Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Au__MO_684444719999_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080053400993348
cohesive_energy=3.9303141206022922
mass=196.9665
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=[1.068807226011498e-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, 5.06388753471942e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.8571615914122e-19, 1.9324813688654397e-19, 7.75272444896358e-20, -6.808321432052279e-20, -2.52634416002388e-19, -4.88748788731602e-19, -7.94386412139978e-19, -1.1952926625592618e-18, -1.72852428335724e-18, -2.4493275292274997e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013462267621515483
Energy: 0.016345402861771427
Energy: 0.07063342058714277
Energy: 0.07020580658273629
Energy: 0.015769790471598613
Energy: 0.014517401240023486
Energy: 0.06937604092625552
Energy: 0.07095521624425856
Energy: 0.0698407792006322
Energy: 0.015314364727146042
Energy: 0.018210454039686866
Energy: 0.06907597508299297
Energy: 0.069739375050356
Energy: 0.07037316213320764
Energy: 0.07027892457432831
Energy: 0.06929659295107467
Energy: 0.07094818863850738
Energy: 0.06975921411647344
Energy: 0.07025805557794311
Energy: 0.07014127999024755
Energy: 0.0709552831883975
Energy: 0.016085842610715027
Energy: 0.013916353243405814
Energy: 0.06904234077370898
Energy: 0.07001491854043944
Energy: 0.07038937544591452
Energy: 0.015451390471518214
Energy: 0.013874305708303824
Energy: 0.06899568422415628
Energy: 0.07051027834969407
Energy: 0.07001109071374566
Energy: 0.014869358314109859
Energy: 0.014624090125443611
Energy: 0.0702427784566828
Energy: 0.0692840599338818
Energy: 0.07038870354430125
Energy: 0.014714893174300706
Energy: 0.014033437141644779
Energy: 0.0696809240888955
Energy: 0.06905849186194823
Energy: 0.06962630864554525
Energy: 0.06976432105262426
Energy: 0.07070033926664662
Energy: 0.014814433828627594
Energy: 0.01485204088017583
Energy: 0.06928122041796159
Energy: 0.07021302389493872
Energy: 0.07043826721744159
Energy: 0.0154841982486567
Energy: 0.06936221597788732
Energy: 0.07079804374708881
Energy: 0.06919821565705438
Energy: 0.06965196545801718
Energy: 0.014403950872802204
Energy: 0.016664759698040224
Energy: 0.07121494698396652
Energy: 0.06869818990926908
Energy: 0.06997119184733996
Energy: 0.014854607709305639
Energy: 0.01752920170571136
Energy: 0.017541841018011664
Energy: 0.07104446905534
Energy: 0.06977691326923137
Energy: 0.07052646210242353
Energy: 0.07104564361083293
Energy: 0.0171857645234383
Energy: 0.07124595102372576
Energy: 0.06959590824752523
Energy: 0.0701217260696427
Energy: 0.07072642090557875

minimum gb energy = 0.013462267621515483 eV
minimum distance =  2.84702948197742 Angstroms
sigma value = 3


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

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Energy: 0.5475447390492194
Energy: 0.5561704161632031
Energy: 0.5238653200148856
Energy: 0.527819601488783
Energy: 0.5489490105735846
Energy: 0.5247013051798263
Energy: 0.5566147131397464
Energy: 0.5394397511855508
Energy: 0.5516005113270269
Energy: 0.5361067712711886
Energy: 0.5579427703729442
Energy: 0.5250155093098053
Energy: 0.5716869521957971
Energy: 0.45928027803900395
Energy: 0.5478772485194663
Energy: 0.5239750527283985
Energy: 0.5571218083629921
Energy: 0.47395355609276185
Energy: 0.5489113313638261
Energy: 0.48729568062309925
Energy: 0.576992817990448
Energy: 0.49649504098843145
Energy: 0.45658435376019474
Energy: 0.4583248891084732
Energy: 0.4585739345281408
Energy: 0.632809313866815
Energy: 0.49639668516385504
Energy: 0.45795109410325485
Energy: 0.5009839091732665
Energy: 0.4607435610808208
Energy: 0.5800304296259151
Energy: 0.5477644567027974
Energy: 0.456204599606458
Energy: 0.4838048162100373
Energy: 0.45965929532923605
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Energy: 0.547284422648874
Energy: 0.5086396169229659
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Energy: 0.5484428549439083
Energy: 0.5108888687346154
Energy: 0.5831988579330686
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Energy: 0.5925573408166525
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Energy: 0.5696081084646919
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Energy: 0.5645405226802406
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Energy: 0.7782025185363036
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Energy: 0.5859722887764409
Energy: 0.5696719412775295
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Energy: 0.5826329261301545
Energy: 0.5857099453401158
Energy: 0.5883534226206637
Energy: 0.5703099029767262
Energy: 0.4803581482136444
Energy: 0.537187861246333
Energy: 0.5872453725030787
Energy: 0.6340193283689857
Energy: 0.5270761151089551
Energy: 0.48042799684320203
Energy: 0.5359445506616359
Energy: 0.5874653897488066
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Energy: 0.526432695789349
Energy: 0.5333844770975814
Energy: 0.6317711336643357
Energy: 0.49454407910740344
Energy: 0.5296464031865513
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Energy: 0.5543270870260121
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Energy: 0.6230853259621624
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Energy: 0.4736250918006231
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Energy: 0.565737301324569
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Energy: 0.5335765210104416
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Energy: 0.5106124883901338
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Energy: 0.4832287344743864
Energy: 0.48636838261901977
Energy: 0.5249877929247114
Energy: 0.44159139427584393
Energy: 0.4882751389767617
Energy: 0.5206284172504273
Energy: 0.4870271065240792
Energy: 0.47924722021328353
Energy: 0.4845632768121699
Energy: 0.49527506819547296
Energy: 0.5240420005908586
Energy: 0.5211122842467278
Energy: 0.47938035481472957
Energy: 0.5175982909506828
Energy: 0.5041225394280838
Energy: 0.5222628730915957
Energy: 0.47795258914123623
Energy: 0.48048681009032607
Energy: 0.5618750946068344
Energy: 0.5534968141413428
Energy: 0.5758044136361056
Energy: 0.43364190667028935
Energy: 0.5225982017584797
Energy: 0.6461740293680609
Energy: 0.5564996211365474
Energy: 0.5446942855032341
Energy: 0.5454853604545128
Energy: 0.5232204255448639
Energy: 0.5726451133538895
Energy: 0.570227385603747
Energy: 0.5221485918986344
Energy: 0.5658306111993446
Energy: 0.5234399142362075
Energy: 0.5742026047997498
Energy: 0.5711207694700124
Energy: 0.4944005173325184
Energy: 0.5473067903075087
Energy: 0.6027019116754149
Energy: 0.5405549262206341
Energy: 0.5166840058518517
Energy: 0.459054620446046
Energy: 0.4592860730435715
Energy: 0.5870895505988346
Energy: 0.5252673557975274
Energy: 0.5615423655259286
Energy: 0.5521280247262637
Energy: 0.5238009244356249
Energy: 0.5572204996407155
Energy: 0.5244947381839312
Energy: 0.5279124000569282
Energy: 0.5302814693144252
Energy: 0.5251433026848022
Energy: 0.5562125723285256
Energy: 0.5235191972132677
Energy: 0.5105103454892612

minimum gb energy = 0.4289400917202812 eV
minimum distance =  2.68858467571253 Angstroms
sigma value = 75


