Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.633016772568226
cohesive_energy=4.280573320677608
mass=55.845
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=[1.485507733688754e-19, 2.2546150028974797e-19, 2.9193260448114e-19, 3.4856954849304003e-19, 3.9552293692904397e-19, 4.35665472493914e-19, 4.7225758463784e-19, 5.077025383118219e-19, 5.406785377928099e-19, 5.67880292684862e-19, 5.8841539060284e-19, 6.04275337102806e-19, 6.178794189021e-19, 6.30470925068706e-19, 6.42173223203442e-19, 6.526578670963379e-19, 6.61622045363568e-19, 6.689504012874839e-19, 6.746974088736419e-19, 6.7901847925554e-19, 6.821106801591599e-19, 6.841742836637519e-19, 6.85375916139252e-19, 6.85770051591216e-19, 6.8533746390003595e-19, 6.8391312887241e-19, 6.812535156599699e-19, 6.77026973699478e-19, 6.708521849520419e-19, 6.6227573343024e-19, 6.50714426839296e-19, 6.35434468280838e-19, 6.1554825189963e-19, 5.900175672368399e-19, 5.57655201406674e-19, 5.171329499795459e-19, 4.66928745153156e-19, 4.05208094681574e-19, 3.2956933579043396e-19, 2.36628671428728e-19, 1.212211647814302e-19, -2.5223547402052197e-20, -2.1607274521450798e-19, -4.6747188303208195e-19, -7.960975367850899e-19, -1.2255577791755218e-18, -1.79471020010778e-18, -2.56719966419088e-18, -3.64995063344808e-18, -5.233429866129299e-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: 0.018494188444209365
Energy: 0.026573574078559866
Energy: 0.17444080544183113
Energy: 0.17352019653004477
Energy: 0.02525643718080686
Energy: 0.020471259324993385
Energy: 0.17314462808323075
Energy: 0.1753893160366127
Energy: 0.17287916211291146
Energy: 0.024015571425571022
Energy: 0.01960435644360903
Energy: 0.1709578793796478
Energy: 0.1732099516442946
Energy: 0.17499331015282452
Energy: 0.17474197568184474
Energy: 0.17167138876167556
Energy: 0.1735568959841085
Energy: 0.17302394482005806
Energy: 0.17537266482908898
Energy: 0.17436596866121207
Energy: 0.175646075463543
Energy: 0.023787251009407828
Energy: 0.019158871203928857
Energy: 0.17512219225305764
Energy: 0.17338029433969115
Energy: 0.17845161098225581
Energy: 0.022594960451736413
Energy: 0.019142029252262962
Energy: 0.17158638817225919
Energy: 0.17446673234937166
Energy: 0.17360881677720919
Energy: 0.020842392455266513
Energy: 0.020628037548982393
Energy: 0.1730659093434505
Energy: 0.1714436202651449
Energy: 0.17460718772399378
Energy: 0.02160702639733913
Energy: 0.019403655403846344
Energy: 0.17108275136849402
Energy: 0.17099774468912
Energy: 0.17275475647108338
Energy: 0.17251659213675835
Energy: 0.17579664884713042
Energy: 0.021339645604071745
Energy: 0.019447492083336883
Energy: 0.17215605573403592
Energy: 0.17341963158147738
Energy: 0.17558339062868447
Energy: 0.022553623219192173
Energy: 0.17103609787496882
Energy: 0.17503363604554276
Energy: 0.1718924200755522
Energy: 0.1733445954904413
Energy: 0.0201050893085462
Energy: 0.01930076216075004
Energy: 0.1760673758253971
Energy: 0.17222891585660735
Energy: 0.17419071333548608
Energy: 0.021099921944324366
Energy: 0.019494974188032903
Energy: 0.01958938718308576
Energy: 0.1763271544610674
Energy: 0.17322491466747816
Energy: 0.17502764167687543
Energy: 0.17737448336113407
Energy: 0.019575367259902544
Energy: 0.17725135947618417
Energy: 0.1727093506467745
Energy: 0.17629210517241062
Energy: 0.17668362897421508

minimum gb energy = 0.018494188444209365 eV
minimum distance =  2.53130632201006 Angstroms
sigma value = 3


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

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Energy: 1.3915792488354375
Energy: 1.4145625641715192
Energy: 1.3458384440160158
Energy: 1.3445745433503584
Energy: 1.3432654288048982
Energy: 1.3446426085543355
Energy: 1.342723792852664
Energy: 1.418429901881292
Energy: 1.3878390261900504
Energy: 1.33156938722982
Energy: 1.7426946526743268
Energy: 1.3435791743358723
Energy: 1.343419371927775
Energy: 1.2728908835572326
Energy: 1.265372959270849
Energy: 1.5840355280227578
Energy: 1.4127901489790748
Energy: 1.2458728693957069
Energy: 1.447945692044097
Energy: 1.438160055372344
Energy: 1.5459441540123975
Energy: 1.1932117329724083
Energy: 1.2673066831062285
Energy: 1.2701968806392632
Energy: 1.2665091412182463
Energy: 1.682659064255034
Energy: 1.188799386567783
Energy: 1.3982969352744128
Energy: 1.4276401296374595
Energy: 1.398186337103775
Energy: 1.4209264917506574
Energy: 1.505019827622909
Energy: 1.2681970670789737
Energy: 1.274331522936001
Energy: 1.266464935740061
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Energy: 1.5044782159110281
Energy: 1.3387890901011974
Energy: 1.4271103377241003
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Energy: 1.3921381920462552
Energy: 1.6077139874718942
Energy: 1.3600604031988692
Energy: 1.3545493013323888
Energy: 1.4538050013508819
Energy: 1.3890833498458772
Energy: 1.6095713285497144
Energy: 1.5575708778916442
Energy: 1.3549033961698707
Energy: 1.4551496105570871
Energy: 1.3931318945728934
Energy: 1.600893912913988
Energy: 1.3570113059649085
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Energy: 1.393098095585536
Energy: 1.6002342677697774
Energy: 1.3574772938605941
Energy: 1.5964302279205114
Energy: 1.4560660505425955
Energy: 1.641670356321137
Energy: 1.4713758935241235
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Energy: 1.6136535092043258
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Energy: 1.3254168043200902
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Energy: 1.4577098650297617
Energy: 1.4632512736711099
Energy: 1.467705467198097
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Energy: 1.354492948138417
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Energy: 1.3637033808818844
Energy: 1.4623804307553818
Energy: 1.4648632776960264
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Energy: 1.466031825468469
Energy: 1.4636886732957268
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Energy: 1.4643758262299413
Energy: 1.470784273151324
Energy: 1.4661895138739094
Energy: 1.4638537704187302
Energy: 1.4715259755834877
Energy: 1.4663884515543506
Energy: 1.3787081399344983
Energy: 1.5870509213655974
Energy: 1.4737297569107792
Energy: 1.467421588003662
Energy: 1.3638973533835037
Energy: 1.40307273565832
Energy: 1.46521535321373
Energy: 1.4628002034229883
Energy: 1.4674231569457867
Energy: 1.3633246113699242
Energy: 1.3548131693776366
Energy: 1.5686497167750555
Energy: 1.199122712559263
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Energy: 1.3647340144421296
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Energy: 1.366197116056923
Energy: 1.4058158470515507
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Energy: 1.1922637408482868
Energy: 1.3921871485692523
Energy: 1.343551360288674
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Energy: 1.3929148606239667
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Energy: 1.587642823080225
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Energy: 1.3549033589800437
Energy: 1.5517608350256722
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Energy: 1.4571249065975418
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Energy: 1.4208694072702575
Energy: 1.6173041956008607
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Energy: 1.4635127635549958
Energy: 1.463490848878006
Energy: 1.420957144412217
Energy: 1.6202695326344634
Energy: 1.4578264914549635
Energy: 1.6161245561871715
Energy: 1.2788715554174597
Energy: 1.3545515880523358
Energy: 1.5758632851530772
Energy: 1.4657718739528347
Energy: 1.4558418559304327
Energy: 1.288879144526473
Energy: 1.3536817209268852
Energy: 1.715737440562761
Energy: 1.471746595799747
Energy: 1.3087786678415685
Energy: 1.3667295662099426
Energy: 1.354464221252737
Energy: 1.3360904796022195
Energy: 1.186107436073647
Energy: 1.3175147720046916
Energy: 1.3941704944414857
Energy: 1.35356161054156
Energy: 1.393834495223483
Energy: 1.185404912503655
Energy: 1.1714747600890667
Energy: 1.3604096791534546
Energy: 1.3559343766961274
Energy: 1.419118788534438
Energy: 1.185551389877016
Energy: 1.3819912199806343
Energy: 1.3594925919424743
Energy: 1.355608977381982
Energy: 1.3901221391185983
Energy: 1.185710413040524
Energy: 1.697453683951353
Energy: 1.354575735856443
Energy: 1.5014373642128396
Energy: 1.3468648101104896
Energy: 1.4066690301760907
Energy: 1.5748374124675253
Energy: 1.2670861048909994
Energy: 1.4997825724746834
Energy: 1.6184276941176479
Energy: 1.4084786233449613
Energy: 1.611457124284442
Energy: 1.5279198873887025
Energy: 1.5820539601868187
Energy: 1.5500314535641555
Energy: 1.5510529090819694
Energy: 1.4704818429361062
Energy: 1.269656418381179
Energy: 1.4678098113261506
Energy: 1.5499694895891718
Energy: 1.5512198163254733
Energy: 1.4334619051468376
Energy: 1.411398213031494
Energy: 1.4196584568304231
Energy: 1.338943324538754
Energy: 1.348042907662369
Energy: 1.2633049035491413
Energy: 1.2716839804648747
Energy: 1.4183373246211957
Energy: 1.3428500960380458
Energy: 1.3921951433567012
Energy: 1.3896642719042
Energy: 1.3422146882051493
Energy: 1.415529190090011
Energy: 1.3436712692497346
Energy: 1.3430416683440756
Energy: 1.3431831799696028
Energy: 1.3426492362787423
Energy: 1.4149660347022608
Energy: 1.3413481298625918
Energy: 1.4146566503410087

