Model name: model_name=EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.492127545177937
cohesive_energy=3.2787006807142314
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.5988697414274238e-19, 2.3622171856369197e-19, 2.8901343865399195e-19, 3.28244335714116e-19, 3.5890358778233996e-19, 3.8387991932976594e-19, 4.04703409041864e-19, 4.222712758336739e-19, 4.37421458084778e-19, 4.5085250480759995e-19, 4.62921701391522e-19, 4.737524154373619e-19, 4.83383099184336e-19, 4.918457961651239e-19, 4.991805607955759e-19, 5.05441867081248e-19, 5.1068579120433e-19, 5.14973215876914e-19, 5.18389056460602e-19, 5.21024637023532e-19, 5.229664751039399e-19, 5.242786577671859e-19, 5.250284764318979e-19, 5.252639963970959e-19, 5.250076481356559e-19, 5.241921402289499e-19, 5.227261486088399e-19, 5.20489510027776e-19, 5.17333222058796e-19, 5.13052206092748e-19, 5.07382102985022e-19, 4.99986455642478e-19, 4.90448698140276e-19, 4.78272155721876e-19, 4.6287684044577e-19, 4.435770207126059e-19, 4.19467466724174e-19, 3.89295276352686e-19, 3.5130286183064396e-19, 3.0311099085655796e-19, 2.4164027993988e-19, 1.6302788121603597e-19, 6.2229341552877e-20, -6.80974736925654e-20, -2.3843592667188e-19, -4.6209978477828e-19, -7.580506482574919e-19, -1.159320592772694e-18, -1.72400614524936e-18, -2.5533408363067797e-18, -3.82902591583026e-18, -5.9108942340498596e-18, -9.6145818718023e-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: -0.0422236321099957 eV

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

Energy: 0.01533007314315383
Energy: 0.018287382471662193
Energy: 0.07349054647389064
Energy: 0.07297359018194532
Energy: 0.01784192742108245
Energy: 0.016347318225426195
Energy: 0.07196551350511016
Energy: 0.07385512708717851
Energy: 0.07262789950353024
Energy: 0.017377636450818464
Energy: 0.020342853244164814
Energy: 0.07560083281174138
Energy: 0.07231535743359599
Energy: 0.07362369175742482
Energy: 0.07346388436147347
Energy: 0.0720342242787196
Energy: 0.07558318722708492
Energy: 0.07198575690133643
Energy: 0.07354597714930818
Energy: 0.07307256791025449
Energy: 0.07398410418232675
Energy: 0.018287791750721857
Energy: 0.015696756763583126
Energy: 0.07211923640530649
Energy: 0.07275855393757429
Energy: 0.07397361628137454
Energy: 0.01760463257014268
Energy: 0.015746074590149307
Energy: 0.07182073414724127
Energy: 0.0734137585069724
Energy: 0.07285354584497081
Energy: 0.0164014978556466
Energy: 0.016554288147387436
Energy: 0.07490382244516934
Energy: 0.07183891980348064
Energy: 0.07333503073366196
Energy: 0.01679118418442824
Energy: 0.016022792032105566
Energy: 0.07514321484224216
Energy: 0.0717633338614996
Energy: 0.07266894983715745
Energy: 0.07239591560802326
Energy: 0.07440305784382349
Energy: 0.016891144210384134
Energy: 0.01585475730239767
Energy: 0.07219722618498103
Energy: 0.07304843337380568
Energy: 0.07401213912109639
Energy: 0.017915578192367485
Energy: 0.075243442157203
Energy: 0.0746167774478096
Energy: 0.07197346022950056
Energy: 0.07276685718772584
Energy: 0.016260347029577987
Energy: 0.018978441528699843
Energy: 0.07461699984135503
Energy: 0.07152749928842012
Energy: 0.07325418396821336
Energy: 0.016696482509277556
Energy: 0.019730763725178117
Energy: 0.02010430351743613
Energy: 0.07438231087806026
Energy: 0.07265245977782508
Energy: 0.07266794147023684
Energy: 0.07494438052451682
Energy: 0.019653993324139665
Energy: 0.07479050919476807
Energy: 0.07244696333019873
Energy: 0.07318106551751956
Energy: 0.0743527608178316

minimum gb energy = 0.01533007314315383 eV
minimum distance =  2.43225753283915 Angstroms
sigma value = 3


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

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Energy: 0.6005266123922722
Energy: 0.611920539331878
Energy: 0.6027908521314311
Energy: 0.5852685143695026
Energy: 0.6094737116432888
Energy: 0.5865511598786973
Energy: 0.6127332309261059
Energy: 0.6127978613401978
Energy: 0.6003404439544469
Energy: 0.5612167848626702
Energy: 0.6951415896144798
Energy: 0.6161945373518365
Energy: 0.538264427946564
Energy: 0.4745336842994326
Energy: 0.4745285630905113
Energy: 0.6306524780907466
Energy: 0.612669004484386
Energy: 0.5373012385427769
Energy: 0.5857062104855254
Energy: 0.6188742749986573
Energy: 0.6370706081904972
Energy: 0.5268973264741454
Energy: 0.4760326510950991
Energy: 0.4736810025056092
Energy: 0.47733395350983765
Energy: 0.5627498084814018
Energy: 0.5281635482011827
Energy: 0.52234115734929
Energy: 0.580417040576016
Energy: 0.5234495273194804
Energy: 0.6667463428441673
Energy: 0.5972761819185542
Energy: 0.4735497957164675
Energy: 0.4733591632600985
Energy: 0.4757634399653503
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Energy: 0.5272930153375412
Energy: 0.5446980478150705
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Energy: 0.6126708159249189
Energy: 0.601530812767959
Energy: 0.6408018438200659
Energy: 0.49976667860565155
Energy: 0.5053307575994256
Energy: 0.6316612291845155
Energy: 0.5736221430168132
Energy: 0.6041717679723169
Energy: 0.625046933706494
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Energy: 0.6351992046320865
Energy: 0.6049175825295161
Energy: 0.6021150285906308
Energy: 0.5471499800982771
Energy: 0.6841824674043422
Energy: 0.6010879857866217
Energy: 0.6013598654727232
Energy: 0.6526149703475197
Energy: 0.5466901136426174
Energy: 0.6301537968629587
Energy: 0.6311216243173617
Energy: 0.6142660380130945
Energy: 0.630120253051798
Energy: 0.49994513168236837
Energy: 0.6211282314031189
Energy: 0.627330830330001
Energy: 0.5954402723873448
Energy: 0.5479811563360241
Energy: 0.5005390090427964
Energy: 0.6265413172793572
Energy: 0.6321202431566965
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Energy: 0.6243983358050396
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Energy: 0.6289104638421893
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Energy: 0.6849276140483616
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Energy: 0.5017051511772366
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Energy: 0.5549805450959635
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Energy: 0.6273400908510528
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Energy: 0.6239312041417645
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Energy: 0.6298053313386744
Energy: 0.6328463705822025
Energy: 0.5773986811384145
Energy: 0.6202636259422386
Energy: 0.6241409739145881
Energy: 0.6279840605910478
Energy: 0.6159128071927004
Energy: 0.6213311409016264
Energy: 0.6191938123646953
Energy: 0.6164739628851403
Energy: 0.6276265798461902
Energy: 0.6233256427180434
Energy: 0.6228287107917106
Energy: 0.5343345763154241
Energy: 0.6893492328186221
Energy: 0.6285514173240149
Energy: 0.6221685282511844
Energy: 0.5014774388218302
Energy: 0.5181922994273854
Energy: 0.6261717362467506
Energy: 0.6283824174957698
Energy: 0.6297567911214239
Energy: 0.5008229893306779
Energy: 0.6016413104276771
Energy: 0.5643999287986367
Energy: 0.5266524470451318
Energy: 0.545272264699452
Energy: 0.4983488680446697
Energy: 0.5260035032110747
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Energy: 0.527673659671899
Energy: 0.5897652026650734
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Energy: 0.5423421787141153
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Energy: 0.5226110490635054
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Energy: 0.5641782303995527
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Energy: 0.6302089789783312
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Energy: 0.6230277540640222
Energy: 0.4997010399951665
Energy: 0.6377540081697136
Energy: 0.6316248837912265
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Energy: 0.5461021830704494
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Energy: 0.6512012477669371
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Energy: 0.6016922155174748
Energy: 0.6318648075008368
Energy: 0.5891568272213225
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Energy: 0.5003786243062212
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Energy: 0.6292452942680506
Energy: 0.6221422621073058
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Energy: 0.6250680891295924
Energy: 0.6320417193827728
Energy: 0.6303779319649335
Energy: 0.5440267772404836
Energy: 0.5700599135816253
Energy: 0.6296168676371781
Energy: 0.629201441409743
Energy: 0.6179866746119118
Energy: 0.5726516496256179
Energy: 0.5367496182296133
Energy: 0.6229615752946567
Energy: 0.6834891167772165
Energy: 0.5566688406674524
Energy: 0.526131111590928
Energy: 0.5498640497765682
Energy: 0.6275035950020093
Energy: 0.6793034518442836
Energy: 0.5540283171767703
Energy: 0.5268240494835745
Energy: 0.5876733175729636
Energy: 0.6252916975539559
Energy: 0.5167237856196254
Energy: 0.5961045034909978
Energy: 0.49927149239500873
Energy: 0.5635061856692846
Energy: 0.5238518140657406
Energy: 0.5451936709613664
Energy: 0.504185987468118
Energy: 0.5480735812029722
Energy: 0.5544250824549569
Energy: 0.5211193743214377
Energy: 0.5651977479593502
Energy: 0.5529260467536388
Energy: 0.5010909406822053
Energy: 0.5691249811739019
Energy: 0.5218391968407426
Energy: 0.5367856210916613
Energy: 0.549899888591041
Energy: 0.5037293589233564
Energy: 0.5522954933307432
Energy: 0.5211873923446287
Energy: 0.5192297770636606
Energy: 0.5524334463468284
Energy: 0.5031931919066159
Energy: 0.584577319335634
Energy: 0.6099888260580641
Energy: 0.5321750127523445
Energy: 0.4771431559568693
Energy: 0.5523224378146131
Energy: 0.6824426276143747
Energy: 0.6147555043955838
Energy: 0.6723361537265483
Energy: 0.6188353741658497
Energy: 0.6281163878585639
Energy: 0.6359165345806662
Energy: 0.6320628831123849
Energy: 0.60548438131282
Energy: 0.47374446750781035
Energy: 0.5590208229222843
Energy: 0.637076666326371
Energy: 0.6318506927271517
Energy: 0.5862773452640218
Energy: 0.5856132271921064
Energy: 0.6137365857148256
Energy: 0.6124636781353593
Energy: 0.5830428032694067
Energy: 0.4766802794943746
Energy: 0.4750720372273842
Energy: 0.6166964483060475
Energy: 0.6086576079607334
Energy: 0.6268091928177174
Energy: 0.6020479890205106
Energy: 0.5848410585804135
Energy: 0.6135474729099812
Energy: 0.5942440005240869
Energy: 0.5855159298183529
Energy: 0.5859325232952998
Energy: 0.586207019238438
Energy: 0.612088414613036
Energy: 0.600709747423517
Energy: 0.5765243625361672