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

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Energy: 0.5490661789777717
Energy: 0.5726350334152606
Energy: 0.5845460158390333
Energy: 0.6218905605510839
Energy: 0.548209545358198
Energy: 0.5671392335008801
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minimum gb energy = 0.5022127166114235 eV
minimum distance =  2.57540596154961 Angstroms
sigma value = 105


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

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Energy: 0.5920313695550922
Energy: 0.5697595943983296
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Energy: 0.5563656304987021
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Energy: 0.57212061128905
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Energy: 0.5777214989772368
Energy: 0.606439310014597
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Energy: 0.6049074063161581
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Energy: 0.6023488165155495
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Energy: 0.6043175998683366
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Energy: 0.5891018237242089
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Energy: 0.6209229654893155
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Energy: 0.6230279366056408
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Energy: 0.6077768246175317
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Energy: 0.557294908633898
Energy: 0.5700324888248084
Energy: 0.5749034501202225
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Energy: 0.6117898451449794
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Energy: 0.6103319876774081
Energy: 0.6393193680803506
Energy: 0.603481672313611
Energy: 0.5753498953488061
Energy: 0.6025057460915468
Energy: 0.5737992702967475
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Energy: 0.5576331087262212
Energy: 0.5992207546398849
Energy: 0.5801433112922603
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Energy: 0.6220760433962597
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Energy: 0.5921094786986928
Energy: 0.5873802134291903
Energy: 0.5730624503585171
Energy: 0.6034271991834664
Energy: 0.5981224861559716
Energy: 0.5663314214991656
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Energy: 0.5666320480853532
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Energy: 0.5769423886579854
Energy: 0.6160333379862013
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Energy: 0.5626619243206182
Energy: 0.5808119203580957
Energy: 0.5785798057953205
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Energy: 0.5815655288327785
Energy: 0.5905962603532058
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Energy: 0.5808080037092986
Energy: 0.5962460898266961
Energy: 0.5928141274394837
Energy: 0.606274833332854
Energy: 0.6351562578030973
Energy: 0.5507581307382179
Energy: 0.5712297167698883
Energy: 0.5936312069068549
Energy: 0.6095611916177177
Energy: 0.570196936658572
Energy: 0.6002754483288717
Energy: 0.5893215939118891
Energy: 0.5725027327434544
Energy: 0.6213616730914233
Energy: 0.5510550030560808
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Energy: 0.589334717564827
Energy: 0.5811419767664746
Energy: 0.6180600146295793
Energy: 0.5849851319845449
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Energy: 0.5436331647241498
Energy: 0.6077432790574868
Energy: 0.5561708221556686
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Energy: 0.6001857392084272
Energy: 0.5437939664499741
Energy: 0.5866134115806099
Energy: 0.6136523703567797
Energy: 0.6039264064587149
Energy: 0.5928223282322385
Energy: 0.5728207985186577
Energy: 0.606054112537658
Energy: 0.5970634001452542
Energy: 0.5912568991773196
Energy: 0.5925805927993988
Energy: 0.5719884854492324
Energy: 0.6065992153655395
Energy: 0.5751630706570017
Energy: 0.6032236061375195
Energy: 0.6063931340412189
Energy: 0.5922850163487904
Energy: 0.5895677268704181
Energy: 0.5884601929073812
Energy: 0.5994864168701636
Energy: 0.5516712552712637
Energy: 0.5911878082200113
Energy: 0.6160180759484373
Energy: 0.606939751803965
Energy: 0.6098677474102637
Energy: 0.6126494180716123
Energy: 0.5982414156578031
Energy: 0.5935225379211383
Energy: 0.5834395235826607
Energy: 0.6024196415303613
Energy: 0.6036435758407875
Energy: 0.5797027195533503
Energy: 0.5707629803483529
Energy: 0.6132554043788511
Energy: 0.5766603618425605
Energy: 0.6039936978633836
Energy: 0.5895768246206402
Energy: 0.5522271553914742
Energy: 0.5963991365131643
Energy: 0.5514500899251744
Energy: 0.599380298119573
Energy: 0.6041405046197108
Energy: 0.5673284811840964
Energy: 0.6306550614423782
Energy: 0.5740990425842908
Energy: 0.5818911542793886
Energy: 0.5885839995775175
Energy: 0.5509071322418458
Energy: 0.6273846858005725
Energy: 0.5801125151162951
Energy: 0.599080399868807
Energy: 0.5748279089380238
Energy: 0.5747977112362682
Energy: 0.6087280509951062
Energy: 0.5960914769474728
Energy: 0.5954739972511481
Energy: 0.5890876808426163
Energy: 0.622830022755175
Energy: 0.5777747982881953
Energy: 0.5970791157930992
Energy: 0.6088385438067508
Energy: 0.5905998577426385
Energy: 0.6108485074211801
Energy: 0.6013424264143787
Energy: 0.5812294841077809
Energy: 0.5622331325897436
Energy: 0.5511738204622865
Energy: 0.5977667692332267
Energy: 0.5513389889399588
Energy: 0.5971394653214243
Energy: 0.5554004797061984
Energy: 0.5505587499111758
Energy: 0.5819025671574855
Energy: 0.5698086533152106
Energy: 0.5426885428887457
Energy: 0.5435928914470874
Energy: 0.5441841629715797
Energy: 0.543380914173742
Energy: 0.5404831517345203
Energy: 0.5439148716529177
Energy: 0.5436449893867515
Energy: 0.5435570513102083
Energy: 0.6060038846468344

minimum gb energy = 0.5404831517345203 eV
minimum distance =  2.57872515264894 Angstroms
sigma value = 165