minimum gb energy = 1.1714747600890667 eV
minimum distance =  2.23688188114944 Angstroms
sigma value = 75


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

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Energy: 1.693978580056645
Energy: 1.4271768611466316
Energy: 1.653414537192467
Energy: 1.6932166275829463
Energy: 1.7303596443988545
Energy: 1.6475982215618328
Energy: 1.4549512884832154
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Energy: 1.6884658671679045
Energy: 1.6751537741588434
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Energy: 1.435225480649152
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Energy: 1.513363259346832
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Energy: 1.7249048615704514
Energy: 1.7566258645744082
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Energy: 1.7235757506386462
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Energy: 1.704497586021486
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Energy: 1.4809179706177271
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Energy: 1.306196605645303
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Energy: 1.566841553886418
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Energy: 1.526438632968957
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Energy: 1.7813029518611365
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Energy: 1.7393482973721666
Energy: 1.718438764527649
Energy: 1.7623787991761606
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minimum gb energy = 1.3026069906870088 eV
minimum distance =  2.3012551488998 Angstroms
sigma value = 105


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

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Energy: 1.553225767345765
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Energy: 1.605085164436468
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Energy: 1.6524280575179404
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Energy: 1.6087429353886644
Energy: 1.600951152609474
Energy: 1.6525626511117089
Energy: 1.667982747376973
Energy: 1.6214679066579842
Energy: 1.5734124248789614
Energy: 1.6084590169303727
Energy: 1.6300295942390899
Energy: 1.6369343773178395
Energy: 1.612478690095157
Energy: 1.5389608221906692
Energy: 1.6073099651813143
Energy: 1.6338446966910498
Energy: 1.6138738329711428
Energy: 1.6261502693905163
Energy: 1.6398328138829852
Energy: 1.5794985254882628
Energy: 1.6318296462932407
Energy: 1.6291514983911795
Energy: 1.610989476225584
Energy: 1.5433132092009125
Energy: 1.545280639513541
Energy: 1.5707998217029737
Energy: 1.604750302718839
Energy: 1.630605971396452
Energy: 1.620974489658727
Energy: 1.6081339920567836
Energy: 1.5204191243567522
Energy: 1.5798228668124632
Energy: 1.469788676154712
Energy: 1.6121867206098897
Energy: 1.6130600510559743
Energy: 1.6440560399413338
Energy: 1.6094364371008563
Energy: 1.52954173541697
Energy: 1.6778413395938625
Energy: 1.6233069401493638
Energy: 1.5694175794846936
Energy: 1.602911469239237
Energy: 1.5235503097684149
Energy: 1.627752227043071
Energy: 1.695766750798355
Energy: 1.5766004207240194
Energy: 1.6672769530654643
Energy: 1.648691671008984
Energy: 1.6237236342775427
Energy: 1.682593582341132
Energy: 1.7050212664880382
Energy: 1.71262075482452
Energy: 1.6467735981744063
Energy: 1.6240995211740483
Energy: 1.6840586052252235
Energy: 1.670815336904007
Energy: 1.652541235060678
Energy: 1.5176736498752388
Energy: 1.5163656386998714
Energy: 1.5156277609520092
Energy: 1.6236005185530047
Energy: 1.5776265499942912
Energy: 1.4693827321764659
Energy: 1.4687500630261967
Energy: 1.5215234827769133
Energy: 1.6891589443181885
Energy: 1.5561838578682556
Energy: 1.4715386616297876
Energy: 1.4890635005707593
Energy: 1.5263870745805574
Energy: 1.4713593325320027
Energy: 1.4652854192965732
Energy: 1.4702903512343304
Energy: 1.5170159015671567
Energy: 1.5182241964019765
Energy: 1.6081534443204357

minimum gb energy = 1.465149702185814 eV
minimum distance =  2.31946898716365 Angstroms
sigma value = 165