minimum gb energy = 0.4733591632600985 eV
minimum distance =  2.15913602364364 Angstroms
sigma value = 75


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

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Energy: 0.5902150570849215
Energy: 0.6069238483375596
Energy: 0.6151655354207756
Energy: 0.6726599559988453
Energy: 0.5861383701748295
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Energy: 0.616853229878664
Energy: 0.6800000992635088
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Energy: 0.6068658079563507
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Energy: 0.5818842803926151
Energy: 0.5547570213220797
Energy: 0.6060440148173517
Energy: 0.6270290564425041
Energy: 0.5660353526493621
Energy: 0.6458262736884649
Energy: 0.6963459755848996
Energy: 0.5999857647194773
Energy: 0.620359375962263
Energy: 0.6001537236339369
Energy: 0.5809108825193566
Energy: 0.6118076286180762
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Energy: 0.5794148990136456
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Energy: 0.5879678565901706
Energy: 0.5993882116214376
Energy: 0.5836014155394857
Energy: 0.5797100762492923
Energy: 0.6021493626801303
Energy: 0.5851649896735612
Energy: 0.6157865686862193
Energy: 0.5581307100917222
Energy: 0.6086910282156941
Energy: 0.6021048338815522
Energy: 0.5817176424934551
Energy: 0.5313802795970449
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Energy: 0.6438092571284376
Energy: 0.6201486112105042
Energy: 0.6382912417807697
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Energy: 0.6954730123626273
Energy: 0.6569739470315727
Energy: 0.6359294436574021
Energy: 0.5929571718843694
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Energy: 0.6250007350830233
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Energy: 0.6332787138615643
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Energy: 0.6441117034629814
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Energy: 0.6118566317857157
Energy: 0.5715696192452994
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Energy: 0.5903371823484722
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Energy: 0.6248639657551879
Energy: 0.5827648952269573
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Energy: 0.7140849991549987
Energy: 0.7324928637580331
Energy: 0.636451213757581
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Energy: 0.6188570132383463
Energy: 0.7306560820727034
Energy: 0.627584713999889
Energy: 0.5435920660938828
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Energy: 0.6228840344374614
Energy: 0.6200213240309119
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Energy: 0.5907483714873569
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minimum gb energy = 0.5154384726208258 eV
minimum distance =  2.20331924278332 Angstroms
sigma value = 105


