472699
Energy: 0.6076190173889625
Energy: 0.6142328080803251
Energy: 0.5727686895566382
Energy: 0.6295779210172519
Energy: 0.6699118855600824
Energy: 0.6412184743652819
Energy: 0.6096441960856502
Energy: 0.5924786608078167
Energy: 0.6784385800412814
Energy: 0.6808662514556816
Energy: 0.650707332664777
Energy: 0.7064835376344021
Energy: 0.5973200351664434
Energy: 0.6832680614204751
Energy: 0.6062308272612922
Energy: 0.62818523200842
Energy: 0.6271694635604144
Energy: 0.6358261725867946
Energy: 0.6294824756287263
Energy: 0.5955002186650661
Energy: 0.6804328862426293
Energy: 0.5954666142236623
Energy: 0.6679718472421903
Energy: 0.6218884699424143
Energy: 0.6033319341905259
Energy: 0.6715793071041032
Energy: 0.6133345208637132
Energy: 0.5979846085252095
Energy: 0.7475142052151688
Energy: 0.6477262227540158
Energy: 0.6231217214610102
Energy: 0.6338096846333328
Energy: 0.6524304883456489
Energy: 0.6348156537086725
Energy: 0.5750258847459444
Energy: 0.6198524547474196
Energy: 0.6564776545468058
Energy: 0.6460065543923779
Energy: 0.6096833181060554
Energy: 0.681458950067005
Energy: 0.6817804494699472
Energy: 0.6650683592241909
Energy: 0.6922515481754958
Energy: 0.6558734318445786
Energy: 0.7205178261260663
Energy: 0.7029631675617838
Energy: 0.724488560394009
Energy: 0.591355937241657
Energy: 0.6494511591594139
Energy: 0.7102302548555688
Energy: 0.696034965888786
Energy: 0.7387728847792052
Energy: 0.7184460259700359
Energy: 0.6802536761457805
Energy: 0.7233828949042349
Energy: 0.6696902400107269
Energy: 0.6528969433269671
Energy: 0.6221499259469851
Energy: 0.669003453798217
Energy: 0.6485591398928022
Energy: 0.6347764925082623
Energy: 0.6749056694887193
Energy: 0.6090258478294304
Energy: 0.6675412556581
Energy: 0.7446441871238002
Energy: 0.6718673959269136
Energy: 0.7334773194675928
Energy: 0.6915171110704329
Energy: 0.7229309214724883
Energy: 0.6981986899954352
Energy: 0.6136377727808352
Energy: 0.6208540132504947
Energy: 0.661483380720301
Energy: 0.7339608298140813
Energy: 0.7173418613815786
Energy: 0.7290896839352378
Energy: 0.6994843028747078
Energy: 0.6750059075939175
Energy: 0.699474814430908
Energy: 0.6986636015829946
Energy: 0.741205350875961
Energy: 0.7174886255470196
Energy: 0.7233189260538235
Energy: 0.7278657969578659
Energy: 0.6600999150960248
Energy: 0.7916461439786628
Energy: 0.7593808483276847
Energy: 0.7320670277427441
Energy: 0.6909773973610301
Energy: 0.6694576754277687
Energy: 0.6908751656998521
Energy: 0.7191045843837856
Energy: 0.6361137310992205
Energy: 0.6617655007551507
Energy: 0.6514080447827713
Energy: 0.5798963046298845
Energy: 0.7327258339646646
Energy: 0.6528565067961812
Energy: 0.6665341762240999
Energy: 0.687869646470171
Energy: 0.6611051530191804
Energy: 0.7412695561774532
Energy: 0.6795893192266658
Energy: 0.74489900065195
Energy: 0.7009136759708754
Energy: 0.6654829624400292
Energy: 0.6945031628693101
Energy: 0.7503243936116651
Energy: 0.7157697186831854
Energy: 0.6912259859803622
Energy: 0.5974511313676836
Energy: 0.6206863853976191
Energy: 0.6292269402107703
Energy: 0.7107883355715892
Energy: 0.6637603741941382
Energy: 0.6200058668925619
Energy: 0.6887474146893114
Energy: 0.653090904898178
Energy: 0.6378725732307763
Energy: 0.6394776214288933
Energy: 0.6562501196214087
Energy: 0.6350441257966358
Energy: 0.6540773877389432
Energy: 0.6783264884435344
Energy: 0.7084543210744005
Energy: 0.6650631763967898
Energy: 0.5890300562993743
Energy: 0.6640054995653286
Energy: 0.6765439221305768
Energy: 0.6806384016292849
Energy: 0.6693880141762644