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

Energy: 2.097865036072964
Energy: 1.4166718269426266
Energy: 1.4340411219865796
Energy: 1.5238931468275532
Energy: 1.4157992806191901
Energy: 1.6229901187887998
Energy: 1.434529045472641
Energy: 1.4346329578681438
Energy: 1.525056544004901
Energy: 1.4156737820562502
Energy: 1.419695013721921
Energy: 1.5266541673683063
Energy: 1.5320441993065077
Energy: 1.5345569375493675
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Energy: 1.525066547509423
Energy: 1.5279372498782542
Energy: 1.5314403865329977
Energy: 1.5350860994430584
Energy: 1.5282003142965432
Energy: 1.526799964847934
Energy: 1.655577136048928
Energy: 1.5225777132309144
Energy: 1.530766263407977
Energy: 1.6060001058735007
Energy: 1.526378452407752
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Energy: 1.5466657574573854
Energy: 1.4339434046839483
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Energy: 1.6221025637368498
Energy: 1.6440238619377294
Energy: 1.527034935419601
Energy: 1.537338133997538
Energy: 1.5389033955012377
Energy: 1.525579992669188
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Energy: 1.5366918577707798
Energy: 1.5398304911373646
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Energy: 1.6044488834410926
Energy: 1.5257543912063611
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Energy: 1.6049923984023535
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Energy: 1.599344064059741
Energy: 1.6535460348020614
Energy: 1.6060117250237422
Energy: 1.5276274778827592
Energy: 1.5298889796816353
Energy: 1.5386331553451829
Energy: 1.5379576022787476
Energy: 1.4161445859495094
Energy: 1.5266568594467638
Energy: 1.5293394773158249
Energy: 1.5380829803084395
Energy: 1.5351034010345048
Energy: 1.5533551158164813
Energy: 1.650068154489087
Energy: 1.4286454178704084
Energy: 1.5232359553255679
Energy: 1.5248975757732401
Energy: 1.4327361804034389
Energy: 1.6489069173067252
Energy: 1.5375238785924865
Energy: 1.5233117613629785
Energy: 1.5269082444209938
Energy: 1.4317115601946007
Energy: 1.5350793415718715
Energy: 1.5237266523605488
Energy: 1.4352158475660572
Energy: 1.4220528307598188
Energy: 1.5518606828265094
Energy: 1.6510879066066475
Energy: 1.5225241831683431
Energy: 1.436177585151054
Energy: 1.419357842167837
Energy: 1.531030156941681
Energy: 1.4188412907887527
Energy: 1.5331665185477525
Energy: 1.5247222411054246
Energy: 1.4348500783297924
Energy: 1.526334076564134
Energy: 1.4187236531864553
Energy: 1.5341501112603277
Energy: 1.5255375879865614
Energy: 1.4345262864437145
Energy: 1.523598408967594

minimum gb energy = 1.4155796241256318 eV
minimum distance =  2.30757151381909 Angstroms
sigma value = 41


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

Energy: 1.4415721572291547
Energy: 1.3256931681109767
Energy: 1.3448109604222136
Energy: 1.298530181281207
Energy: 1.2398266855590738
Energy: 1.4191042437284251
Energy: 1.2396367329286127
Energy: 1.3478446289685921
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Energy: 1.456664436933749
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Energy: 1.40979851383941
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Energy: 1.4810411310433123
Energy: 1.630102615889691
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Energy: 1.4787315878684266
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Energy: 1.4000510412966785
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Energy: 1.4146294746463652
Energy: 1.3983806815887152
Energy: 1.4493763526192218
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Energy: 1.4413651705017787
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Energy: 1.4219804387640698
Energy: 1.4239075055548627
Energy: 1.3783036520269627
Energy: 1.4477657273785942
Energy: 1.4509006916291434
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Energy: 1.4234509632060055
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Energy: 1.3514643389917416
Energy: 1.2416339568356052
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Energy: 1.4415151079955215
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Energy: 1.3570854570004791
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Energy: 1.309682936783868
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Energy: 1.4257399927988545
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Energy: 1.4876501109309441
Energy: 1.3981940974107934
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Energy: 1.3057203483143383
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Energy: 1.452527239657284
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Energy: 1.424327685201003
Energy: 1.4882164438298475
Energy: 1.494489764583672
Energy: 1.4492109798249626
Energy: 1.4857566691900328
Energy: 1.388086239607506
Energy: 1.3950544109999856
Energy: 1.4595517742339414
Energy: 1.4181142895399772
Energy: 1.4692933129459989
Energy: 1.394967586175381
Energy: 1.4181655387059924
Energy: 1.4399746255699406
Energy: 1.4773531815757541
Energy: 1.2682066584239944
Energy: 1.3901281371361431
Energy: 1.4225409678484144
Energy: 1.3390338857623127
Energy: 1.4896329673487751
Energy: 1.371597893715213
Energy: 1.4001323772500502
Energy: 1.3803044588027038
Energy: 1.3500046383620707
Energy: 1.4019840480376367
Energy: 1.374277504769966
Energy: 1.2465880059820569
Energy: 1.3488251911207259
Energy: 1.3501640547406732
Energy: 1.440703685444468
Energy: 1.3509946812978426
Energy: 1.4149914408888624
Energy: 1.3896685791833525
Energy: 1.4731717487004943
Energy: 1.4822375516453803
Energy: 1.389705144762246
Energy: 1.343354788235652
Energy: 1.2390227829113554
Energy: 1.4080921566617643
Energy: 1.3797408912520135
Energy: 1.3908249613597696
Energy: 1.3011556622241722
Energy: 1.4115294431579866
Energy: 1.467492140352935
Energy: 1.3316405761746821
Energy: 1.3924448379172931
Energy: 1.440123564551368
Energy: 1.239339252115864
Energy: 1.4036790027387538
Energy: 1.240476319868547
Energy: 1.3918399009449183
Energy: 1.3971942230676861
Energy: 1.315686708088397

minimum gb energy = 1.2390227829113554 eV
minimum distance =  2.336660207263 Angstroms
sigma value = 185


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

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Energy: 1.0539568791067422
Energy: 0.8705406466940178
Energy: 1.0131300644354198
Energy: 0.7395446134192066
Energy: 0.8100300092163507
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Energy: 0.9522440695650186
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Energy: 0.6665729605996661
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Energy: 1.1635491856246125
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Energy: 0.9490079059741893
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Energy: 0.5912214643607202
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Energy: 1.1760468534772095
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Energy: 0.8566628748933296
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Energy: 0.884147604299691
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Energy: 0.739918187188344
Energy: 0.9577497407541313
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Energy: 0.8908889387896772
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Energy: 0.9052711331643183
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Energy: 0.9895877859635882
Energy: 0.8580799886284031
Energy: 0.8563383475667777
Energy: 1.018192539134723
Energy: 1.0383086199693077
Energy: 0.9528330247454407
Energy: 0.7381639040156691
Energy: 0.9526381742148943
Energy: 0.9473147290562179
Energy: 0.9516221994178645
Energy: 0.9490124156027592
Energy: 0.9481420477715476
Energy: 0.9666708544344351
Energy: 1.0800633443243732
Energy: 0.9650334692288965
Energy: 0.7396003028888387
Energy: 0.7725670953013207
Energy: 1.0105097750806449
Energy: 1.8413384551040433
Energy: 1.0102042237665376
Energy: 0.9524038577112975
Energy: 0.9482258550966259
Energy: 0.9789096632569836
Energy: 0.9910723533976428
Energy: 0.9880469957039303
Energy: 0.9431017581827164
Energy: 0.9566517946066583
Energy: 0.9913615307622311
Energy: 0.9341840774396328
Energy: 1.0280745819594759
Energy: 0.8983777988259445
Energy: 0.8789568969497905
Energy: 0.865469044328665
Energy: 1.0733359154768838
Energy: 0.8949108940288898
Energy: 0.8702817210448826
Energy: 0.9902232552746604
Energy: 1.0668920470604415
Energy: 0.8714559389485123
Energy: 0.9582905858659055
Energy: 0.7375326717955109
Energy: 0.9571289286768919
Energy: 1.0131730560581318
Energy: 0.8815779112139137
Energy: 1.0410224831892438

minimum gb energy = 0.5912214643607202 eV
minimum distance =  2.35997828365209 Angstroms
sigma value = 33