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

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Energy: 0.6451868869378199
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Energy: 0.6079958090776769
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Energy: 0.5917101814567334
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Energy: 0.5799598746565897
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Energy: 0.6621576406551702
Energy: 0.5768750903631089
Energy: 0.6051987719266904
Energy: 0.5934659752789068
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Energy: 0.6172471273488879
Energy: 0.6051166068490283
Energy: 0.6397760216216167
Energy: 0.5886497905259596
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Energy: 0.6359026635453818
Energy: 0.5885114299279095
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Energy: 0.6453673248298
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Energy: 0.5869485307296589
Energy: 0.5860471963805796
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Energy: 0.5906987151992725
Energy: 0.5869271025620628
Energy: 0.5894014601810275
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Energy: 0.6501325361633469
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Energy: 0.6087718991567441
Energy: 0.6210763956502151
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Energy: 0.6495364794759361
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Energy: 0.6120467420950358
Energy: 0.6215669196612565
Energy: 0.6133977253192571
Energy: 0.6068762133917295
Energy: 0.6179705965359481
Energy: 0.6142984661636555
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Energy: 0.6543688697616955
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Energy: 0.614244250750473
Energy: 0.5762569628692628
Energy: 0.6158685703584781
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Energy: 0.5965345244643976
Energy: 0.641867291606478
Energy: 0.5720359665270979
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Energy: 0.6090915240939274
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Energy: 0.6420087898745064
Energy: 0.6118192585860148
Energy: 0.6115489472388672
Energy: 0.6102767926314185
Energy: 0.6426990684249474
Energy: 0.6431046166167291
Energy: 0.6116448413266801
Energy: 0.6104626847092756
Energy: 0.6067458020487096
Energy: 0.6418494070318932
Energy: 0.6537150796724192
Energy: 0.6136917359838727
Energy: 0.6074311988712111
Energy: 0.6092917522974688
Energy: 0.611908492056513
Energy: 0.6468928562457357
Energy: 0.6143912827155856
Energy: 0.6068269217003617
Energy: 0.6096341613859282
Energy: 0.612966437026175
Energy: 0.614954262115308
Energy: 0.6163228653081427
Energy: 0.6136027280259936
Energy: 0.6132035631074002
Energy: 0.6193451384420999
Energy: 0.6142620729928506
Energy: 0.6161704599432658
Energy: 0.6133151539841419
Energy: 0.613325249878548
Energy: 0.6039450599059625
Energy: 0.6192966627955061
Energy: 0.5804592312649036
Energy: 0.6140291029378143
Energy: 0.6137547606112767
Energy: 0.5786484966908895
Energy: 0.6131829414532255
Energy: 0.5806626041329908
Energy: 0.6138488119966556
Energy: 0.6140004526489142
Energy: 0.6003766650801858
Energy: 0.5923147829148954
Energy: 0.5814760176517338
Energy: 0.616288167451918
Energy: 0.614818394765975
Energy: 0.5784775747797011
Energy: 0.5923983584716743
Energy: 0.5802401411443093
Energy: 0.6125809836717204
Energy: 0.6222672177607219
Energy: 0.6098777332763303
Energy: 0.6518032624299595
Energy: 0.641483215205203
Energy: 0.6425022041705187
Energy: 0.6431736862375697
Energy: 0.6476506052001749
Energy: 0.5843132721928865
Energy: 0.6413701937582764
Energy: 0.6424423622596624
Energy: 0.6432523641649349
Energy: 0.6481408714239058
Energy: 0.6232192114888688
Energy: 0.6025322589092498
Energy: 0.5808044398202639
Energy: 0.5785585686863963
Energy: 0.6196572655627879
Energy: 0.5908104375514942
Energy: 0.5937529474453973
Energy: 0.5803011009466231
Energy: 0.5786594796243497
Energy: 0.6186447541924324
Energy: 0.6537668419252942
Energy: 0.5802272895106516
Energy: 0.58153337525906
Energy: 0.5805989625434589
Energy: 0.5791236156287235
Energy: 0.578175587780572
Energy: 0.5799089901526422
Energy: 0.5803708068618153
Energy: 0.5799200046974983
Energy: 0.6187754621957

minimum gb energy = 0.5720359665270979 eV
minimum distance =  2.22784441935546 Angstroms
sigma value = 165


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

Energy: 0.8426249597061847
Energy: 0.5858312694795238
Energy: 0.5904658175053804
Energy: 0.6167676624076897
Energy: 0.5595593900661563
Energy: 0.7830016070121465
Energy: 0.5933382048542737
Energy: 0.5917903644605401
Energy: 0.6222281049196868
Energy: 0.5847410015014537
Energy: 0.5847970122879942
Energy: 0.6252780275031589
Energy: 0.6199944539810724
Energy: 0.6195805619782159
Energy: 0.6152680162657607
Energy: 0.6042467564089297
Energy: 0.5834655356776904
Energy: 0.6221432056763861
Energy: 0.6226343311217266
Energy: 0.6560279942711122
Energy: 0.593991677841063
Energy: 0.6608286865576074
Energy: 0.5920510269872981
Energy: 0.5966694849215033
Energy: 0.6206051823467097
Energy: 0.5926379734396031
Energy: 0.5943411718716601
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Energy: 0.6216709845558008
Energy: 0.6736182056988883
Energy: 0.5940741811866893
Energy: 0.6154740449747196
Energy: 0.6255107548606048
Energy: 0.5975213242783258
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Energy: 0.59576188454834
Energy: 0.5944875509065094
Energy: 0.6206464388160386
Energy: 0.6497165290856795
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Energy: 0.6217306113142991
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Energy: 0.5813668822704643
Energy: 0.6245963224254985
Energy: 0.5942394264991598
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Energy: 0.5863339018823943
Energy: 0.6204709216540635
Energy: 0.5992567546618887
Energy: 0.5997072472652646
Energy: 0.627501598322549
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Energy: 0.6422396710061088
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Energy: 0.6440577729908569
Energy: 0.646574141932137
Energy: 0.5602269229962787
Energy: 0.5615877656716406
Energy: 0.5874215383734896
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Energy: 0.6435431535320771
Energy: 0.6380866010367716
Energy: 0.5622863299827044
Energy: 0.6217533728405283
Energy: 0.6159830166377525
Energy: 0.6436886484419784
Energy: 0.616392549212604
Energy: 0.6195340654377071
Energy: 0.6028473596267009
Energy: 0.6526975678344366
Energy: 0.6500225986297109
Energy: 0.6400167908973102
Energy: 0.6357508784900787
Energy: 0.5935634360954605
Energy: 0.6434884257404276
Energy: 0.6481872084564668
Energy: 0.6414863219405302
Energy: 0.6352510396913665
Energy: 0.6479671879725392
Energy: 0.6049272881284449
Energy: 0.6181190503228539
Energy: 0.6210480596529077
Energy: 0.6504848371127052
Energy: 0.6314813846039579
Energy: 0.6032765464337265
Energy: 0.6482998498861317
Energy: 0.6228618441781798
Energy: 0.6501488387248222
Energy: 0.6494921946142058
Energy: 0.6019762724870164
Energy: 0.5884696369808624
Energy: 0.5872421810859964
Energy: 0.6521240186221512
Energy: 0.6168722475890281
Energy: 0.6260782038265998
Energy: 0.6245210416651367
Energy: 0.6279357608275696
Energy: 0.6333168412319278
Energy: 0.6188650969740048
Energy: 0.5811741484059575
Energy: 0.5821607131444886
Energy: 0.590132373362846
Energy: 0.5998625135114193
Energy: 0.6200700018682525
Energy: 0.6005924182622672
Energy: 0.6297347636943686
Energy: 0.5977805003915073
Energy: 0.5818328616517306
Energy: 0.5902761905671433
Energy: 0.6148347417759888
Energy: 0.5889858036762685
Energy: 0.5810310920287979
Energy: 0.6162263156824722
Energy: 0.5944063037581729
Energy: 0.594056038901943
Energy: 0.5875113182521472
Energy: 0.5865958557626262
Energy: 0.5836598178330941
Energy: 0.6461923664269068
Energy: 0.617366918017577
Energy: 0.5913667694819009
Energy: 0.6010657049010041
Energy: 0.598408334037554
Energy: 0.615597233136212
Energy: 0.6212857405399114
Energy: 0.5930531962790417
Energy: 0.6265245092787912

minimum gb energy = 0.5595593900661563 eV
minimum distance =  2.23626906511564 Angstroms
sigma value = 41