Energy: 0.646897209854724
Energy: 0.6824190844632172
Energy: 0.6160398106005248
Energy: 0.627586314232368
Energy: 0.6300279678601126
Energy: 0.643349086085067
Energy: 0.6252462867777168
Energy: 0.5820599562179338
Energy: 0.583139699450232
Energy: 0.6385840910566731
Energy: 0.6479813579791173
Energy: 0.6232089412556894
Energy: 0.6695365892799852
Energy: 0.6771361927365173
Energy: 0.6759862112043228
Energy: 0.6087552981704715
Energy: 0.6405799360277745
Energy: 0.5913322603653965
Energy: 0.6070818411326576
Energy: 0.5939995657455684
Energy: 0.6116865439802204
Energy: 0.6057687800554608
Energy: 0.6353651219607651
Energy: 0.6016402667825205
Energy: 0.6118155993641724
Energy: 0.6362660137405532
Energy: 0.6393635307992018
Energy: 0.6246717104386189
Energy: 0.6399256640084056
Energy: 0.5866811775479351
Energy: 0.5935976047105258
Energy: 0.6779060563411599
Energy: 0.7010687505210456
Energy: 0.698597333979381
Energy: 0.707292865012442
Energy: 0.6427281161296261
Energy: 0.6108143139940945
Energy: 0.6057577477338139
Energy: 0.6285408045887471
Energy: 0.6275526034785522
Energy: 0.6120266005235253
Energy: 0.6383616199000061
Energy: 0.59529204715469
Energy: 0.6790962425875886
Energy: 0.6170521815603726
Energy: 0.6675500575500929
Energy: 0.628642155221212
Energy: 0.6045111296120286
Energy: 0.6637485655179763
Energy: 0.600290601365108
Energy: 0.6099875247515655
Energy: 0.646202661139136
Energy: 0.6470885989820272
Energy: 0.5903504088518434
Energy: 0.6331211423534197
Energy: 0.6521184792856611
Energy: 0.6282239270284977
Energy: 0.5763840319718582
Energy: 0.6159494790021651
Energy: 0.6544670004305315
Energy: 0.6462894364701114
Energy: 0.6208900420309591
Energy: 0.6563278435324252
Energy: 0.6781170941809193
Energy: 0.660702569699236
Energy: 0.6659528466515234
Energy: 0.656082140266878
Energy: 0.6994401148062844
Energy: 0.7026350936057949
Energy: 0.6822103952284818
Energy: 0.6202940127443314
Energy: 0.6508464490057714
Energy: 0.6894302551008626
Energy: 0.6968929115499743
Energy: 0.6626118443006722
Energy: 0.676308833779399
Energy: 0.6109333454335012
Energy: 0.6848546203263824
Energy: 0.7154540229217957
Energy: 0.753590943557515
Energy: 0.6893548396745073
Energy: 0.6951994714078304
Energy: 0.5914392566877594
Energy: 0.602768726251297
Energy: 0.7017422791981474
Energy: 0.6818431776253219
Energy: 0.6670628777930365
Energy: 0.7446803640831434
Energy: 0.6279257127830715
Energy: 0.7325377706625845
Energy: 0.7227135851470884
Energy: 0.6765859210655221
Energy: 0.6992264756830708
Energy: 0.6070084875369637
Energy: 0.6229342605946956
Energy: 0.6595337452407627
Energy: 0.7483857879570578
Energy: 0.7166995044093042
Energy: 0.7021456458370745
Energy: 0.6983919165536049
Energy: 0.6813105950560187
Energy: 0.6995924619165311
Energy: 0.699820434261779
Energy: 0.7459519986026996
Energy: 0.7175709698565168
Energy: 0.6948465375284322
Energy: 0.7194081309061557
Energy: 0.683838136101766
Energy: 0.791641637796688
Energy: 0.7622451019763113
Energy: 0.7053546351727635
Energy: 0.6918008524242873
Energy: 0.6690665871165886

minimum gb energy = 0.5727686895566382 eV
minimum distance =  2.60229197217096 Angstroms
sigma value = 365


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

Energy: 0.6430309770930782
Energy: 0.7967678405968467
Energy: 0.6329312287806002
Energy: 0.574829570670277
Energy: 0.5741310481181109
Energy: 0.6296602578025703
Energy: 0.6353901644474591
Energy: 0.6185224655473222
Energy: 0.6911965676718348
Energy: 0.5744058337096444
Energy: 0.5756467485385488
Energy: 0.5753406037932649
Energy: 0.5748453936912423