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

Energy: 1.279164656215837
Energy: 1.2534298770516235
Energy: 1.2455834968004937
Energy: 1.2267729982581468
Energy: 1.208645201536074
Energy: 1.1950657614690123
Energy: 1.237313584490815
Energy: 1.2280385332652906
Energy: 1.2447503157110245
Energy: 1.2382201174982317
Energy: 1.2326131429692386
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Energy: 1.23653791815216
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Energy: 1.2600699818051606
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Energy: 1.2280217970464333
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Energy: 1.2329485878661104
Energy: 1.2537650738753015
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Energy: 1.2403586533975313
Energy: 1.2325327356931692
Energy: 1.25630811284391
Energy: 1.241734695352997
Energy: 1.2331118758718278
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Energy: 1.217589247345045
Energy: 1.2208060956030637
Energy: 1.2530403464866875
Energy: 1.2156406349868334
Energy: 1.2342728797011084
Energy: 1.2156038461737368
Energy: 1.243285025301759
Energy: 1.253187840856251
Energy: 1.2162292169162698
Energy: 1.2417959003344874
Energy: 1.2185012539592572
Energy: 1.2329853559244288
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Energy: 1.2052577914540834
Energy: 1.2407352947799142
Energy: 1.2287588743542583
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Energy: 1.2202854785078723
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Energy: 1.227961951387451
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Energy: 1.2250150059433877
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Energy: 1.201929454074879
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Energy: 1.240008320713495
Energy: 1.235990922064207
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Energy: 1.2008084137358421
Energy: 1.2417431115717372
Energy: 1.2269264983541994
Energy: 1.2475536217363585
Energy: 1.2360971588900307

minimum gb energy = 1.1950657614690123 eV
minimum distance =  2.30737453719631 Angstroms
sigma value = 219


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

Energy: 1.618180098399094
Energy: 1.6245005330088904
Energy: 1.6345119328338222
Energy: 1.6185414492477557
Energy: 1.6411368789668315
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Energy: 1.6264782817621504
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Energy: 1.6385263053431591
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Energy: 1.619834561314047
Energy: 1.6324937088163711
Energy: 1.6444845525680316
Energy: 1.634005121598649
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Energy: 1.6203440228054506
Energy: 1.6705588103567068
Energy: 1.6294534184187726
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Energy: 1.6362108418500723
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Energy: 1.628171887086824
Energy: 1.631156631797857
Energy: 1.6400718567390267
Energy: 1.6505283282356955
Energy: 1.628770588033963
Energy: 1.6170139199080222
Energy: 1.6310981646144604

minimum gb energy = 1.6135193039296958 eV
minimum distance =  2.32564369678054 Angstroms
sigma value = 15


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

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Energy: 1.8508015489425895
Energy: 1.880956464234196
Energy: 1.8354704438612606
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Energy: 1.8110519798853744
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Energy: 1.837611855199405
Energy: 1.83337018072903
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Energy: 1.8737039018035706
Energy: 1.8443532580886448
Energy: 1.8384248200955389
Energy: 1.8911643844989294
Energy: 1.8779749080660848
Energy: 1.8657988658802516
Energy: 1.8330171943094713
Energy: 1.8437359235848065
Energy: 1.8635689184321895
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minimum gb energy = 1.80317994504024 eV
minimum distance =  2.29914484312285 Angstroms
sigma value = 293


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

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Energy: 1.9221475406974062
Energy: 1.9243737041467206
Energy: 1.8363106793590223
Energy: 1.8732160944762506
Energy: 1.837590499962041
Energy: 1.8133895509413478
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Energy: 1.8222670604122404
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Energy: 1.8192095182654622
Energy: 1.8211463668494776
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Energy: 1.85608614049114
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Energy: 1.8205935087944716
Energy: 1.8109843732757795
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Energy: 1.8944530857512822
Energy: 1.8368790778901913
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Energy: 1.8186641075600867
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Energy: 1.832883407475008
Energy: 1.8288401410110156
Energy: 1.856514092655266
Energy: 1.8194197077615497
Energy: 1.861323414820173
Energy: 1.8969803841009398
Energy: 1.8284286591776304
Energy: 1.861657587732812
Energy: 1.8200110556326752
Energy: 1.8564082070372836
Energy: 1.8768313420010696
Energy: 1.8245937405967048
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Energy: 1.8376237717403825
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Energy: 1.8589713461141082
Energy: 1.8215812850696849
Energy: 1.8172546857810663
Energy: 1.9118943157964423
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Energy: 1.8355279694524413
Energy: 1.8260943634874949
Energy: 1.8170825518011615
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Energy: 1.826679998956695
Energy: 1.8466781552194156
Energy: 1.8219794400111333
Energy: 1.8384553890093873
Energy: 1.7871095909253005
Energy: 1.7892218601257572
Energy: 1.8499545316787862
Energy: 1.8211401414159716
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Energy: 1.7874223380232652
Energy: 1.7908802579853633
Energy: 1.8495711353293223
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Energy: 1.81700580542427
Energy: 1.8876198283986794
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Energy: 1.9156194527905819
Energy: 1.8183596652301626
Energy: 1.8178799654465374
Energy: 1.8888944900090097
Energy: 1.8117018143576595
Energy: 1.8273575484797986
Energy: 1.8229752943224327
Energy: 1.878886947788855
Energy: 1.8818859338301037
Energy: 1.788282459425812
Energy: 1.8898548214372093
Energy: 1.8217775203697735
Energy: 1.9242925162897015
Energy: 1.858497992580216
Energy: 1.7896297984322491
Energy: 1.9275176186660743
Energy: 1.8142680366110273
Energy: 1.813330386010288
Energy: 1.910144257787316
Energy: 1.936688955735126
Energy: 1.8485865912032353
Energy: 1.8114270984140435
Energy: 1.834629493811821
Energy: 1.8916860896369627
Energy: 1.7912214639361501
Energy: 1.8229820549937366
Energy: 1.8247079806877269
Energy: 1.8089915834747665
Energy: 1.9078113805481574
Energy: 1.8096259112902287
Energy: 1.82204074216397
Energy: 1.8238698972281027
Energy: 1.8096824143417403
Energy: 1.8240040361064267
Energy: 1.8764677268437657
Energy: 1.8246133020620459
Energy: 1.881815286093126
Energy: 1.8563400341770429
Energy: 1.8282807967004913
Energy: 1.8600667698281752
Energy: 1.8357061027889692
Energy: 1.8775814344567379
Energy: 1.8572600475104042
Energy: 1.828845876837561
Energy: 1.85886310374672
Energy: 1.8362807191521238
Energy: 1.8383205620931957
Energy: 1.922450713140998
Energy: 1.895091402800454
Energy: 1.9089582319041676
Energy: 1.8379888911865616
Energy: 1.8383135453106725
Energy: 1.9222217014606329
Energy: 1.883220930906332
Energy: 1.9078201365622076
Energy: 1.8369141189116316
Energy: 1.9346325403523525
Energy: 1.9879451156378372
Energy: 1.8213186987352492
Energy: 1.9090194955061062
Energy: 1.824784711733824
Energy: 1.935228836582671
Energy: 1.9767372007382806
Energy: 1.8230766739984323
Energy: 1.9109830444724591
Energy: 1.7901732080050026
Energy: 1.8355341601570714
Energy: 1.8224308277195673
Energy: 1.8230508358785615
Energy: 1.9070649853633128
Energy: 1.7876805621652612
Energy: 1.8371791308389924
Energy: 1.8215717413219372
Energy: 1.82309585207936
Energy: 2.005380294049579

minimum gb energy = 1.7863659987363787 eV
minimum distance =  2.33971011153912 Angstroms
sigma value = 293