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

Energy: 0.6638451797850357
Energy: 0.5312632170534184
Energy: 0.5263809445967654
Energy: 0.5340123914128393
Energy: 0.5101921189432354
Energy: 0.5623180879825503
Energy: 0.5251031988195292
Energy: 0.5264589031726574
Energy: 0.5264950960262716
Energy: 0.5192585731659398
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Energy: 0.5425395417866749
Energy: 0.5324119868176169
Energy: 0.5331104999982077
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Energy: 0.5370881849699985
Energy: 0.5490425681083614
Energy: 0.5269857019264096
Energy: 0.5618668782214573
Energy: 0.5718103523499284
Energy: 0.5340160604930703
Energy: 0.5440591741699368
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Energy: 0.5757526092348738
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Energy: 0.5511432287538063
Energy: 0.5334302885850963
Energy: 0.5611888708050917
Energy: 0.5454539091139047
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Energy: 0.5598697414056147
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Energy: 0.5328720445287667
Energy: 0.5279354343750782
Energy: 0.6216116888254783
Energy: 0.566221741371874
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Energy: 0.5627747843644632
Energy: 0.5573744245819798
Energy: 0.5478864160734895
Energy: 0.5408316719273171
Energy: 0.5267352174940727
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Energy: 0.5298761895849657
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Energy: 0.5459572627479224
Energy: 0.560750351486306
Energy: 0.5284112350086975
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Energy: 0.52295971704316
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Energy: 0.5536176659356777
Energy: 0.6280175446920918
Energy: 0.5667896272831504
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Energy: 0.5455376223767515
Energy: 0.5644628571864455
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Energy: 0.5467517925331874
Energy: 0.5477280375481263
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Energy: 0.5683363763056449
Energy: 0.5584990727594137
Energy: 0.5621755640207787
Energy: 0.5530267949840179
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Energy: 0.5772372500659092
Energy: 0.5575626400915179
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Energy: 0.5473217254686066
Energy: 0.5723646397043757
Energy: 0.5666375556708039
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Energy: 0.5631212854505915
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Energy: 0.5069431476490116
Energy: 0.5364366164476253
Energy: 0.5309299843716951
Energy: 0.5867758272002619
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Energy: 0.5380348629468563
Energy: 0.5049135706825675
Energy: 0.5151244881287862
Energy: 0.5328191437206581
Energy: 0.5330217993811551
Energy: 0.5154777596030952
Energy: 0.5251160206881776
Energy: 0.5153815545904866
Energy: 0.5332873270090385
Energy: 0.536333901128571
Energy: 0.5432353631155986
Energy: 0.5341691047730638
Energy: 0.5357962502523484
Energy: 0.5647262491171877
Energy: 0.5302876612367737
Energy: 0.5257804731414613
Energy: 0.5107551921803685
Energy: 0.5322791414110372
Energy: 0.5493473760134289
Energy: 0.5363204856002575
Energy: 0.5191794339615294
Energy: 0.5405784658845245
Energy: 0.5444736265501561
Energy: 0.5163145977266789
Energy: 0.5434495183733598
Energy: 0.545572928286511
Energy: 0.507875655810552
Energy: 0.5608516834951316
Energy: 0.5165418372908294
Energy: 0.5290836454054668
Energy: 0.5325885967675443
Energy: 0.5317630332044196

minimum gb energy = 0.5049135706825675 eV
minimum distance =  2.23478127728825 Angstroms
sigma value = 185


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

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Energy: 0.33747980215802786
Energy: 0.4395965435129272
Energy: 0.4132967432372439
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Energy: 0.2720987609676444
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Energy: 0.4650676870213129
Energy: 0.4182139660414084
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Energy: 0.2639736610931674
Energy: 0.37431542160282744
Energy: 0.4567282874111461
Energy: 0.43526490358241005
Energy: 0.2640837983447798
Energy: 0.264994066599686
Energy: 0.43197924875633176
Energy: 0.41307160921764424
Energy: 0.412663679631891
Energy: 0.43297302251287223
Energy: 0.44143526386992366
Energy: 0.4219555274796412
Energy: 0.42169959534649665
Energy: 0.41119188968888576
Energy: 0.41092418585673784
Energy: 0.41658271417487513
Energy: 0.4327671326263384
Energy: 0.43216929379862457
Energy: 0.41739300403861695
Energy: 0.34069591256150955
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Energy: 0.4325973424982633
Energy: 0.4310979616933046
Energy: 0.4092198451298376
Energy: 0.23807072352051692
Energy: 0.4152571647321716
Energy: 0.4040233598086866
Energy: 0.43099951423211047
Energy: 0.34099870741694

minimum gb energy = 0.2313180439745759 eV
minimum distance =  2.30619984418705 Angstroms
sigma value = 33


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

Energy: 0.4777460080025475
Energy: 0.47364263496022196
Energy: 0.4872419633943354
Energy: 0.4975240510388046
Energy: 0.46927733325385784
Energy: 0.4657167043246353
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Energy: 0.4793188902018804
Energy: 0.47988018862079973
Energy: 0.46943763828667256
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Energy: 0.4685722242929963
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Energy: 0.468646991698896
Energy: 0.4772681774874239
Energy: 0.4862090662469114
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Energy: 0.4652770810664754
Energy: 0.4772352442747823
Energy: 0.47884146502556774
Energy: 0.49150299032814815
Energy: 0.47137406800063425

minimum gb energy = 0.46400703201207993 eV
minimum distance =  2.27107058525947 Angstroms
sigma value = 219


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

Energy: 0.9289173898871043
Energy: 0.6273853348023073
Energy: 0.6216119531049922
Energy: 0.6219536501652413
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Energy: 0.6185542835262663
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Energy: 0.6200763132601698
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Energy: 0.6210793935983149
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Energy: 0.6339384302399238
Energy: 0.6249177228199477
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Energy: 0.6178385284103722
Energy: 0.6190351735424469
Energy: 0.6242847743560234
Energy: 0.6349073713217018
Energy: 0.6214457956044038
Energy: 0.6242272994129541
Energy: 0.619574679113808
Energy: 0.61682214532707
Energy: 0.6240252649455912
Energy: 0.6191054580853661
Energy: 0.6250482103721918
Energy: 0.6198825822925598
Energy: 0.6376254676573085
Energy: 0.6214411591362041
Energy: 0.6201046201050924
Energy: 0.613944858674484
Energy: 0.6247602051724224
Energy: 0.6157399903256894
Energy: 0.6160138839129995
Energy: 0.6203935410846533
Energy: 0.614635527731665
Energy: 0.6246853900971554
Energy: 0.615330212737769
Energy: 0.6163944779409516
Energy: 0.6196777846316976

minimum gb energy = 0.6028114292536134 eV
minimum distance =  2.25599170574884 Angstroms
sigma value = 15


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

Energy: 1.086284018130119
Energy: 0.7057672443656297
Energy: 0.7134739353923314
Energy: 0.7174574443337524
Energy: 0.7412465338468196
Energy: 0.6937688559140692
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Energy: 0.7037471093033544
Energy: 0.7093541235406191
Energy: 0.7124255182924514
Energy: 0.7285133706163706
Energy: 0.705639258098439
Energy: 0.7115157450014138
Energy: 0.700326762270509
Energy: 0.7122238903120658
Energy: 0.7279216596090577
Energy: 0.7045000583935878
Energy: 0.7121127369472872
Energy: 0.7012446843301199
Energy: 0.715455369860833
Energy: 0.7087200427153745
Energy: 0.7264981419997728
Energy: 0.6962915597758346
Energy: 0.7268165753857918
Energy: 0.6938672024806893
Energy: 0.7117546031827569
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minimum gb energy = 0.6869482806625756 eV
minimum distance =  2.23453623013156 Angstroms
sigma value = 293