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

Energy: 0.7962752025588693
Energy: 0.5602375479625575
Energy: 0.5593622470087689
Energy: 0.5730861088007838
Energy: 0.5371505134389988
Energy: 0.7407823391432147
Energy: 0.5636358754696307
Energy: 0.5633188860154997
Energy: 0.5801440262547685
Energy: 0.5611296251100033
Energy: 0.5598897604398138
Energy: 0.5937811772525352
Energy: 0.5755645548930387
Energy: 0.5742359974378756
Energy: 0.5681135204550347
Energy: 0.5698580648051148
Energy: 0.5568790770721814
Energy: 0.5805954816218931
Energy: 0.5802564255491351
Energy: 0.6051802405364649
Energy: 0.563053902233219
Energy: 0.5870950333113195
Energy: 0.5676810305007239
Energy: 0.5717024947759577
Energy: 0.5753959358809421
Energy: 0.5542649311876547
Energy: 0.565890529337581
Energy: 0.5934790451007824
Energy: 0.5795510784327035
Energy: 0.6090551470922444
Energy: 0.5901357748170772
Energy: 0.5727225546593634
Energy: 0.5944915395729411
Energy: 0.5550226679390485
Energy: 0.5611042049949607
Energy: 0.5947186195727804
Energy: 0.581621324436004
Energy: 0.5652901120954109
Energy: 0.5621236970969063
Energy: 0.6096214394094088
Energy: 0.6028720472418135
Energy: 0.5810650390630301
Energy: 0.5869986347131981
Energy: 0.5857564243029564
Energy: 0.5514222688648746
Energy: 0.581273279456315
Energy: 0.5663597536310416
Energy: 0.5605017788535454
Energy: 0.5563195865334633
Energy: 0.5864103132005789
Energy: 0.5807189090909509
Energy: 0.5651857827281448
Energy: 0.6068061925067493
Energy: 0.562747824097726
Energy: 0.5521613430747573
Energy: 0.5799921143148828
Energy: 0.564754656325133
Energy: 0.5584018836082855
Energy: 0.5616943956804773
Energy: 0.5527359837540557
Energy: 0.5545100947140271
Energy: 0.6010311437372579
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Energy: 0.5570943718096023
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Energy: 0.5762090237769201
Energy: 0.6035124306571465
Energy: 0.589123557247883
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Energy: 0.5783978972660189
Energy: 0.6073766213987911
Energy: 0.6021763965108478
Energy: 0.6010033296258667
Energy: 0.5947843631673134
Energy: 0.5378065927614241
Energy: 0.5903448178043256
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Energy: 0.6034652977417535
Energy: 0.5372356429199062
Energy: 0.5381600179540225
Energy: 0.5570535119270217
Energy: 0.5884030428901482
Energy: 0.6053183507689032
Energy: 0.5906673331957891
Energy: 0.5380323802772923
Energy: 0.5501214775242061
Energy: 0.5870487737077299
Energy: 0.6007765481522613
Energy: 0.5675474097783478
Energy: 0.6058630090191929
Energy: 0.5580550379026212
Energy: 0.6092006315971971
Energy: 0.6037491723936939
Energy: 0.5978644076244032
Energy: 0.5706071514705539
Energy: 0.5585863938572692
Energy: 0.5677014335439645
Energy: 0.6025660128389954
Energy: 0.6049836338427896
Energy: 0.5972141407013447
Energy: 0.6024863324206993
Energy: 0.5704113320490053
Energy: 0.6009700562819724
Energy: 0.571847339457892
Energy: 0.6033173020497864
Energy: 0.5878262121561887
Energy: 0.5691224568054915
Energy: 0.6175384389991403
Energy: 0.5727892974907951
Energy: 0.6054048519361304
Energy: 0.6085607329519935
Energy: 0.5902381398530628
Energy: 0.5542825971944295
Energy: 0.5582591588342153
Energy: 0.6059057902746867
Energy: 0.5711953439099641
Energy: 0.5906125923832604
Energy: 0.5899347725598207
Energy: 0.5936008538863106
Energy: 0.5839675855587402
Energy: 0.5823011920951628
Energy: 0.5484771802281444
Energy: 0.5507661780283764
Energy: 0.5584247552545413
Energy: 0.5677515653464031
Energy: 0.5772552976734877
Energy: 0.5904319216000932
Energy: 0.5911866796500993
Energy: 0.5677071924814386
Energy: 0.579185857727974
Energy: 0.5826008107986519
Energy: 0.5733550173917785
Energy: 0.5638310774208736
Energy: 0.5489184561476447
Energy: 0.5708123052384095
Energy: 0.5818118020725128
Energy: 0.5647709719985935
Energy: 0.5628053718814182
Energy: 0.5554700106221181
Energy: 0.5593855653578756
Energy: 0.5743997027877593
Energy: 0.576320826419499
Energy: 0.5649227793953281
Energy: 0.5691199190804809
Energy: 0.5639790048198076
Energy: 0.5681989344508772
Energy: 0.5797373864541242
Energy: 0.5662294523729475
Energy: 0.5949340878891518

minimum gb energy = 0.5371505134389988 eV
minimum distance =  2.62052464527209 Angstroms
sigma value = 41