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

Energy: 1.8425231441946162
Energy: 1.737541383726774
Energy: 1.8776849747242725
Energy: 1.7596631317075073
Energy: 1.7376064841730834
Energy: 1.7382096155814282
Energy: 1.7585400255922825
Energy: 1.877256673230605
Energy: 1.758090697955917
Energy: 1.738101882289402
Energy: 1.7374345066307955
Energy: 1.7601175106937426
Energy: 1.756675554421673
Energy: 1.7568987252279409
Energy: 1.7566583287620443
Energy: 1.8808236213727472
Energy: 1.7608070222984957
Energy: 1.738468738828383
Energy: 1.758088942433206
Energy: 1.7574699640245566
Energy: 1.7584381985505375
Energy: 1.7601273018991193
Energy: 1.7605557424493223
Energy: 1.880630867070623
Energy: 1.8815993709718861
Energy: 1.757297200812898
Energy: 1.7589243924319702
Energy: 1.7617904999680243
Energy: 1.8782284737968495
Energy: 1.8811997123072488
Energy: 1.8783352870573777
Energy: 1.7374682317216672
Energy: 1.7388676456074983
Energy: 1.7562399785183616
Energy: 1.8797862595591215
Energy: 1.8772923816604865
Energy: 1.7374760365819442
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Energy: 1.757420938986548
Energy: 1.7802261135156412
Energy: 1.7577160964961078
Energy: 1.7401096999860648
Energy: 1.737500596831854
Energy: 1.8805932018609994
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Energy: 1.7570915196464025
Energy: 1.737983271154477
Energy: 1.7374896292005408
Energy: 1.7602498866560823
Energy: 1.7593148241438155
Energy: 1.758432393828147
Energy: 1.878559514130615
Energy: 1.7575003801903288
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Energy: 1.7378906697984418
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Energy: 1.758261713433165
Energy: 1.7629386087089995
Energy: 1.7381659667375606
Energy: 1.8785597619107388
Energy: 1.7800345781263243
Energy: 1.756674891183673
Energy: 1.758983417070647
Energy: 1.7601320570955108
Energy: 1.8782007878824891
Energy: 1.7798054784391368
Energy: 1.7562676565010336
Energy: 1.759710903751674
Energy: 1.7595159881831075
Energy: 1.7581067537274502
Energy: 1.8795618145501591
Energy: 1.7605716045914963
Energy: 1.7379421678559712
Energy: 1.7387260003104554
Energy: 1.7585870009853992
Energy: 1.8830493265955248
Energy: 1.761250430496657
Energy: 1.7382063182704388
Energy: 1.738165621104726
Energy: 1.7609764776137469
Energy: 1.7386213782739155
Energy: 1.7558446013144058
Energy: 1.739934082181702
Energy: 1.8809882123197093
Energy: 1.760325031072327
Energy: 1.756985540035383
Energy: 1.7557101934144774
Energy: 1.7374485508751456
Energy: 1.8822254685047004
Energy: 1.7632806820227773
Energy: 1.7619549889229464
Energy: 1.8829860856919722
Energy: 1.8792656750922545
Energy: 1.7589520463381494
Energy: 1.7613563255818332
Energy: 1.7643572640644425
Energy: 1.8839052188029914
Energy: 1.7582330874524255
Energy: 1.7605286111032317
Energy: 1.7373689517498063
Energy: 1.757054269882888
Energy: 1.7594309027851962
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Energy: 1.8817839475186797
Energy: 1.7371271621717204
Energy: 1.7567519892052483
Energy: 1.7795072504282896
Energy: 1.8781240289875065
Energy: 1.8816721761778803
Energy: 1.7375126196096105
Energy: 1.7584412890839494
Energy: 1.8773737336593326
Energy: 1.7583018289543204
Energy: 1.737539877598774
Energy: 1.7372867182673764
Energy: 1.7588365747659551
Energy: 1.8773078268817722
Energy: 1.7582503187782101
Energy: 1.737818240162873
Energy: 1.8805367385098908
Energy: 1.759794872124271
Energy: 1.7566277642562498
Energy: 1.7567460711404435
Energy: 1.7570703422384826
Energy: 1.8811568068168778
Energy: 1.7606858613436376
Energy: 1.738434336655994
Energy: 1.7579466324134274
Energy: 1.7569219888123457
Energy: 1.7588008857421455
Energy: 1.7604456670074857
Energy: 1.762867274952349
Energy: 1.8774845633512995
Energy: 1.8793300096543688
Energy: 1.7578162726473752
Energy: 1.7591863285488918
Energy: 1.7609395517589623
Energy: 1.877528041343949
Energy: 1.8817481132872103
Energy: 1.8787969764492738
Energy: 1.7372577641951696
Energy: 1.7389639943739843
Energy: 1.7560343465195538
Energy: 1.8799384350571902
Energy: 1.878330220704131
Energy: 1.7371843467695782
Energy: 1.7386167803928616
Energy: 1.7572328475491032
Energy: 1.8806584573797842
Energy: 1.7578677359281185
Energy: 1.739567322989644
Energy: 1.737845611654132
Energy: 1.761628006697728
Energy: 1.7605437766782432
Energy: 1.7573789921447938
Energy: 1.7380369835267502
Energy: 1.738089222795759
Energy: 1.7610766756623364
Energy: 1.7598173643194053
Energy: 1.7590564751230768
Energy: 1.8785457592905441
Energy: 1.7574006931790593
Energy: 1.7596461424848695
Energy: 1.7379865947410431
Energy: 1.7594929468999279
Energy: 1.8772050667114533
Energy: 1.758098250509449
Energy: 1.7626150518795833
Energy: 1.7377296852017061
Energy: 1.87823488478677
Energy: 1.7801905545300558
Energy: 1.7568162805897607
Energy: 1.7592527663950324
Energy: 1.7610577426750726
Energy: 1.8782012574227898
Energy: 1.7800875647108263
Energy: 1.7566169699706555
Energy: 1.7594953479627584
Energy: 1.7606368853634204
Energy: 1.7579361063567092
Energy: 1.8800553533331863
Energy: 1.762336576570651
Energy: 1.7375129537952172
Energy: 1.7393755646069708
Energy: 1.758493665371942
Energy: 1.883023924006662
Energy: 1.7611627472596703
Energy: 1.7377037680504794
Energy: 1.7391125585148037
Energy: 1.76132440831364
Energy: 1.73837492987054
Energy: 1.75614648919332
Energy: 1.7404971540839076
Energy: 1.8822017901301509
Energy: 1.7603695213825163
Energy: 1.7568062118498855
Energy: 1.7559255318725315
Energy: 1.7373882472140814
Energy: 1.7601492880883554
Energy: 1.763079945824542
Energy: 1.76109179107302
Energy: 1.882812047367012
Energy: 1.7594149235168068
Energy: 1.7595354240262564
Energy: 1.7611590276276763
Energy: 1.7612831046786257
Energy: 1.8826588920119667
Energy: 1.7585043718438047
Energy: 1.7609387835789114
Energy: 1.7373058594568005
Energy: 1.7570581605688183
Energy: 1.7598917844927677
Energy: 1.8782204862400138
Energy: 1.8831153057088799
Energy: 1.7371399421392495
Energy: 1.7566993033482856
Energy: 1.779572556977697
Energy: 1.8777718365419562
Energy: 1.8812693722310327

minimum gb energy = 1.7371271621717204 eV
minimum distance =  2.33593048060829 Angstroms
sigma value = 15