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

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Energy: 0.6944027452108644
Energy: 0.7082066840609713
Energy: 0.7427486079303828
Energy: 0.6932202062573368
Energy: 0.7210344344446852
Energy: 0.6942493164138137
Energy: 0.7101116783788058
Energy: 0.743264914446283
Energy: 0.6938383893158103
Energy: 0.7023020658519673
Energy: 0.703050036560277
Energy: 0.7225953143063529
Energy: 0.693590445495601
Energy: 0.6998609846707725
Energy: 0.7203012613547511
Energy: 0.7014556892575516
Energy: 0.7233148029835452
Energy: 0.692382422095471
Energy: 0.7415005635993744
Energy: 0.7197040816100999
Energy: 0.6775591529458129
Energy: 0.7067014430260264
Energy: 0.6918518367067426
Energy: 0.6924787361296678
Energy: 0.7065137508171497
Energy: 0.6774960854146078
Energy: 0.7071204513036705
Energy: 0.6916139231681543
Energy: 0.6936592930926373
Energy: 0.7061144619884367
Energy: 0.6964302662638716
Energy: 0.6911264935664228
Energy: 0.6921196374814779
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Energy: 0.693410155639075
Energy: 0.6995404380182347
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Energy: 0.6978889598667817
Energy: 0.6953567243642383
Energy: 0.7039538929728004
Energy: 0.6914271362512496
Energy: 0.6921404352645417
Energy: 0.7292188873980109
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Energy: 0.7054047407292975
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Energy: 0.6971789235638214
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Energy: 0.6776740523831812
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Energy: 0.7113772188510048
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Energy: 0.7327174067793424
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Energy: 0.711205501775386
Energy: 0.7200381048341543
Energy: 0.7158576379291137
Energy: 0.6790663240992151
Energy: 0.7079253283399959
Energy: 0.6936747086749573
Energy: 0.6937854895027348
Energy: 0.7187564601257357
Energy: 0.678649821429675
Energy: 0.7104891844149167
Energy: 0.6919441710152652
Energy: 0.6967513933036786
Energy: 0.6911147326339849
Energy: 0.6934895737786947
Energy: 0.6936163774330338
Energy: 0.6958338336017965
Energy: 0.6914844571798429
Energy: 0.6914199403868592
Energy: 0.6915128003550081
Energy: 0.6935271485828709
Energy: 0.6946964513805941
Energy: 0.6913990897524164
Energy: 0.6913100146533792
Energy: 0.6892047901099092
Energy: 0.7055632374678811
Energy: 0.6918873957469933
Energy: 0.7093283333320642
Energy: 0.6906902479185438
Energy: 0.6892758594228969
Energy: 0.7064672911913469
Energy: 0.6916475608652366
Energy: 0.7095975415225596
Energy: 0.7198911643689325
Energy: 0.706867285267212
Energy: 0.7214654370634889
Energy: 0.7146389747889168
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Energy: 0.6939099739895209
Energy: 0.7193966580098226
Energy: 0.7222620790754714
Energy: 0.7128390069267974
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Energy: 0.7080798777065584
Energy: 0.7067116845723052
Energy: 0.7201947809046139
Energy: 0.7117302707337438
Energy: 0.7240022139206476
Energy: 0.7096145091320248
Energy: 0.7218311663899333
Energy: 0.7208200913713144
Energy: 0.710193800955715
Energy: 0.6981782217187592
Energy: 0.6985827096481649
Energy: 0.7002335221580891
Energy: 0.7332402228161754
Energy: 0.7034715275393775
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Energy: 0.7514263043446942
Energy: 0.7005923548418692
Energy: 0.6993477911423104
Energy: 0.7113668096196946
Energy: 0.6937166435771926
Energy: 0.6917490179385845
Energy: 0.7019122815517956
Energy: 0.6762490910602315
Energy: 0.6788168018744498
Energy: 0.6971683964901391
Energy: 0.6921521261768933
Energy: 0.7039213791105827
Energy: 0.6793386079524256
Energy: 0.6786719861409192
Energy: 0.6970143763061009
Energy: 0.6965461517686281
Energy: 0.6993104443413863
Energy: 0.6976972088890178
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Energy: 0.6940066312925095
Energy: 0.6968534247199277
Energy: 0.7004767578224558
Energy: 0.7193554575140971
Energy: 0.6925790929878587
Energy: 0.6955290837632281
Energy: 0.7197310398126546
Energy: 0.6951653775067359
Energy: 0.6903765762679199
Energy: 0.7124816051648032
Energy: 0.6931121039913474
Energy: 0.7204807485720991
Energy: 0.6949222510560509
Energy: 0.691976171502246
Energy: 0.7121454757047649
Energy: 0.6957790567502624
Energy: 0.678972529835057
Energy: 0.695682346256969
Energy: 0.7073192842631406
Energy: 0.6956004160187004
Energy: 0.6794957908732312
Energy: 0.7046478633349187
Energy: 0.6925890893302958
Energy: 0.7227288218849148
Energy: 0.7292513895634898
Energy: 0.6801376370972041
Energy: 0.7258397162290353
Energy: 0.6908546561762517
Energy: 0.6920896530096111
Energy: 0.7106351453028764
Energy: 0.7275699088914773
Energy: 0.729421144833196
Energy: 0.6910682932347129
Energy: 0.6913512919603735
Energy: 0.711020873921526
Energy: 0.6788335778379094
Energy: 0.6939900631976482
Energy: 0.6947259426087242
Energy: 0.6924415294828689
Energy: 0.7197924574863712
Energy: 0.6943595142217084
Energy: 0.7008264151156701
Energy: 0.6960095826094843
Energy: 0.6919892025680239
Energy: 0.7041561449669137
Energy: 0.7099076890661807
Energy: 0.6937496771852278
Energy: 0.710238665983295
Energy: 0.7061172189028477
Energy: 0.689208956705557
Energy: 0.690325936798989
Energy: 0.6958960953353768
Energy: 0.7113866067312499
Energy: 0.7056440384881872
Energy: 0.689056618084572
Energy: 0.6916809031278858
Energy: 0.6955222988102572
Energy: 0.7128028983761785
Energy: 0.7317192568588314
Energy: 0.6931278797429526
Energy: 0.719741682976524
Energy: 0.7098118553048065
Energy: 0.7145773607041019
Energy: 0.7314397624112574
Energy: 0.7185844324583573
Energy: 0.7204488606596262
Energy: 0.6959124738976163
Energy: 0.7093234085536464
Energy: 0.747461809350724
Energy: 0.6942307485154666
Energy: 0.7194495075440155
Energy: 0.6948523595716416
Energy: 0.7093221285897298
Energy: 0.7457905987849694
Energy: 0.6939370266897786
Energy: 0.7194990356119279
Energy: 0.6762943218043602
Energy: 0.7077954169764554
Energy: 0.693959405287133
Energy: 0.6973712151717296
Energy: 0.72127496128312
Energy: 0.709427673264149
Energy: 0.706108556718524
Energy: 0.6932427222860752
Energy: 0.6975928336555489
Energy: 0.7116447146404747

minimum gb energy = 0.6756456287367727 eV
minimum distance =  2.21215130777179 Angstroms
sigma value = 293