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

Energy: 0.5972741506389319
Energy: 0.48434823477369704
Energy: 0.48610936487828055
Energy: 0.4764363293249161
Energy: 0.4768526720238335
Energy: 0.4756302796994676
Energy: 0.48553651855431684
Energy: 0.4866159121972469
Energy: 0.48673593893404193
Energy: 0.5085315529650996
Energy: 0.524598057891804
Energy: 0.5041473931042947
Energy: 0.4823662465725011
Energy: 0.4869045767133139
Energy: 0.5064624641914995
Energy: 0.5190065008828555
Energy: 0.4817265910179752
Energy: 0.4888560262635425
Energy: 0.4960908994981026
Energy: 0.5087133852797638
Energy: 0.49017288931681036
Energy: 0.5049300990804128
Energy: 0.5091133231250246
Energy: 0.49625718891965837
Energy: 0.4961818125664171
Energy: 0.4945446529776043
Energy: 0.4906633332480471
Energy: 0.5096695675455015
Energy: 0.5017438097639848
Energy: 0.4799710316546244
Energy: 0.512965932471216
Energy: 0.48343594024369785
Energy: 0.5075406568980307
Energy: 0.5014965350304401
Energy: 0.5081175043977051
Energy: 0.5127432097197377
Energy: 0.47725741467628024
Energy: 0.49225275812846087
Energy: 0.5049671919815224
Energy: 0.5892685821735185
Energy: 0.5169473443733753
Energy: 0.5025110387653194
Energy: 0.5112487482522762
Energy: 0.5103206506636967
Energy: 0.5113589901070755
Energy: 0.5177829274119623
Energy: 0.5016295100823879
Energy: 0.5078363258350918
Energy: 0.5137550418329814
Energy: 0.5145207950986689
Energy: 0.51554106434483
Energy: 0.49206740940230415
Energy: 0.5102994429871475
Energy: 0.48376775121905097
Energy: 0.5157597870013464
Energy: 0.5195285227136918
Energy: 0.5016284035490888
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Energy: 0.48758654050913963
Energy: 0.5132046035393658
Energy: 0.5174296203378584
Energy: 0.5173343502112063
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Energy: 0.4876058967608676
Energy: 0.5110786649102708
Energy: 0.5191578770539695
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Energy: 0.5006604596935965
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Energy: 0.4959860338548347
Energy: 0.5042840311013799
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Energy: 0.493914379182933
Energy: 0.5093526205650991
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Energy: 0.5172250596794273
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Energy: 0.4998763795130909
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Energy: 0.4842001849830893
Energy: 0.49075239623631545
Energy: 0.5143802064184905
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Energy: 0.4916047070219892
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Energy: 0.49143972800956537
Energy: 0.5000644120353408
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Energy: 0.495772968803091
Energy: 0.500503665026946
Energy: 0.49147470004035904
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Energy: 0.5105997929693981
Energy: 0.500393830327909
Energy: 0.4988153502001124
Energy: 0.4957823062582578
Energy: 0.4990544085835707
Energy: 0.5087131834663766
Energy: 0.4964966436935634
Energy: 0.4970098807427029
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Energy: 0.501658551327634
Energy: 0.5048334849085023
Energy: 0.49619636545167284
Energy: 0.49552060251740326
Energy: 0.5507984369821166
Energy: 0.5023396988123745
Energy: 0.498594342621837
Energy: 0.4975519110779054
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Energy: 0.5134997637502362
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Energy: 0.5022496288714574
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Energy: 0.5003215301975857
Energy: 0.5047144046136277
Energy: 0.5070933095211027
Energy: 0.5151176833319544
Energy: 0.4954089247926268
Energy: 0.5000383087965926
Energy: 0.5045574874219587
Energy: 0.5060851328135846
Energy: 0.501627369290354
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Energy: 0.5133186715288147
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Energy: 0.5203280878726344
Energy: 0.4904911542434588
Energy: 0.5029143020414806
Energy: 0.5153449851264503
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Energy: 0.5205934346593272
Energy: 0.5233563011387069
Energy: 0.5288663064310757
Energy: 0.5166638816053024
Energy: 0.5069096450397301
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Energy: 0.5221918924646426
Energy: 0.5171494826034786
Energy: 0.5064655365190909
Energy: 0.5091897641525965
Energy: 0.5012770565230963
Energy: 0.5117604337753342
Energy: 0.5012481136659902
Energy: 0.486441082939236
Energy: 0.5191617704771032
Energy: 0.5152670999336881
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Energy: 0.516731451703863
Energy: 0.5010358561420495
Energy: 0.5013911306531167
Energy: 0.5121153795850177
Energy: 0.4870952732087681
Energy: 0.5033614174079097
Energy: 0.5018523145437196
Energy: 0.5010444763333923
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Energy: 0.5105701035555316
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Energy: 0.5131984037221318
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Energy: 0.5061655348359956
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Energy: 0.5136768715103635
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Energy: 0.502163155108651
Energy: 0.5224322981564307
Energy: 0.47722639789959237
Energy: 0.4771267912599424
Energy: 0.4932245180023665
Energy: 0.493945819724671
Energy: 0.527147489037344
Energy: 0.48524331289517436
Energy: 0.48991434276719253
Energy: 0.5065373055812805
Energy: 0.4811197765127674
Energy: 0.4870416343836494
Energy: 0.4851256422371203
Energy: 0.48156662331479105
Energy: 0.4907551384428199
Energy: 0.4924706494870796
Energy: 0.5106710774959701
Energy: 0.4841710510773927
Energy: 0.49399300237392013
Energy: 0.4916663619200153
Energy: 0.4826507928671026
Energy: 0.5299499326900663
Energy: 0.48368251633156845
Energy: 0.49203132052694726
Energy: 0.49000112933713447
Energy: 0.48646376199612507
Energy: 0.5069112816386032
Energy: 0.48937226300967146
Energy: 0.4931261668572594
Energy: 0.4960809223293895
Energy: 0.47973129222018235
Energy: 0.4772869758224681
Energy: 0.49303811068723646
Energy: 0.49441814961416797
Energy: 0.4902438178811956
Energy: 0.4907964544048238
Energy: 0.47661162980415955
Energy: 0.4830653539865339
Energy: 0.47953223705037645
Energy: 0.5014865573929641

minimum gb energy = 0.4756302796994676 eV
minimum distance =  2.65827082093937 Angstroms
sigma value = 185


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

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Energy: 0.3637992261756256
Energy: 0.43031003627451386
Energy: 0.36292626052978694
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Energy: 0.25515802823451017
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Energy: 0.4441899966522444
Energy: 0.33390870037150194
Energy: 0.42789978053725397
Energy: 0.3854549832848364
Energy: 0.2828533208157515
Energy: 0.34265403035798486
Energy: 0.38972691636567725
Energy: 0.366840005839376
Energy: 0.26267481842442825
Energy: 0.2764614350913023
Energy: 0.3153630728801559
Energy: 0.44383096072438577
Energy: 0.41921000374812833
Energy: 0.28042764182133023
Energy: 0.2826905743721127
Energy: 0.3872174353349218
Energy: 0.4465470795962459
Energy: 0.3783288023310283
Energy: 0.4266592170441913
Energy: 0.31603676788158014
Energy: 0.41388070562990525
Energy: 0.3693841102584347
Energy: 0.36950715503496706
Energy: 0.3705127396082254
Energy: 0.3781551331628632
Energy: 0.39406741343524576
Energy: 0.4491224267939422
Energy: 0.41607025448234525
Energy: 0.3675311042359121
Energy: 0.3183678723847505
Energy: 0.4044575293895223
Energy: 0.37278966876634967
Energy: 0.3756440846269904
Energy: 0.2586565410966782
Energy: 0.38914642292142415
Energy: 0.4041827370139649
Energy: 0.44252822028322386
Energy: 0.36495081775512633

minimum gb energy = 0.19696944907817915 eV
minimum distance =  2.65791218526221 Angstroms
sigma value = 33


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

Energy: 0.4494849189064301
Energy: 0.44269376643324787
Energy: 0.4574416674388444
Energy: 0.4591855716211613
Energy: 0.43368851074649106
Energy: 0.43221636438829103
Energy: 0.4414638196858417
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Energy: 0.44617283625607224
Energy: 0.46026620612934604
Energy: 0.45947321551311976
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Energy: 0.5001841372957417
Energy: 0.4402966773081043
Energy: 0.45029801921920076
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Energy: 0.4394681124652088
Energy: 0.44994962665124827
Energy: 0.461492857244648
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Energy: 0.44958338634142286
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Energy: 0.4323294809060028
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Energy: 0.4549433468384881
Energy: 0.4678451295421906
Energy: 0.4451087077287515

minimum gb energy = 0.43177288002644204 eV
minimum distance =  2.61695570942366 Angstroms
sigma value = 219