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

Energy: 1.7605666361428838
Energy: 1.9230263593560448
Energy: 1.9453636518928163
Energy: 1.8466617880171385
Energy: 1.939751512608191
Energy: 1.741877987850266
Energy: 2.0361131597564714
Energy: 1.9603946525985325
Energy: 1.8458013821699972
Energy: 1.7734926773658215
Energy: 1.7216014611227073
Energy: 1.8898776870664131
Energy: 1.7662882239051776
Energy: 1.7652244958087109
Energy: 1.771046246219362
Energy: 1.729875784954691
Energy: 1.8886476922737825
Energy: 1.768283113944206
Energy: 1.9121858759119317
Energy: 1.8419226586165227
Energy: 1.9531581892255818
Energy: 1.7752581819286537
Energy: 1.7363229480131224
Energy: 1.8385460696557985
Energy: 1.7570697252253191
Energy: 1.941494526544794
Energy: 1.8322871071723275
Energy: 1.7355053492937185
Energy: 1.820078188857536
Energy: 1.742639607834158
Energy: 1.7430033324575824
Energy: 1.7319733759296783
Energy: 1.8489088984753241
Energy: 1.9400678724825593
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Energy: 1.7574958521922233
Energy: 1.8358284754978462
Energy: 1.8487032168532689
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Energy: 2.0121149862335206
Energy: 1.8771585483658095
Energy: 1.9048148858622436
Energy: 1.7378350626745722
Energy: 1.9636050018899764
Energy: 1.9885697116790497
Energy: 1.8732433409739249
Energy: 1.8559808240318805
Energy: 1.8915250828989807
Energy: 1.9624960628531398
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Energy: 1.7355668337457566
Energy: 1.7360828936904946
Energy: 2.030797330118907
Energy: 2.116912365103045
Energy: 1.7524116763517579
Energy: 1.7356662402425462
Energy: 1.7370349436303192
Energy: 2.0499106040972848
Energy: 2.1257348259393267
Energy: 1.7369706219722334
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Energy: 1.7365875970287104
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Energy: 2.0373203216531275
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Energy: 1.7432872579029814
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Energy: 1.778310976583114
Energy: 2.036193063698787
Energy: 1.7387497091189235
Energy: 1.7429108414551033
Energy: 1.7677190270167953
Energy: 1.904977589434586
Energy: 2.0097498309059625
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Energy: 1.7402437459285909
Energy: 1.7972538069032655
Energy: 1.90868359094193
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Energy: 1.7433419137710409
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Energy: 1.945424701489301
Energy: 1.729851495091583
Energy: 1.7363008281657673
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Energy: 2.121164207697756
Energy: 1.9371322400911737
Energy: 1.7674596668072515
Energy: 1.7363343616014573
Energy: 1.876751856266413
Energy: 1.8037878957346418
Energy: 1.7698479131580718
Energy: 1.7353611940925764
Energy: 1.7606555074733568
Energy: 1.7743538817361104
Energy: 1.8061295435396068
Energy: 1.7685044296408874
Energy: 1.7374461054028674
Energy: 1.7612673252673712
Energy: 1.8556598291064859
Energy: 1.8504653306923955
Energy: 1.7597484492476774
Energy: 1.7558512098719794
Energy: 1.7580956112262622
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Energy: 1.8465056224640422
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Energy: 1.7561380757272143
Energy: 1.7556199157161663
Energy: 1.9964421978766627
Energy: 1.9122117856360759
Energy: 1.7874462316946984
Energy: 1.730584360409281
Energy: 1.9894615337090085
Energy: 1.9815154796764956
Energy: 1.8773717467135265
Energy: 1.733344289573385
Energy: 1.7441816957288436
Energy: 1.9953641993499691
Energy: 1.9552225575135618
Energy: 2.0510936178227572
Energy: 1.7397876904922045
Energy: 1.9776695528158974
Energy: 1.8866513804562657
Energy: 1.9054797758940516
Energy: 2.02567527406925
Energy: 1.7397605331770951
Energy: 1.9623217957167278
Energy: 1.8487615128136639
Energy: 1.7673137086896757
Energy: 1.91505026855885
Energy: 1.9783860044311954
Energy: 1.871356996927554
Energy: 1.9107640523193572
Energy: 1.7675201878271454
Energy: 1.9106290954811809
Energy: 1.7195173231152592
Energy: 1.8733129638534016
Energy: 1.9133676817636545
Energy: 1.8077130702739475
Energy: 1.898675387386929
Energy: 1.9831211258013244
Energy: 1.984751330033906
Energy: 1.884968970135054
Energy: 1.8156328298333761
Energy: 1.8998645578037265
Energy: 1.9878103514611438
Energy: 1.9479409927097857
Energy: 1.882014348390353
Energy: 2.026541984046362
Energy: 1.985604805174908
Energy: 1.758514068276057
Energy: 1.9079825158794845
Energy: 1.8797595802876519
Energy: 1.9865211625167167
Energy: 1.984038774710607
Energy: 1.75833830305519
Energy: 1.769105201754094
Energy: 1.9110769634955067
Energy: 1.8590529998292273
Energy: 1.8935126885416051
Energy: 1.9382942244384402
Energy: 2.028736144420041
Energy: 1.915252919012655
Energy: 1.8625919932926658
Energy: 1.8941982629909164
Energy: 1.8482456352323835
Energy: 2.030710449828811
Energy: 1.9217305729862315
Energy: 2.031937118336165
Energy: 2.1542282265948147
Energy: 2.1599012366977237
Energy: 1.8320209481935559
Energy: 1.7424459907057068
Energy: 2.031652771530582
Energy: 2.1542536838543667
Energy: 2.152678921274281
Energy: 1.8187755331366444
Energy: 1.7443124889301587
Energy: 1.7449068146219262
Energy: 1.8205500689233465
Energy: 1.783421026002709
Energy: 1.73960363604981
Energy: 1.737991199907994
Energy: 1.7399068006276177
Energy: 1.7382989860420555
Energy: 1.744197187634126
Energy: 1.7410483599272504
Energy: 1.7442722578195622
Energy: 1.7652835959344193
Energy: 1.9046587359257707
Energy: 1.946135206581536
Energy: 1.7379449118073003
Energy: 1.7371930230412442
Energy: 1.7751330404352548
Energy: 1.9007017159145378
Energy: 1.8622780338418412
Energy: 1.7376238120609173
Energy: 1.7409656604422261
Energy: 1.8934683736654145
Energy: 1.8423528176709751
Energy: 1.7698831021294787
Energy: 1.7453857306351388
Energy: 1.7972759994703977
Energy: 1.8583123810653448
Energy: 1.7349472728307591
Energy: 1.7696836760017978
Energy: 1.7283638181361587
Energy: 1.8440331529391967
Energy: 1.7303436340287546
Energy: 1.7284364612582064
Energy: 1.8603275026513713
Energy: 2.1191453051287032
Energy: 1.7379618400253205
Energy: 1.7315486437886831
Energy: 1.7290972390672534
Energy: 1.916376018651732
Energy: 2.117627340647545
Energy: 1.7420028030707548
Energy: 1.7793948892704756
Energy: 1.7615563826689995
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Energy: 1.739524200520131
Energy: 1.7660149359732578
Energy: 1.7614545839704077
Energy: 1.8217059216199494
Energy: 1.82246743611956
Energy: 1.739177760030838
Energy: 1.7416161606157943
Energy: 1.7529252973519165
Energy: 1.9846968015734399
Energy: 1.9845340728813197
Energy: 2.016923866194812
Energy: 1.742646210926254
Energy: 1.7476597663965354
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Energy: 1.9154431488405084