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

Energy: 0.6725101139758274
Energy: 0.677069369548708
Energy: 0.7274668610176612
Energy: 0.6847554445810645
Energy: 0.6752522142801067
Energy: 0.6722145724547423
Energy: 0.6862474491992384
Energy: 0.7273081797674298
Energy: 0.6858247100558845
Energy: 0.674351917616294
Energy: 0.6801253453144738
Energy: 0.6802430301778368
Energy: 0.6800409620626859
Energy: 0.6806167334499627
Energy: 0.6808919862917847
Energy: 0.7185799821946551
Energy: 0.6806400260290655
Energy: 0.6745959411607236
Energy: 0.6819592474440268
Energy: 0.6810104919357051
Energy: 0.6848657739422699
Energy: 0.6811230239446224
Energy: 0.6819020953888114
Energy: 0.6861210666948199
Energy: 0.7210292561151217
Energy: 0.6832270764989542
Energy: 0.6804925158773447
Energy: 0.680669483007498
Energy: 0.7291735869286533
Energy: 0.7211118990008026
Energy: 0.7320020366226287
Energy: 0.6723592366640314
Energy: 0.672866179877273
Energy: 0.6826762141219669
Energy: 0.7272097868236722
Energy: 0.7312720722780727
Energy: 0.6725328657708496
Energy: 0.6738165188463223
Energy: 0.6836410094399947
Energy: 0.6721637497931399
Energy: 0.6825616278059968
Energy: 0.6785584434632612
Energy: 0.672265053049095
Energy: 0.6811551204811062
Energy: 0.6821051728899036
Energy: 0.681011671264155
Energy: 0.6766515153016383
Energy: 0.6721337590949776
Energy: 0.6799467717261336
Energy: 0.680709896930179
Energy: 0.6804067826027327
Energy: 0.7291497199996277
Energy: 0.6869432703095377
Energy: 0.6821806626642655
Energy: 0.6756762932068994
Energy: 0.6812227875104547
Energy: 0.7275153028496013
Energy: 0.6861400952357255
Energy: 0.6838028250490839
Energy: 0.6782826258495905
Energy: 0.7306538796710713
Energy: 0.6718601798648473
Energy: 0.6806571121763338
Energy: 0.6808101333610727
Energy: 0.6800937058700548
Energy: 0.7307874933259368
Energy: 0.6709852228847923
Energy: 0.6801764049609392
Energy: 0.6803467132415287
Energy: 0.6799936887727213
Energy: 0.6824989721566442
Energy: 0.7180606541469476
Energy: 0.6863101677709796
Energy: 0.6726322051997129
Energy: 0.6814356627994523
Energy: 0.6856888018852175
Energy: 0.7186442390341016
Energy: 0.685200157239612
Energy: 0.6732984648790658
Energy: 0.68612052782024
Energy: 0.6799878636585502
Energy: 0.673854094388849
Energy: 0.6808239859756611
Energy: 0.6724474794773563
Energy: 0.7199065518493261
Energy: 0.6798444142491795
Energy: 0.6802342788376863
Energy: 0.680388242298213
Energy: 0.6721435390722473
Energy: 0.7248535419618786
Energy: 0.6841242680684096
Energy: 0.6832461524097485
Energy: 0.7191788285455798
Energy: 0.7323189509440264
Energy: 0.6846322170776601
Energy: 0.6857988737185745
Energy: 0.6850267264403159
Energy: 0.7195686565241987
Energy: 0.6874991765018257
Energy: 0.6817613381331247
Energy: 0.6726091372818017
Energy: 0.683057447651943
Energy: 0.6814743803560339
Energy: 0.6821942797127345
Energy: 0.723014304674427
Energy: 0.6725138411591824
Energy: 0.6813847253831836
Energy: 0.6711506059473727
Energy: 0.6854932884486874
Energy: 0.7221652048040478
Energy: 0.6726288168398163
Energy: 0.685400863734461
Energy: 0.7270446091725975
Energy: 0.6849169635426351
Energy: 0.6756229011522439
Energy: 0.6726372626506205
Energy: 0.6860596988565328
Energy: 0.7299653945960648
Energy: 0.6859738297585776
Energy: 0.674674916927466
Energy: 0.720562965928244
Energy: 0.6802241406859414
Energy: 0.6799163585327143
Energy: 0.6802085948084593
Energy: 0.6805613012193606
Energy: 0.7188924214934178
Energy: 0.6806721059579032
Energy: 0.6746145512144754
Energy: 0.6815169941698302
Energy: 0.6812390378844906
Energy: 0.6845919381900297
Energy: 0.6814156557597139
Energy: 0.6822853772337801
Energy: 0.7312258970341734
Energy: 0.7214532943593301
Energy: 0.6832891448384498
Energy: 0.6807394897692052
Energy: 0.6807853083785202
Energy: 0.7279280760350192
Energy: 0.7208934415076492
Energy: 0.7319208376306332
Energy: 0.6723969524115999
Energy: 0.6727315911822735
Energy: 0.6825817353788075
Energy: 0.7233682857445076
Energy: 0.7309911847177318
Energy: 0.6724979838758527
Energy: 0.6737597586601866
Energy: 0.683359006697156
Energy: 0.7214676466940048
Energy: 0.6829314921595656
Energy: 0.6761406689386994
Energy: 0.6723640277444506
Energy: 0.6806872639924887
Energy: 0.6819862993225672
Energy: 0.682727882315517
Energy: 0.6769877703301829
Energy: 0.6721392964454171
Energy: 0.6800170982442583
Energy: 0.6806752413581691
Energy: 0.6802330091805036
Energy: 0.7291491955568294
Energy: 0.6869115462367886
Energy: 0.6819533552015783
Energy: 0.6753664998097335
Energy: 0.6810511804839917
Energy: 0.7279689402593037
Energy: 0.6862095155938539
Energy: 0.683113616559796
Energy: 0.6774712771336112
Energy: 0.7306933838751735
Energy: 0.6719257786592326
Energy: 0.6806468425261221
Energy: 0.6809716661467512
Energy: 0.6804229899317564
Energy: 0.7303637180894605
Energy: 0.670974729098769
Energy: 0.6802851257034341
Energy: 0.6804097703948345
Energy: 0.6802705417935546
Energy: 0.6823566832021037
Energy: 0.7178720468409406
Energy: 0.6868966391063821
Energy: 0.6725456269836155
Energy: 0.6769550898750095
Energy: 0.6853717349340208
Energy: 0.7184921417994214
Energy: 0.6853757521152857
Energy: 0.6729742037006544
Energy: 0.6757703634669651
Energy: 0.6801331304922436
Energy: 0.6741797930703306
Energy: 0.6813587359005139
Energy: 0.6724948895811954
Energy: 0.7209822117152156
Energy: 0.679702541799773
Energy: 0.6803364637893853
Energy: 0.6806364997443284
Energy: 0.6721196759951094
Energy: 0.6809636517433352
Energy: 0.6837568158668601
Energy: 0.682945604519036
Energy: 0.7184916547352099
Energy: 0.7323955868771015
Energy: 0.6845575823575446
Energy: 0.6857181417406105
Energy: 0.6847213075601885
Energy: 0.7200538074594429
Energy: 0.6869148416719577
Energy: 0.6822024718270493
Energy: 0.6723623058903248
Energy: 0.6823646597128195
Energy: 0.681893292293155
Energy: 0.6915066614680876
Energy: 0.7227482294826721
Energy: 0.6723776017811947
Energy: 0.6811611893043835
Energy: 0.6711077775459805
Energy: 0.6863327593518825
Energy: 0.7217863269280943

minimum gb energy = 0.670974729098769 eV
minimum distance =  2.23102863768118 Angstroms
sigma value = 15