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

Energy: 0.8767537895104225
Energy: 0.5717098278543478
Energy: 0.5852714934784958
Energy: 0.5853661705820723
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Energy: 0.5769090883143898
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Energy: 0.5802779726438495
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Energy: 0.5847040845146493
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Energy: 0.5835895318531672
Energy: 0.5922181016267094
Energy: 0.5823980283684276
Energy: 0.5810752062241247
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Energy: 0.5819377603630853
Energy: 0.5851638658281446
Energy: 0.581874017277481
Energy: 0.583545808490476
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Energy: 0.5833278981152709
Energy: 0.5821888262481375
Energy: 0.5848710970443537
Energy: 0.5903163043733831
Energy: 0.5799205495259252
Energy: 0.5841115070959324
Energy: 0.5824759315484412
Energy: 0.5839968141110902
Energy: 0.5884524725353585
Energy: 0.580985011347697
Energy: 0.5718700826076829
Energy: 0.5836995529361783
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Energy: 0.5834632157567591
Energy: 0.5852565723776196
Energy: 0.5728715926653781
Energy: 0.5839731796594188
Energy: 0.5832519460349863
Energy: 0.5828520164258747
Energy: 0.5812709165998451

minimum gb energy = 0.5717098278543478 eV
minimum distance =  2.62415435549318 Angstroms
sigma value = 15


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

Energy: 1.0336811505452335
Energy: 0.6652536962394241
Energy: 0.6724061372500436
Energy: 0.6763793781335725
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Energy: 0.6831994163830594
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Energy: 0.6719482494320304
Energy: 0.6888227496570725
Energy: 0.6690495359628338
Energy: 0.6839761752087808
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Energy: 0.6723282312647703
Energy: 0.6684813424621767
Energy: 0.6797342611249901
Energy: 0.6768256123739599
Energy: 0.6851102737890052
Energy: 0.6600594086390694
Energy: 0.6624597035249374
Energy: 0.6795036716174416
Energy: 0.677103997766413
Energy: 0.6841874910456401
Energy: 0.6768291831664206
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minimum gb energy = 0.6536713208579059 eV
minimum distance =  2.58837619277442 Angstroms
sigma value = 293


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

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Energy: 0.6672533645984363
Energy: 0.6704124690261052
Energy: 0.6556222273484623
Energy: 0.7430623273929634
Energy: 0.6776165371860805
Energy: 0.6709830178648617
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Energy: 0.6691109525769514
Energy: 0.66751521279574
Energy: 0.6684454675825702
Energy: 0.6747121665343873
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Energy: 0.6519802561392698
Energy: 0.6562429488906584
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Energy: 0.6438748624553009
Energy: 0.6699200511607302
Energy: 0.6520093537610383
Energy: 0.6565341449943621
Energy: 0.66380130096257
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Energy: 0.6506730523339648
Energy: 0.6512707110694201
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Energy: 0.6556484898264024
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Energy: 0.6516047787416855
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Energy: 0.6564159001959118
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Energy: 0.659517882945016
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Energy: 0.6630736153894761
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Energy: 0.660035544055782
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Energy: 0.6634138795701552
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Energy: 0.6607360575646833
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Energy: 0.6688716246750984
Energy: 0.6684234598637371
Energy: 0.6683972656358431
Energy: 0.6891960941676476
Energy: 0.6895765319558865
Energy: 0.6991772204361333
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Energy: 0.6878856547750666
Energy: 0.6979851073198988
Energy: 0.65194502346551
Energy: 0.6530561422327807
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Energy: 0.6513849929881523
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Energy: 0.6516258434758914
Energy: 0.6473373130705423
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Energy: 0.6598144063839485
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Energy: 0.6734733388866005
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Energy: 0.6616908091650956
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Energy: 0.6516756677465845
Energy: 0.6717118551827057
Energy: 0.6550057708832017
Energy: 0.6765299977435759
Energy: 0.6613563300053934
Energy: 0.6538991058455642
Energy: 0.6684571446223702
Energy: 0.6570699128999098
Energy: 0.6450159314176991
Energy: 0.6677789455088217
Energy: 0.675694067866987
Energy: 0.6752797315929246
Energy: 0.6444494154925584
Energy: 0.6637526058094071
Energy: 0.6559139983857594
Energy: 0.6719049406089104
Energy: 0.6519643413052184
Energy: 0.6659681839968109
Energy: 0.68353278334989
Energy: 0.6516336526238661
Energy: 0.6520064341676719
Energy: 0.6724825422179649
Energy: 0.6870210137335134
Energy: 0.6826186589022329
Energy: 0.651501704642291
Energy: 0.6536729238409047
Energy: 0.6681889557303607
Energy: 0.6470284241804438
Energy: 0.6698128998305095
Energy: 0.6616286574697129
Energy: 0.6529861585283202
Energy: 0.6687006921669835
Energy: 0.6543427816160851
Energy: 0.6691083176606049
Energy: 0.6635483527397639
Energy: 0.6522081938762095
Energy: 0.661092786680592
Energy: 0.650728466034485
Energy: 0.6634112565355031
Energy: 0.6680048373284915
Energy: 0.6600775575938054
Energy: 0.6507719974682393
Energy: 0.6558786711496376
Energy: 0.6575847812051652
Energy: 0.6683983670930613
Energy: 0.6596343058829831
Energy: 0.6507775292134129
Energy: 0.6522191141830497
Energy: 0.6561374634658869
Energy: 0.6795362112765042
Energy: 0.6970151281627979
Energy: 0.6623347528327035
Energy: 0.6675202502601816
Energy: 0.6710713472463229
Energy: 0.6816731468236312
Energy: 0.6979836737141857
Energy: 0.6617627505370375
Energy: 0.6678213768479019
Energy: 0.6575359336476689
Energy: 0.6591097190571935
Energy: 0.705555747604796
Energy: 0.6575716349366248
Energy: 0.667947098118503
Energy: 0.6574938525277857
Energy: 0.655423899549926
Energy: 0.7048900315422929
Energy: 0.6593792195177529
Energy: 0.669734576783143
Energy: 0.6431830606006679
Energy: 0.6697192511759866
Energy: 0.6551279333682263
Energy: 0.6629642756397318
Energy: 0.6687957979555701
Energy: 0.6575173556221987
Energy: 0.6646004594549618
Energy: 0.6543910822813938
Energy: 0.663396097038729
Energy: 0.6672107975343381

minimum gb energy = 0.6414036270817219 eV
minimum distance =  2.57502794220313 Angstroms
sigma value = 293