Energy: 2.0172746456998945
Energy: 1.9356915874373053
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Energy: 1.9299606626902472
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Energy: 1.9530367609072372
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Energy: 1.739340561121533
Energy: 1.7380149086484635
Energy: 1.90532615881153
Energy: 1.7669561013212771
Energy: 1.9121617048615138
Energy: 1.9170626057044318
Energy: 1.736597413043234
Energy: 1.9108268908123747
Energy: 1.7658014569823721
Energy: 1.9153039470401962
Energy: 2.007887440039279
Energy: 1.9476315223717517
Energy: 1.8012379498543938
Energy: 1.736522484956642
Energy: 1.779492063326537
Energy: 1.8744903361742258
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Energy: 1.8847369907089784
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Energy: 1.86991119276043
Energy: 1.7591454031821823
Energy: 1.9625271305142429
Energy: 1.8687327513842322
Energy: 1.9740266571426273
Energy: 1.9850127972273333
Energy: 1.764656453823551
Energy: 1.959199752539051
Energy: 1.8480080741669374
Energy: 1.9695526263123124
Energy: 1.9863512951031927
Energy: 1.753220967461222
Energy: 1.877222033638155
Energy: 1.9463990522884356
Energy: 1.738690769058668
Energy: 2.000546491778728
Energy: 1.7601709305015287
Energy: 2.0331492175357657
Energy: 1.9367648047813295
Energy: 1.739820368770508
Energy: 1.98974166396848
Energy: 2.150676423849018
Energy: 1.7378641622922562
Energy: 1.7393326308666588
Energy: 2.0572926078373173
Energy: 2.152306393983996
Energy: 1.9954936533530003
Energy: 1.7376792559629834
Energy: 1.7410660551887223
Energy: 2.0572824677911354
Energy: 2.1526884064963507
Energy: 1.7380254779130315
Energy: 1.7369848368205303
Energy: 1.7415222962899972
Energy: 1.760650745301062
Energy: 2.0755004791195777
Energy: 1.7392450546428126
Energy: 1.7408141175732275
Energy: 1.742835815584536
Energy: 1.784471923208963
Energy: 2.000578782458865
Energy: 1.739175140119252
Energy: 1.7406893209474275
Energy: 1.7463202916460174
Energy: 1.734580452164454
Energy: 1.8970503348748127
Energy: 1.7391193045342215
Energy: 1.7391310581226267
Energy: 1.746260994310949
Energy: 1.7960658730394778
Energy: 1.896049486034434
Energy: 1.8558553926101105
Energy: 1.737874842045567
Energy: 1.9016648199298405
Energy: 1.8970156676155396
Energy: 1.848664092530307
Energy: 1.81087258659093
Energy: 1.7772427393653347
Energy: 1.8964055666037192
Energy: 1.7300662975983676
Energy: 1.8524813041754087
Energy: 1.906396448450709
Energy: 2.1188602506350036
Energy: 1.79688061265511
Energy: 1.7373915950182655
Energy: 1.7358987689573502
Energy: 1.8887962323447114
Energy: 2.1198154495597104
Energy: 1.7967256770593603
Energy: 1.7370203647153784
Energy: 1.7365839035721227
Energy: 2.00642718260963
Energy: 1.7412797455959725
Energy: 1.76329154115539
Energy: 1.7563649422785317
Energy: 1.7590380015473837
Energy: 1.9152491779438705
Energy: 1.742291574260085
Energy: 1.7609912456736874
Energy: 1.7574418626618615
Energy: 1.7584246776187966
Energy: 1.9820710348450077
Energy: 2.016417547991704
Energy: 1.73398113839439
Energy: 1.7300674784477326
Energy: 1.8743115333359281
Energy: 1.9821564107989416
Energy: 2.0078248873432094
Energy: 1.7328616445462164
Energy: 1.7300937238368204
Energy: 1.9166273764030615
Energy: 1.9264245368831845
Energy: 1.8094581894677542
Energy: 1.7365061639268138
Energy: 1.837543201899926
Energy: 1.959196480901939
Energy: 1.8727657742897093
Energy: 1.7336942418181684
Energy: 1.73739249367433
Energy: 1.9464206583542978
Energy: 1.9261179591068578
Energy: 1.7672937994495952
Energy: 1.916070425034011
Energy: 1.9170200253869933
Energy: 1.738882121590645
Energy: 1.7735303231448676
Energy: 1.7665835842555921
Energy: 1.9177859922173106
Energy: 1.8357272565333498
Energy: 1.7384954416815048
Energy: 1.7732768647468935
Energy: 1.8085823325522214
Energy: 1.8564581774579392
Energy: 1.729954806328234
Energy: 1.9174482375972453
Energy: 1.8434084903125059
Energy: 1.813727955112501
Energy: 1.8718409545640782
Energy: 1.7309431540907607
Energy: 1.7588962867755267
Energy: 1.87719997279789
Energy: 2.041225842576904
Energy: 1.987286307047965
Energy: 1.984055970949203
Energy: 1.9621769738613484
Energy: 1.8025853097562914
Energy: 1.9787106011888127
Energy: 1.9855620918506816
Energy: 1.984558170494693
Energy: 1.96117647330776
Energy: 1.8037331389151992
Energy: 1.737404476166871
Energy: 2.0266369495867846
Energy: 1.9628487189379333
Energy: 1.8240814237915126
Energy: 1.9374317170504667
Energy: 1.7378796260980538
Energy: 2.02006425264789
Energy: 1.8418014716203086
Energy: 1.8538618269984026
Energy: 1.9235666715931437
Energy: 2.0287840468483385
Energy: 2.1523961574334707
Energy: 2.1551815338950164
Energy: 1.8184956912168797
Energy: 1.7418237152854206
Energy: 1.9714297572651507
Energy: 2.1583234648034693
Energy: 2.1548074159910175
Energy: 2.0154197880927742
Energy: 1.7362038594406157
Energy: 1.7413871672924475
Energy: 1.744231472990813
Energy: 1.8920040665768159
Energy: 1.7371717692076112
Energy: 1.7393026160684848
Energy: 1.7404736750867114
Energy: 1.8178085173872527
Energy: 1.7382110561320478
Energy: 1.7383171223438696
Energy: 1.7421210158569564
Energy: 1.7824849200964863
Energy: 1.839546370680554
Energy: 1.884235271164426
Energy: 1.7348022416797086
Energy: 1.735364568166523
Energy: 1.8517376718039706
Energy: 1.898455184178984
Energy: 1.8435316972863327
Energy: 1.7362600930717738
Energy: 1.7370992783183286
Energy: 1.8927292277976497
Energy: 1.7409038070641842
Energy: 1.9259879691669328
Energy: 1.807667478220922
Energy: 1.8416130834793585
Energy: 1.8684711083456473
Energy: 1.7334185287485797
Energy: 1.8521975494231413
Energy: 1.8104447550323635
Energy: 1.8733124444387323
Energy: 1.7414460767834212
Energy: 1.7406928087614526
Energy: 1.9198728268717251
Energy: 2.1141483783409947
Energy: 1.7420372966313018
Energy: 1.7548579166221427
Energy: 1.7266536413908498
Energy: 1.961937057093141
Energy: 2.1613950278329384
Energy: 1.7431417284753434
Energy: 1.7609587687522443
Energy: 1.7432062245781448
Energy: 1.7515644759403945
Energy: 1.7387549177781554
Energy: 1.728654808099411
Energy: 1.7622762003871688
Energy: 1.7557955099075926
Energy: 1.779161275711455
Energy: 1.7415510670714591
Energy: 1.745348833849306
Energy: 1.7532787419180345
Energy: 1.8872471240610194
Energy: 1.9836978333065542
Energy: 1.981605630123138
Energy: 1.9818572256625928
Energy: 1.7369700069453482
Energy: 1.8014784542977074
Energy: 1.9819780464930292
Energy: 2.0125292655686238
Energy: 1.9735077935919334
Energy: 1.7710099995979187
Energy: 2.030909575841867
Energy: 1.7431706593632523
Energy: 1.8627018943003524
Energy: 1.7198264838071644
Energy: 1.7370045754165302
Energy: 2.020484784526457
Energy: 1.737086560337679
Energy: 1.8937297248199931
Energy: 1.7265440555152773