Energy: 0.6909771259971903
Energy: 0.619140084671566
Energy: 0.6895903515781069
Energy: 0.5754965231102607
Energy: 0.574762856604113
Energy: 0.5753695900919189
Energy: 0.5752179759850523
Energy: 0.5753426352226405
Energy: 0.6197712258540098
Energy: 0.6899968351539808
Energy: 0.5748933061221925
Energy: 0.5749187130484338
Energy: 0.5747152156410696
Energy: 0.5752403873245416
Energy: 0.576124315017107
Energy: 0.6396082918258953
Energy: 0.691225915135219
Energy: 0.6183348656571794
Energy: 0.6902557926804915
Energy: 0.5748729851551132
Energy: 0.6171465023137082
Energy: 0.6908318265506891
Energy: 0.6245621976289708
Energy: 0.7633278674627697
Energy: 0.5745815868170724
Energy: 0.5741869119600178
Energy: 0.5742321224457969
Energy: 0.5745044776564441
Energy: 0.6360096397633547
Energy: 0.6194906049160466
Energy: 0.6902972610596483
Energy: 0.5746425273336468
Energy: 0.5756922407657805
Energy: 0.5753641792139248
Energy: 0.5749178342266428
Energy: 0.6904841601063111
Energy: 0.6196380138002004
Energy: 0.6903614177592519
Energy: 0.5753118615825921
Energy: 0.5750764689371703
Energy: 0.5755498495968314
Energy: 0.5752278907084439
Energy: 0.6905039301002148
Energy: 0.6216138172055583
Energy: 0.7623572827726848
Energy: 0.5744412010705617
Energy: 0.5744523772100779
Energy: 0.574498298440525
Energy: 0.5747154504944343
Energy: 0.6369345146635194
Energy: 0.6393460333898809
Energy: 0.6910885778802542
Energy: 0.6184040272610551
Energy: 0.6907362778729347
Energy: 0.6916199512487966
Energy: 0.6173619995765794
Energy: 0.691147831574256
Energy: 0.6208039501451698
Energy: 0.6911966208891274
Energy: 0.5750758362710835
Energy: 0.5743332880809512
Energy: 0.5748657201799088
Energy: 0.5746897511261105
Energy: 0.6380621077657601
Energy: 0.6191224016529462
Energy: 0.6901627177866928
Energy: 0.575299235331195
Energy: 0.5754100864685513
Energy: 0.5750419398782587
Energy: 0.5754845316579222
Energy: 0.6901705301377637
Energy: 0.6198501065727888
Energy: 0.690169776889483
Energy: 0.5744044678597835
Energy: 0.5755425226160931
Energy: 0.5756425151203497
Energy: 0.5748744175180791
Energy: 0.6907928625845301
Energy: 0.6226617783222974
Energy: 0.7636578641849077
Energy: 0.5749673685074013
Energy: 0.574224757255733
Energy: 0.5742119578298472
Energy: 0.5749113952761866
Energy: 0.635555373691279
Energy: 0.6398693847566859
Energy: 0.6914502502786144
Energy: 0.6181515845308021
Energy: 0.5746357463857803
Energy: 0.5752029150618859
Energy: 0.5742748354596797
Energy: 0.6906560999832799
Energy: 0.6196933403418992
Energy: 0.6893844570231591
Energy: 0.5753031276985329
Energy: 0.5748542642419161
Energy: 0.5750328503391413
Energy: 0.5748560028650785
Energy: 0.5755531107771455
Energy: 0.6193834359163215
Energy: 0.6897122736522334
Energy: 0.5751285667923257
Energy: 0.5751130422323927
Energy: 0.5748247858478978
Energy: 0.5754414323412412
Energy: 0.575506274760328
Energy: 0.6401041560173669
Energy: 0.6912105312033143
Energy: 0.5739950596570982
Energy: 0.5752909037146627
Energy: 0.5752988629525855
Energy: 0.5745725100882942
Energy: 0.6906187100419378
Energy: 0.6343371927846528
Energy: 0.7637628484172903
Energy: 0.576255920739513
Energy: 0.5739009325509242
Energy: 0.5750170387878415
Energy: 0.5762247607841838
Energy: 0.635401554096953
Energy: 0.6197813414142688
Energy: 0.6906145602426303
Energy: 0.5744667272502125
Energy: 0.5757694698853328
Energy: 0.5755584914951424
Energy: 0.574780310277338
Energy: 0.6909501133815391

minimum gb energy = 0.5739009325509242 eV
minimum distance =  2.69045708528936 Angstroms
sigma value = 23