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

Energy: 0.6317197705036812
Energy: 0.6384894449239201
Energy: 0.6884955861970978
Energy: 0.6478430555819397
Energy: 0.6375937260053375
Energy: 0.6319477360603315
Energy: 0.6493514176348073
Energy: 0.6885717035230299
Energy: 0.6487422479422956
Energy: 0.6374214967755868
Energy: 0.6351578881098241
Energy: 0.6435711356894219
Energy: 0.64300662344104
Energy: 0.6439840534671938
Energy: 0.6442457709466395
Energy: 0.6767102584523872
Energy: 0.6436928020452284
Energy: 0.6385392663239915
Energy: 0.6449251765893294
Energy: 0.6466604285279929
Energy: 0.6453357341138578
Energy: 0.6453024972869417
Energy: 0.6442492538078509
Energy: 0.6486030848807115
Energy: 0.6774606508507149
Energy: 0.6443016378460047
Energy: 0.6436041648384132
Energy: 0.6438446501184465
Energy: 0.6902543311852122
Energy: 0.6788909618154283
Energy: 0.6914387266662192
Energy: 0.6340165269208939
Energy: 0.6356907058367995
Energy: 0.6453434673267348
Energy: 0.6939127519481857
Energy: 0.6902823022853591
Energy: 0.6336397055237093
Energy: 0.6367704759106761
Energy: 0.6466846503911869
Energy: 0.6357552936226596
Energy: 0.645229937928395
Energy: 0.6409516012272901
Energy: 0.633477842167734
Energy: 0.6774908831596143
Energy: 0.6511583682261746
Energy: 0.6438001668561683
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Energy: 0.6338370608077232
Energy: 0.6474776346732422
Energy: 0.6437076283015696
Energy: 0.6438671685723976
Energy: 0.6911570528655212
Energy: 0.6499682716273498
Energy: 0.6446579804995309
Energy: 0.6415407503027927
Energy: 0.6447007319575969
Energy: 0.6885271311970623
Energy: 0.6488251845510629
Energy: 0.6437813684934984
Energy: 0.6433012782701859
Energy: 0.6464739353123509
Energy: 0.6347895338742908
Energy: 0.6445160357619686
Energy: 0.643704638210926
Energy: 0.6830071043826462
Energy: 0.6458325661099292
Energy: 0.6336044837574493
Energy: 0.6451120456513633
Energy: 0.6434487854742725
Energy: 0.6448063017316934
Energy: 0.6460661002781845
Energy: 0.6745576631473017
Energy: 0.6477488765680249
Energy: 0.6331999436714275
Energy: 0.6410020542840703
Energy: 0.6531173323048676
Energy: 0.6743892366782072
Energy: 0.6469666393128919
Energy: 0.6368073436027253
Energy: 0.6363086872907465
Energy: 0.6434169095076441
Energy: 0.6379076038662562
Energy: 0.6450820255825414
Energy: 0.635038034132932
Energy: 0.6806759833916028
Energy: 0.6435006513304196
Energy: 0.6424826226004184
Energy: 0.644962207809889
Energy: 0.6342988916344791
Energy: 0.6844925897570425
Energy: 0.6438936993691866
Energy: 0.6458758946539904
Energy: 0.6769935120447574
Energy: 0.6941684256675913
Energy: 0.6489557318790887
Energy: 0.6513531647251166
Energy: 0.6467560848697909
Energy: 0.6767447148187886
Energy: 0.6509252569333218
Energy: 0.6455549471240166
Energy: 0.6347064492551103
Energy: 0.6495733934910062
Energy: 0.6429160818716059
Energy: 0.6448391123144733
Energy: 0.680944518808054
Energy: 0.6347924315772363
Energy: 0.646380059942978
Energy: 0.6333584769420914
Energy: 0.6463743055812249
Energy: 0.6790287815632392
Energy: 0.6318420070866932
Energy: 0.6478664810500866
Energy: 0.68880246028872
Energy: 0.6477435391243022
Energy: 0.6377003296175738
Energy: 0.6322679993625597
Energy: 0.6491792325430532
Energy: 0.6921618722651525
Energy: 0.6484516267656386
Energy: 0.6371013348076358
Energy: 0.6805145536077261
Energy: 0.6435950405815052
Energy: 0.6426963781188723
Energy: 0.6441068866203125
Energy: 0.6451661470254475
Energy: 0.6771875662444843
Energy: 0.6439076916532371
Energy: 0.6382176132693763
Energy: 0.6446500873715766
Energy: 0.6504272171899156
Energy: 0.6461668397957995
Energy: 0.6455239453975057
Energy: 0.6446331453414369
Energy: 0.693805722193627
Energy: 0.6777880226826655
Energy: 0.6472745777452469
Energy: 0.6440694023764914
Energy: 0.643842982316228
Energy: 0.6888674753467079
Energy: 0.6786211020610283
Energy: 0.6914600569430367
Energy: 0.633865345753772
Energy: 0.6356431950195397
Energy: 0.646983181300085
Energy: 0.6876963252776181
Energy: 0.6900595537819486
Energy: 0.6334539572099487
Energy: 0.6366795777440161
Energy: 0.6471914125400117
Energy: 0.6784382634623024
Energy: 0.6456259966362947
Energy: 0.6397416312524417
Energy: 0.6335220126322294
Energy: 0.6510687356577274
Energy: 0.6519251612797036
Energy: 0.6437853362833852
Energy: 0.6393209839609574
Energy: 0.633519959243113
Energy: 0.6439584829073965
Energy: 0.6439255208848903
Energy: 0.6435702126753311
Energy: 0.6901227330629293
Energy: 0.6504957890656821
Energy: 0.6441579835089695
Energy: 0.6382106130514329
Energy: 0.6444077896710029
Energy: 0.6884669383452725
Energy: 0.6491719062469837
Energy: 0.6434593640895943
Energy: 0.6436166898299261
Energy: 0.6473999584396991
Energy: 0.6345959890809971
Energy: 0.6449408954608745
Energy: 0.643666066316555
Energy: 0.6787681400308276
Energy: 0.645929190225431
Energy: 0.6335421307782967
Energy: 0.6454694160514493
Energy: 0.6433334242157778
Energy: 0.644764265429001
Energy: 0.6465021909764326
Energy: 0.674454384918112
Energy: 0.6482256139155543
Energy: 0.6333448724859225
Energy: 0.6407165489124009
Energy: 0.6542024927934522
Energy: 0.6746739714435765
Energy: 0.646811594245459
Energy: 0.6356953307424948
Energy: 0.636848126628422
Energy: 0.6435175454986707
Energy: 0.6383603858331705
Energy: 0.6451110828974362
Energy: 0.6351379715990351
Energy: 0.6803205542140496
Energy: 0.6434376922487515
Energy: 0.6424858915834604
Energy: 0.6451567020075746
Energy: 0.6344423007115828
Energy: 0.6450281688187826
Energy: 0.6439436674592868
Energy: 0.6450701686977528
Energy: 0.6751208388119073
Energy: 0.6907506103979953
Energy: 0.6490864868043974
Energy: 0.6482677726762283
Energy: 0.6466780487965361
Energy: 0.6774937488536028
Energy: 0.655674133595033
Energy: 0.6461281353521866
Energy: 0.6341300449033481
Energy: 0.6498118460884869
Energy: 0.6428506889869267
Energy: 0.644298719495248
Energy: 0.679889330271036
Energy: 0.6343973285650545
Energy: 0.6459172836469836
Energy: 0.6332752255462708
Energy: 0.6453455279609205
Energy: 0.6780860600781223

minimum gb energy = 0.6317197705036812 eV
minimum distance =  2.59755471811764 Angstroms
sigma value = 15