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

Energy: 0.7648841616442573
Energy: 0.7294373176783184
Energy: 0.7448685397709184
Energy: 0.7140574635507679
Energy: 0.7350921500174543
Energy: 0.7344332919243228
Energy: 0.7682515820076578
Energy: 0.7447252126931625
Energy: 0.712075907408942
Energy: 0.7066131910796867
Energy: 0.6475040878728494
Energy: 0.7367375329341733
Energy: 0.6696806777045704
Energy: 0.6709908359899416
Energy: 0.6682853944400755
Energy: 0.6593951722963173
Energy: 0.737653180259652
Energy: 0.6686586890126507
Energy: 0.7531609039005547
Energy: 0.732062116051323
Energy: 0.7399693995424439
Energy: 0.6744187736255595
Energy: 0.6605427752172206
Energy: 0.692442921696753
Energy: 0.6653292768888857
Energy: 0.7386960252741502
Energy: 0.674610624647706
Energy: 0.6597994494764304
Energy: 0.6916505310293506
Energy: 0.7535205176028252
Energy: 0.6643015578544927
Energy: 0.6595056986084322
Energy: 0.7053414804390492
Energy: 0.7424842179805335
Energy: 0.752474437792305
Energy: 0.6939419150523096
Energy: 0.6615189287486546
Energy: 0.6975749560713347
Energy: 0.741908655097423
Energy: 0.7536677499981345
Energy: 0.7406325742445248
Energy: 0.7150425108203607
Energy: 0.6582123604187962
Energy: 0.6601913266635778
Energy: 0.7474968794572067
Energy: 0.7414243152222983
Energy: 0.7145638891404897
Energy: 0.6931495515927445
Energy: 0.6601817931369189
Energy: 0.6475317003253245
Energy: 0.6499191753484543
Energy: 0.6598387929938593
Energy: 0.6597376371168117
Energy: 0.7426791269469526
Energy: 0.8346619761473537
Energy: 0.6612822524722287
Energy: 0.6597885359128592
Energy: 0.659777352899086
Energy: 0.7426640798623083
Energy: 0.8281776568175487
Energy: 0.661603946137825
Energy: 0.6604384850483507
Energy: 0.6603980499494874
Energy: 0.655382564395876
Energy: 0.7408487124752835
Energy: 0.6630460947623129
Energy: 0.659636147555925
Energy: 0.6601120524793288
Energy: 0.6866572493998773
Energy: 0.7376242139644442
Energy: 0.663172354945515
Energy: 0.6630758595713913
Energy: 0.6653558924158116
Energy: 0.6594705840004291
Energy: 0.751908915144428
Energy: 0.6613299908244632
Energy: 0.6613988923963166
Energy: 0.6646023898153302
Energy: 0.7565730938308451
Energy: 0.7068684478035613
Energy: 0.6700419432177215
Energy: 0.833301845305246
Energy: 0.688526668857843
Energy: 0.7724473076879265
Energy: 0.6612791991266795
Energy: 0.6691625179508666
Energy: 0.8312627586564171
Energy: 0.6882571483207823
Energy: 0.6593375449422035
Energy: 0.6605815771620693
Energy: 0.6887564549379994
Energy: 0.6692566205688786
Energy: 0.66266644902605
Energy: 0.6606532152547381
Energy: 0.6614696681854071
Energy: 0.6763940662172292
Energy: 0.6683380541047179
Energy: 0.6630782954673451
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Energy: 0.661239149696053
Energy: 0.7493939079965934
Energy: 0.7045901426270125
Energy: 0.6600390720318738
Energy: 0.6596819347930226
Energy: 0.6599929008488451
Energy: 0.7008212421545802
Energy: 0.6560172918588283
Energy: 0.6604136235232837
Energy: 0.6600438518711989
Energy: 0.6601705625399718
Energy: 0.7618931448803956
Energy: 0.7425262760238415
Energy: 0.6604430301833106
Energy: 0.6593991995892216
Energy: 0.7875412092434781
Energy: 0.7529687978874844
Energy: 0.7440130383879054
Energy: 0.6597095069887748
Energy: 0.6623242176537488
Energy: 0.7863157027047163
Energy: 0.7456784660536675
Energy: 0.7383800402711935
Energy: 0.6691717068266992
Energy: 0.7337096415555328
Energy: 0.7699602817195823
Energy: 0.7470583454320002
Energy: 0.655651902161899
Energy: 0.6681423866208737
Energy: 0.7341300805618748
Energy: 0.7026753365083189
Energy: 0.670868431863182
Energy: 0.7570804984140066
Energy: 0.7487294372955944
Energy: 0.6966106450999012
Energy: 0.7511159568373568
Energy: 0.67058186551422
Energy: 0.7410124347610128
Energy: 0.6492372961832584
Energy: 0.7405141802430423
Energy: 0.7513432656217868
Energy: 0.6613430222940404
Energy: 0.715181582582034
Energy: 0.7508554993639128
Energy: 0.7010917336249506
Energy: 0.7369355812506104
Energy: 0.7119267014374661
Energy: 0.6618104659428385
Energy: 0.750791023741488
Energy: 0.7000885724767988
Energy: 0.7381301374620785
Energy: 0.7493787308488141
Energy: 0.752062155298637
Energy: 0.6608951597341913
Energy: 0.6943580491567873
Energy: 0.6957393808439981
Energy: 0.7466457868963268
Energy: 0.7518200155968854
Energy: 0.6606007051331588
Energy: 0.693681999715199
Energy: 0.6847145123765429
Energy: 0.6611302652636937
Energy: 0.6622713037153085
Energy: 0.6600856699677287
Energy: 0.744186937280275
Energy: 0.7519926147892422
Energy: 0.6647850306779399
Energy: 0.6629117406221774
Energy: 0.6919372380748826
Energy: 0.7450860180127128
Energy: 0.7532907241483773
Energy: 0.7425118676334976
Energy: 0.8292095773154167
Energy: 0.8338668527123101
Energy: 0.7017848046840026
Energy: 0.6602181031153759
Energy: 0.7823334977417207
Energy: 0.8293638333731993
Energy: 0.832874282858602
Energy: 0.7006779953660851
Energy: 0.6597136758460431
Energy: 0.6618669206288311
Energy: 0.6885030720638161
Energy: 0.6635298827132188
Energy: 0.6619255077916152
Energy: 0.6628123543898097
Energy: 0.6626656031842367
Energy: 0.6599855300015218
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Energy: 0.6629839350469502
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Energy: 0.6603122290511095
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Energy: 0.7516378133096102
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Energy: 0.6612207629121434
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Energy: 0.6751046957991095
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Energy: 0.7534569278703349
Energy: 0.7424279026439004
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Energy: 0.7416571545703284
Energy: 0.8359800122977099
Energy: 0.783352245911429
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Energy: 0.659802789268834
Energy: 0.7555700707231552
Energy: 0.8553514328283824
Energy: 0.6607145769379075
Energy: 0.6626116347872562
Energy: 0.6599742606814996
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Energy: 0.659870054408555
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Energy: 0.6705605642258787
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Energy: 0.6494757376543712
Energy: 0.6634296415059038
Energy: 0.659053982081306
Energy: 0.6612791404216921
Energy: 0.6749069868641984
Energy: 0.6490420058093728
Energy: 0.6641911171955304
Energy: 0.662483218585356
Energy: 0.6616794315244566
Energy: 0.7539397809054424
Energy: 0.6535752070787818
Energy: 0.6604501235748044
Energy: 0.6616782702783546
Energy: 0.6604557309675507
Energy: 0.7002721180998168
Energy: 0.6547906044716285
Energy: 0.6606721643299678
Energy: 0.662379838722783
Energy: 0.6613181946602179
Energy: 0.7617944916343015
Energy: 0.7415382718662213
Energy: 0.6599086794261991
Energy: 0.659341280027102
Energy: 0.7510524878461695
Energy: 0.7515761316139413
Energy: 0.7424745020690343
Energy: 0.6599674802972533
Energy: 0.6593863220287273
Energy: 0.7522747692103416
Energy: 0.7473338526845901
Energy: 0.6593157312834108
Energy: 0.6709224285821835
Energy: 0.6705429073825458
Energy: 0.7420124152615551
Energy: 0.7492595565065102
Energy: 0.6592805480938377
Energy: 0.6700937102893612
Energy: 0.6722712156072058
Energy: 0.7412728087668775
Energy: 0.6745486899084926
Energy: 0.7416927734216765
Energy: 0.7222340659110346
Energy: 0.6717880439169025
Energy: 0.6645684960306516
Energy: 0.674237736368243
Energy: 0.7421303884628068
Energy: 0.6678707131745589
Energy: 0.6717071701946681
Energy: 0.661828811668764
Energy: 0.660890248613307
Energy: 0.6912756516913138
Energy: 0.7516273882799896
Energy: 0.6998300261014565
Energy: 0.7390613597129645
Energy: 0.7117882260498817
Energy: 0.6932588843489611
Energy: 0.7515412946621335
Energy: 0.6737640572684164
Energy: 0.74147687401463
Energy: 0.7425272739703153
Energy: 0.7516518889194361
Energy: 0.7604655905784093
Energy: 0.738443909290581
Energy: 0.6845034885233793
Energy: 0.747789416945733
Energy: 0.7508679432534919
Energy: 0.6603150487442643
Energy: 0.7360969897591676
Energy: 0.6587711466567562
Energy: 0.6635546623836852
Energy: 0.7380370051803568
Energy: 0.6968686414509265
Energy: 0.7676157483635795
Energy: 0.75161262281804
Energy: 0.6645321295905124
Energy: 0.7710779444711977
Energy: 0.6967513914791492
Energy: 0.7679845484431865
Energy: 0.7540997217565013
Energy: 0.7829115346268967
Energy: 0.8316048648402078
Energy: 0.8307790349064875
Energy: 0.6978784854132744
Energy: 0.6600442805083431
Energy: 0.779284345820648
Energy: 0.8310737071442186
Energy: 0.8310757960284373
Energy: 0.7310411392751615
Energy: 0.659782133151254
Energy: 0.6612297796399165
Energy: 0.6638695580008738
Energy: 0.6645624147280308
Energy: 0.6607927958623551
Energy: 0.6633198732239657
Energy: 0.6623926472333528
Energy: 0.6912944684951053
Energy: 0.6649288194413614
Energy: 0.6613805981265628
Energy: 0.6641555651279916
Energy: 0.6639632984503672
Energy: 0.7494187384307324
Energy: 0.7111011504687981
Energy: 0.6594699699694055
Energy: 0.6600014094447322
Energy: 0.7041025131172555
Energy: 0.7494465537160133
Energy: 0.7229593957344785
Energy: 0.6591324536812276
Energy: 0.6601266358547868
Energy: 0.7181421099538345
Energy: 0.6602142513019398
Energy: 0.6635280590111248
Energy: 0.6684614939377528
Energy: 0.7182596518345828
Energy: 0.7171644666254642
Energy: 0.6594099561069744
Energy: 0.663093628262016
Energy: 0.6694837200396415
Energy: 0.7195197116510408
Energy: 0.6595346239816687
Energy: 0.6595101545346455
Energy: 0.7094957631609019
Energy: 0.8304364210347404
Energy: 0.6695497656344548
Energy: 0.6594939580824438
Energy: 0.6599726286993605
Energy: 0.6880773987352753
Energy: 0.8324136211581791
Energy: 0.6705882122320325
Energy: 0.6632790467772651
Energy: 0.6598831697740574
Energy: 0.6642605960867818
Energy: 0.6598315729638983
Energy: 0.6625674434814389
Energy: 0.6647849972267087
Energy: 0.6610073978411563
Energy: 0.6639583925940601
Energy: 0.6616404020085948
Energy: 0.6612423750815054
Energy: 0.6598120853900052
Energy: 0.6610605876018575
Energy: 0.7511465918973437
Energy: 0.7504506798359983
Energy: 0.7437633351468013
Energy: 0.6607043949201402
Energy: 0.6974564396312738
Energy: 0.7514474421510139
Energy: 0.7518312244785526
Energy: 0.7419521673323122
Energy: 0.6740318616069001
Energy: 0.7673231768886926
Energy: 0.6603280811948384
Energy: 0.6629565244551658
Energy: 0.6495186153770046
Energy: 0.6694116748069792
Energy: 0.7439954267557355
Energy: 0.7007041853365256
Energy: 0.6622871368759664
Energy: 0.6492010503452603