minimum gb energy = 1.7190353801143832 eV
minimum distance =  2.29670523538324 Angstroms
sigma value = 437


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

Energy: 1.7952788206381263
Energy: 1.7824252651903976
Energy: 1.8523974262201166
Energy: 1.9994628831093626
Energy: 1.7826866084942599
Energy: 1.7712736860944656
Energy: 1.7049266296836394
Energy: 1.8522316254937323
Energy: 2.00851170174855
Energy: 1.919857338399139
Energy: 1.5875793654802453
Energy: 1.8543181076393145
Energy: 1.8237270814196784
Energy: 1.9411595387395326
Energy: 1.6516485247312591
Energy: 1.6072157184230744
Energy: 1.8536901969176844
Energy: 1.9575671008270348
Energy: 1.8592497301253748
Energy: 1.655206311027657
Energy: 1.7608000012329441
Energy: 1.7845288115024265
Energy: 1.6795691534018924
Energy: 1.6598280487741823
Energy: 1.6504208811008023
Energy: 1.772199968092143
Energy: 1.7825835363747466
Energy: 1.6791366931311669
Energy: 1.6579465519205332
Energy: 1.5815903221722574
Energy: 1.6588932831880587
Energy: 1.6493648726319936
Energy: 1.877698293402488
Energy: 1.7594852207854892
Energy: 1.790410005131232
Energy: 1.6580010146529447
Energy: 1.65652941463695
Energy: 1.87669020689792
Energy: 1.7620562139996692
Energy: 1.7913231914714758
Energy: 1.9301528081475825
Energy: 1.8571934819607652
Energy: 1.6631935059440208
Energy: 1.667600557568507
Energy: 2.0166589729838016
Energy: 1.7807590351976563
Energy: 1.8570442739109085
Energy: 1.6553280702336435
Energy: 1.6546597234868219
Energy: 1.7761877245933744
Energy: 1.6894899200758522
Energy: 1.66262672435479
Energy: 1.6810157140871729
Energy: 1.7747792613187903
Energy: 1.770729378842982
Energy: 1.6905388152988385
Energy: 1.648401040185894
Energy: 1.7871856988516486
Energy: 1.7740622839177154
Energy: 1.7709839758333044
Energy: 1.7766406354138105
Energy: 1.7576016252496152
Energy: 1.7658060845650996
Energy: 1.6498972696228624
Energy: 1.6831917185813146
Energy: 1.7737349649748537
Energy: 1.7678268116627778
Energy: 1.7657537930583833
Energy: 1.8296914182896824
Energy: 1.6832279998995492
Energy: 1.7854673242332226
Energy: 1.5848225689162414
Energy: 1.6498311999024693
Energy: 1.8319681319882333
Energy: 1.8482618218040743
Energy: 1.784733333664113
Energy: 1.5837519902219344
Energy: 1.648634294007934
Energy: 1.832394141791165
Energy: 1.8490166785772735
Energy: 1.6564681578353895
Energy: 1.8790861432305155
Energy: 1.8570956792909115
Energy: 1.6790123060920128
Energy: 1.657253076506459
Energy: 1.657049462568279
Energy: 1.886327437522697
Energy: 1.8548395729602487
Energy: 2.0634137616014088
Energy: 1.6571539691205133
Energy: 1.7094792405829498
Energy: 1.8533179948199971
Energy: 1.5868240135015481
Energy: 1.8106224094536916
Energy: 1.8536340103359483
Energy: 1.6287823620129536
Energy: 1.660705810927382
Energy: 1.586005697905161
Energy: 1.9971100965383357
Energy: 1.8534590397203456
Energy: 1.6029633282319637
Energy: 1.5805076941774685
Energy: 1.853334808198307
Energy: 1.7689807260051513
Energy: 1.6163814675853478
Energy: 1.6034543379827464
Energy: 1.5826326745367307
Energy: 1.8524359812031421
Energy: 1.7700375322293997
Energy: 1.6604538238832691
Energy: 1.5925864993178986
Energy: 1.598750465812709
Energy: 1.5931381020954887
Energy: 1.8504180497251288
Energy: 1.59464447670867
Energy: 1.5879563651854323
Energy: 1.5852824259986684
Energy: 1.5948721737479947
Energy: 1.8989550229018752
Energy: 1.590557867959981
Energy: 1.6062499835284325
Energy: 1.602941863419782
Energy: 1.855202321738782
Energy: 1.8573184031861931
Energy: 1.8583746337732219
Energy: 1.5909768515869616
Energy: 1.6469273375289057
Energy: 1.8575950878594152
Energy: 1.8560296115144457
Energy: 1.5923954546314327
Energy: 1.6949452892688737
Energy: 1.7089806137147976
Energy: 1.8518527856381837
Energy: 1.6058377879012409
Energy: 1.6158183802638277
Energy: 1.9625158073495537
Energy: 1.7086382175820485
Energy: 2.040490832249586
Energy: 1.6085999153939763
Energy: 1.6890355575581373

minimum gb energy = 1.5805076941774685 eV
minimum distance =  2.34632972475371 Angstroms
sigma value = 33