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

Energy: 1.189333795637368
Energy: 0.6807202341999783
Energy: 0.707787948753585
Energy: 0.6484053417648378
Energy: 0.6916396655382974
Energy: 0.6349309340879841
Energy: 0.6877743819238218
Energy: 0.6880916179723899
Energy: 0.6385617657326627
Energy: 0.6880553490468981
Energy: 0.6233545119023272
Energy: 0.6696249584903862
Energy: 0.6812298369544956
Energy: 0.6811843499446358
Energy: 0.6485054577931629
Energy: 0.6234287435575917
Energy: 0.6707584014288228
Energy: 0.6810282849499767
Energy: 0.6832496547571649
Energy: 0.6404535502273985
Energy: 0.7103232120455285
Energy: 0.6658376537375305
Energy: 0.6582963078302196
Energy: 0.6782624080998443
Energy: 0.6471313566714028
Energy: 0.7117742373522137
Energy: 0.6670854337413588
Energy: 0.6575956716679571
Energy: 0.6715821193859971
Energy: 0.7274220556575198
Energy: 0.6760550649469386
Energy: 0.641607436308575
Energy: 0.6864805431359314
Energy: 0.7145246887761575
Energy: 0.7328273640544042
Energy: 0.6788024107191138
Energy: 0.6357422936423887
Energy: 0.6887431156484005
Energy: 0.711949665418111
Energy: 0.7279578825622702
Energy: 0.70359518841606
Energy: 0.6955173534777587
Energy: 0.6340828968067392
Energy: 0.6366815844477702
Energy: 0.6682549214494126
Energy: 0.6919855832963274
Energy: 0.6964607992131827
Energy: 0.6528140571986935
Energy: 0.6368706024701168
Energy: 0.6233972036538873
Energy: 0.6249737326015021
Energy: 0.6361551308557972
Energy: 0.6361545306350113
Energy: 0.7004383321517105
Energy: 0.7640233726579415
Energy: 0.68617165946476
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Energy: 0.7206234253806444
Energy: 0.7552825315432568
Energy: 0.6418753646986309
Energy: 0.6351340679318682
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Energy: 0.6701021294072335
Energy: 0.6406491178116798
Energy: 0.6354534694783261
Energy: 0.6382238645922931
Energy: 0.6433208963997067
Energy: 0.7004981347975255
Energy: 0.6401004964956061
Energy: 0.6371783792406116
Energy: 0.6469697978532829
Energy: 0.6363708552853315
Energy: 0.6782894899452447
Energy: 0.6385603224169522
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Energy: 0.656098230887842
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Energy: 0.6904494329238718
Energy: 0.6363030164348202
Energy: 0.7628421749589815
Energy: 0.6882471819042879
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Energy: 0.6433685855621049
Energy: 0.6360075762963446
Energy: 0.7606422590542699
Energy: 0.6918209385877908
Energy: 0.6710312564186663
Energy: 0.6430431676737987
Energy: 0.6894814704495436
Energy: 0.6363464557604978
Energy: 0.6287877119007118
Energy: 0.6506261672467762
Energy: 0.6500593245307015
Energy: 0.6714584002538339
Energy: 0.6797955599811325
Energy: 0.6299689534873208
Energy: 0.6519523581046134
Energy: 0.6522530049317886
Energy: 0.6814781802024316
Energy: 0.6499425426045197
Energy: 0.6460201954775183
Energy: 0.6515090488249237
Energy: 0.6374022769320107
Energy: 0.6746992980668816
Energy: 0.6393244145757211
Energy: 0.6472897722450092
Energy: 0.6531642059071926
Energy: 0.6381805517871151
Energy: 0.768725813772415
Energy: 0.6749380484043549
Energy: 0.6487605167761906
Energy: 0.625476901346295
Energy: 0.7043839151973567
Energy: 0.7682532612788433
Energy: 0.6598970875090834
Energy: 0.6254020979645329
Energy: 0.6263956674977849
Energy: 0.6750806805611552
Energy: 0.7044925781286515
Energy: 0.6735657765512716
Energy: 0.6557185344884517
Energy: 0.6662900009373783
Energy: 0.6722811617119498
Energy: 0.7098685119426251
Energy: 0.6418510000932391
Energy: 0.6523361263603475
Energy: 0.6672225432986177
Energy: 0.6839553096020526
Energy: 0.6829063267288211
Energy: 0.6892073886210174
Energy: 0.7055104252044934
Energy: 0.6869877522967645
Energy: 0.6741978226254249
Energy: 0.6825100186678233
Energy: 0.6876786219694215
Energy: 0.6206495871053215
Energy: 0.6876148995961908
Energy: 0.6616899063453897
Energy: 0.6366842189698405
Energy: 0.6717896666995152
Energy: 0.7356699212854195
Energy: 0.707984402376429
Energy: 0.6597249540326187
Energy: 0.6487814619137542
Energy: 0.6808028454126057
Energy: 0.739943631595275
Energy: 0.7185339427787514
Energy: 0.672456466941708
Energy: 0.7171718555434577
Energy: 0.7370704858138537
Energy: 0.6514735026953559
Energy: 0.670952476807779
Energy: 0.6505035437786941
Energy: 0.7303879835124231
Energy: 0.7380174931170831
Energy: 0.6516463234472751
Energy: 0.6665995423015851
Energy: 0.6227212125831236
Energy: 0.6236681359778056
Energy: 0.6416894143759992
Energy: 0.6422236814390062
Energy: 0.7234270163801712
Energy: 0.6852178332301274
Energy: 0.6246428822367506
Energy: 0.6488587149950754
Energy: 0.7526206292608464
Energy: 0.710452454618677
Energy: 0.6872517303615211
Energy: 0.6918310758524574
Energy: 0.7360162244905615
Energy: 0.7368969924634997
Energy: 0.6465123284303019
Energy: 0.6397000245583627
Energy: 0.7188608781000304
Energy: 0.736061441990559
Energy: 0.7363342089717266
Energy: 0.6455437049146409
Energy: 0.6391444127162391
Energy: 0.6383808717732096
Energy: 0.6331354770377938
Energy: 0.6596835364122648
Energy: 0.6423761573326476
Energy: 0.6430402705210878
Energy: 0.6394566282302419
Energy: 0.639888664967063
Energy: 0.6417496373531147
Energy: 0.6407672583776073
Energy: 0.6427871988276964
Energy: 0.616849215976213
Energy: 0.6856650486955457
Energy: 0.6701745944385371
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Energy: 0.6388110824948036
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Energy: 0.6464528875730929
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Energy: 0.6247994871474699
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Energy: 0.6615155146549037
Energy: 0.6704523878075573
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Energy: 0.7118606900661409
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Energy: 0.731653253573509
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Energy: 0.6383650048803639
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Energy: 0.7380491984816849
Energy: 0.7285560776537326
Energy: 0.6756873575012613
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Energy: 0.6367510410797402
Energy: 0.6412223596015929
Energy: 0.6398623136573872
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Energy: 0.6418326778703366
Energy: 0.6365697438676312
Energy: 0.6432680699491586
Energy: 0.6399132116910824
Energy: 0.6406101696798606
Energy: 0.6430178985285732
Energy: 0.6421149619909479
Energy: 0.683795213863805
Energy: 0.6763830559839485
Energy: 0.6359815395783678
Energy: 0.6369061342119696
Energy: 0.641698937313484
Energy: 0.6836945304939201
Energy: 0.6773237475593072
Energy: 0.6353433889695845
Energy: 0.6370727805734578
Energy: 0.687836747997001
Energy: 0.6337334038141436
Energy: 0.6471102253634382
Energy: 0.6872703771421969
Energy: 0.6698090759315821
Energy: 0.672017163127119
Energy: 0.6339958896226172
Energy: 0.6372247045960916
Energy: 0.6872225750633305
Energy: 0.683044122557486
Energy: 0.6390857174235124
Energy: 0.6373970750462645
Energy: 0.6710063441457018
Energy: 0.7598785536419109
Energy: 0.6359138757001689
Energy: 0.6240103898366455
Energy: 0.6235383034243145
Energy: 0.6607132700508703
Energy: 0.762482963699119
Energy: 0.6364058899563361
Energy: 0.6465190885725015
Energy: 0.6406632372892448
Energy: 0.6434170014397326
Energy: 0.636608854156709
Energy: 0.6505112271689361
Energy: 0.646352310403059
Energy: 0.6462746101726192
Energy: 0.6529542506735846
Energy: 0.6382437631729747
Energy: 0.6427094063461658
Energy: 0.6398919617076184
Energy: 0.6256582020866664
Energy: 0.6459482590726806
Energy: 0.7536547717988887
Energy: 0.6972983529084832
Energy: 0.6242603050424576
Energy: 0.6608769476658009
Energy: 0.7625960579129264
Energy: 0.6839102804674685
Energy: 0.7073118588825649
Energy: 0.6522250544406768
Energy: 0.7064382256396337
Energy: 0.6689425975637481
Energy: 0.6366060947254257
Energy: 0.6209882375920435
Energy: 0.6435007259458054
Energy: 0.7064348790908286
Energy: 0.6943533755501999
Energy: 0.6656413410781772
Energy: 0.6247283591928683