minimum gb energy = 0.6475040878728494 eV
minimum distance =  2.21912800220335 Angstroms
sigma value = 437


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

Energy: 0.933327680024057
Energy: 0.6234615157724221
Energy: 0.7134652003116306
Energy: 0.6866741614985074
Energy: 0.6220821241441284
Energy: 0.6693747868072176
Energy: 0.6476948375093229
Energy: 0.7145256133599499
Energy: 0.6760041237503308
Energy: 0.7480484190902011
Energy: 0.6097606009781622
Energy: 0.7042271934462104
Energy: 0.6107390386502934
Energy: 0.7408774965595334
Energy: 0.6360261281042644
Energy: 0.6113548550017156
Energy: 0.7082089196869846
Energy: 0.6105916685193398
Energy: 0.7012833446522172
Energy: 0.6357990880433723
Energy: 0.6806244029001932
Energy: 0.6857558827129266
Energy: 0.6390874536036141
Energy: 0.6389905599996903
Energy: 0.6169530069416982
Energy: 0.6808634646896845
Energy: 0.6869031159214554
Energy: 0.6371890984100127
Energy: 0.637523122087359
Energy: 0.680243778957139
Energy: 0.6353472268955034
Energy: 0.638451895798932
Energy: 0.6383394218127751
Energy: 0.68084921494472
Energy: 0.612770930094
Energy: 0.6363851693683817
Energy: 0.6367408183053246
Energy: 0.7007279361616415
Energy: 0.6796839615478514
Energy: 0.6150857555914523
Energy: 0.6210979996093312
Energy: 0.6512377269489196
Energy: 0.6290198148004803
Energy: 0.6376676126591535
Energy: 0.63606701061374
Energy: 0.6214083400294462
Energy: 0.650679848557289
Energy: 0.6324870365642679
Energy: 0.6287873715088683
Energy: 0.609472451332585
Energy: 0.6541535703265182
Energy: 0.6403793763977744
Energy: 0.611201543264732
Energy: 0.6228295766464286
Energy: 0.6594853873318626
Energy: 0.6549264882395424
Energy: 0.6398122140186165
Energy: 0.6102332301352246
Energy: 0.6824055393493663
Energy: 0.6595766303135561
Energy: 0.6826084681938495
Energy: 0.6783635065772669
Energy: 0.6775393213849398
Energy: 0.6378439305146419
Energy: 0.6363560248100582
Energy: 0.6813809385878145
Energy: 0.677718645514714
Energy: 0.6770722537836528
Energy: 0.6365604239106917
Energy: 0.6364623230959108
Energy: 0.6870929688135665
Energy: 0.6766359815132856
Energy: 0.6350810905886858
Energy: 0.6278010432940655
Energy: 0.7038987280055152
Energy: 0.6864258861343883
Energy: 0.6103711171007438
Energy: 0.6359667517240222
Energy: 0.6289391909725297
Energy: 0.7021227774754606
Energy: 0.6350760209162112
Energy: 0.6356005090519251
Energy: 0.6446986833848681
Energy: 0.6370577048373889
Energy: 0.636147818696665
Energy: 0.6341756865620326
Energy: 0.7086290798755263
Energy: 0.6439398548949687
Energy: 0.6384901977040062
Energy: 0.6356374803933819
Energy: 0.6494421167617633
Energy: 0.6325043211618311
Energy: 0.6136417934921832
Energy: 0.6136086433926701
Energy: 0.6525270774209356
Energy: 0.6202487657757222
Energy: 0.6323253324883576
Energy: 0.6125418965382164
Energy: 0.7565142190772736
Energy: 0.6511314683064271
Energy: 0.6131593968113762
Energy: 0.6114441180364178
Energy: 0.6451304741203734
Energy: 0.6589064663524631
Energy: 0.6106511310145806
Energy: 0.6128052683338746
Energy: 0.6106575710928507
Energy: 0.6455665788934354
Energy: 0.6594065737566719
Energy: 0.6380885028419676
Energy: 0.614125780776723
Energy: 0.614488914147504
Energy: 0.6142235840929309
Energy: 0.6838618611676466
Energy: 0.6137655017183777
Energy: 0.6120710901782006
Energy: 0.6104027853627285
Energy: 0.6151364027708788
Energy: 0.6832861918791743
Energy: 0.6128277525817944
Energy: 0.6113846116863834
Energy: 0.6134096899289402
Energy: 0.7011440271787035
Energy: 0.7004811822585917
Energy: 0.6122868192615593
Energy: 0.6119091853991437
Energy: 0.612302165686966
Energy: 0.7022115429234663
Energy: 0.6999778760940869
Energy: 0.6127210479172497
Energy: 0.6367590859583113
Energy: 0.6501955696046879
Energy: 0.7333598702120622
Energy: 0.6150792808519652
Energy: 0.6165382111565268
Energy: 0.7482214643302254
Energy: 0.6497721360710452
Energy: 0.7732884008806307
Energy: 0.6139030095135233
Energy: 0.6528043798715418

minimum gb energy = 0.609472451332585 eV
minimum distance =  2.25657724746545 Angstroms
sigma value = 33