minimum gb energy = 0.6148833256314065 eV
minimum distance =  2.56259555214406 Angstroms
sigma value = 437


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

Energy: 0.88693081630083
Energy: 0.6935123228187731
Energy: 0.6538150001725822
Energy: 0.654675696753465
Energy: 0.6947699971556798
Energy: 0.8852952064738635
Energy: 0.6118956093334984
Energy: 0.654599889327849
Energy: 0.6048871968561698
Energy: 0.587389549858433
Energy: 0.5822406855246429
Energy: 0.6603727720879365
Energy: 0.5984963564664058
Energy: 0.704397184706913
Energy: 0.6026811579771607
Energy: 0.5841742342413568
Energy: 0.6206777055962949
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Energy: 0.6596608573415533
Energy: 0.6028794383213626
Energy: 0.6470697781423022
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Energy: 0.6589733077356736
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Energy: 0.6480922998074843
Energy: 0.6553364560265961
Energy: 0.6594168899648551
Energy: 0.6032721618067846
Energy: 0.6536450619354404
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Energy: 0.6046622329862348
Energy: 0.6580981461620014
Energy: 0.6511685682642098
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Energy: 0.6578316254164592
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Energy: 0.6584755684427188
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Energy: 0.645727802145093
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Energy: 0.6525769538915246
Energy: 0.6455120784324048
Energy: 0.6441094213415678
Energy: 0.6025629545004235
Energy: 0.5999586514054509
Energy: 0.6549527211023185
Energy: 0.5860986918491756
Energy: 0.6020853221347761
Energy: 0.6047209279834913
Energy: 0.660047532245436
Energy: 0.65426319995823
Energy: 0.5872685474210331
Energy: 0.6020995714278093
Energy: 0.6058930789568184
Energy: 0.6599431869254162
Energy: 0.6014851402438475
Energy: 0.6578500953631501
Energy: 0.6133129456377214
Energy: 0.601604867738562
Energy: 0.6031908326679798
Energy: 0.6009080992662642
Energy: 0.6577387062886487
Energy: 0.6124385578537082
Energy: 0.60491762934683
Energy: 0.6025384700081146
Energy: 0.5869877483045985
Energy: 0.608508356624725
Energy: 0.586744579663781
Energy: 0.5880450099093582
Energy: 0.6208505177993414
Energy: 0.601563290707679
Energy: 0.6071886301877385
Energy: 0.5881412134788001
Energy: 0.5858623549554337
Energy: 0.6173554502811052
Energy: 0.5849322788034501
Energy: 0.5844660461394974
Energy: 0.6125403172013516
Energy: 0.613147862775348
Energy: 0.5855217089789315
Energy: 0.5845285461899372
Energy: 0.5841113142533844
Energy: 0.6137763476246817
Energy: 0.6133712355834836
Energy: 0.6054476134801713
Energy: 0.5874394377431004
Energy: 0.5871169505368294
Energy: 0.5873733307197446
Energy: 0.6691426465035797
Energy: 0.5863656506030404
Energy: 0.5840991619948368
Energy: 0.5884336736128394
Energy: 0.5884609227513087
Energy: 0.6388706251166155
Energy: 0.5854790614896124
Energy: 0.585382247982259
Energy: 0.5871003318478651
Energy: 0.6063081860320846
Energy: 0.6591879062637078
Energy: 0.586005731340987
Energy: 0.5858707523158756
Energy: 0.5888902570214805
Energy: 0.6061296521365293
Energy: 0.6584982976142488
Energy: 0.585122832850796
Energy: 0.5881373502376822
Energy: 0.6132256198445268
Energy: 0.6786808845447379
Energy: 0.5872002992492553
Energy: 0.5895514571956353
Energy: 0.7119632664687803
Energy: 0.6131270898253209
Energy: 0.7127197958213745
Energy: 0.5863536041261277
Energy: 0.6136798350890078

minimum gb energy = 0.5822406855246429 eV
minimum distance =  2.64435059215085 Angstroms
sigma value = 33