Model name: model_name=EAM_Dynamo_Marinica_2007_Fe__MO_466808877130_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855279721319676
cohesive_energy=4.12272209665705
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.014455709976999735
Energy: 0.01481976720999835
Energy: 0.01473444934669372
Energy: 1.886864450753025
Energy: 0.014734449345061235
Energy: 0.014819767210472299
Energy: 0.014455709976999735
Energy: 0.01481976720999835
Energy: 0.014734449345061235
Energy: 1.5313348809098284
Energy: 0.8249280863495346
Energy: 0.014872469898155551
Energy: 0.016740864105348818
Energy: 0.8168681497833199
Energy: 0.01674086410511184
Energy: 0.014872469898392525
Energy: 0.8249280863509039
Energy: 0.014872469898392525
Energy: 0.016740864105348818
Energy: 0.816868149783083
Energy: 0.014455709976999735
Energy: 0.01481976720999835
Energy: 0.014734449346456749
Energy: 1.8868626057962958
Energy: 0.014734449345061235
Energy: 0.014819767210472299
Energy: 0.014455709976762762
Energy: 0.014819767210235325
Energy: 0.014734449345298209
Energy: 1.5313348809070637
Energy: 0.8249280863502193
Energy: 0.014872469898155551
Energy: 0.016740864105348818
Energy: 0.816868149783083
Energy: 0.016740864104874867
Energy: 0.014872469898155551
Energy: 0.8249280863502193
Energy: 0.014872469898392525
Energy: 0.016740864104874867
Energy: 0.8168681497837675
Energy: 0.014455709977210381
Energy: 0.014819767210472299
Energy: 0.014734449346904365
Energy: 1.5313348809091438
Energy: 0.014734449345061235
Energy: 0.014819767209761376
Energy: 0.014455709976999735
Energy: 0.014819767210235325
Energy: 0.014734449345535182
Energy: 1.531334880908907
Energy: 0.8249280863499824
Energy: 0.014872469898155551
Energy: 0.01674086410558579
Energy: 0.8168681497837675
Energy: 0.01674086410511184
Energy: 0.014872469898155551
Energy: 0.8249280863502193
Energy: 0.014872469898629498
Energy: 0.01674086410511184
Energy: 0.8168681497833199
Energy: 0.014455709976999735
Energy: 0.014819767209761376
Energy: 0.014734449346456749
Energy: 1.531334880909618
Energy: 0.014734449344587288
Energy: 0.014819767210472299
Energy: 0.014455709976999735
Energy: 0.014819767210682941
Energy: 0.014734449345298209
Energy: 2.0552823330893806

minimum gb energy = 0.014455709976762762 eV
minimum distance =  2.2587399724004 Angstroms
sigma value = 3


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

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Energy: 1.425537615060377
Energy: 1.528503888012308
Energy: 1.5057215983559407
Energy: 1.60664938863918
Energy: 1.4221760974340385
Energy: 1.5712767777462486
Energy: 1.4255376151290524
Energy: 1.5285038880151458
Energy: 1.4351166541991967
Energy: 1.4917943260575657
Energy: 1.353406645587958
Energy: 1.50385713240557
Energy: 1.5050099888790114
Energy: 1.433095581451746
Energy: 1.3887276860710511
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Energy: 1.5038571324015972
Energy: 1.5050099888676602
Energy: 1.43889043830174
Energy: 1.4197778422662009
Energy: 1.4086795664170428
Energy: 1.4371663355490822
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Energy: 1.4388904382994698
Energy: 1.3966061021533966
Energy: 1.4086795668085086
Energy: 1.4371663355490822
Energy: 1.4740600742500272
Energy: 1.4193922873831444
Energy: 1.39233787187538
Energy: 1.416647219376081
Energy: 1.3802328567028261
Energy: 1.3650188057457036
Energy: 1.474060074255135
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Energy: 1.4150586161029886
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Energy: 1.3538015066709097
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Energy: 1.4680021542871715
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Energy: 1.3606032521583762
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Energy: 1.3414703205946632
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Energy: 1.433169611087199
Energy: 1.392609752437257
Energy: 1.4364545676699554
Energy: 1.3612773967858827
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Energy: 1.3365324274206432
Energy: 1.4876276509976603
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Energy: 1.5153203990925008
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Energy: 1.5153203990987438
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Energy: 1.3922895100765722
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Energy: 1.3606032525407608
Energy: 1.4666825951919154
Energy: 1.3507903455766475
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Energy: 1.3820920306302362
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Energy: 1.4631236926248141
Energy: 1.3912234403161587
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Energy: 1.3820920306489655
Energy: 1.3857568172236212
Energy: 1.3848917246111079
Energy: 1.4170948722973595
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Energy: 1.3794502481726958
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Energy: 1.4106750332012925
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Energy: 1.4170948722973595
Energy: 1.5192212232973377
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Energy: 1.3954713286430145
Energy: 1.4259657738952725
Energy: 1.4016196292736738
Energy: 1.4092608324753289
Energy: 1.5344677457375042
Energy: 1.3796276959589993
Energy: 1.3954713286492577
Energy: 1.4259657742782246
Energy: 1.4016196292867278
Energy: 1.4092608324753289
Energy: 1.4158801587403915
Energy: 1.4107629422630532
Energy: 1.4221609502611259
Energy: 1.4753247255081843
Energy: 1.3652577244757003
Energy: 1.3773347104317988
Energy: 1.4158801587420942
Energy: 1.4107629422636212
Energy: 1.4221609502679364
Energy: 1.4753247255036437
Energy: 1.4371663355530553
Energy: 1.4058583951205488
Energy: 1.4138414239861619
Energy: 1.4340519852694045
Energy: 1.3590324314368474
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Energy: 1.4371663355513524
Energy: 1.4058583951301977
Energy: 1.4088449212593348
Energy: 1.434051985276783
Energy: 1.5034971302118214
Energy: 1.502779389152499
Energy: 1.382856782376871
Energy: 1.4948831952275288
Energy: 1.3921350621824724
Energy: 1.4331110480976974
Energy: 1.5034971302050109
Energy: 1.5027793891252559
Energy: 1.3828567823802764
Energy: 1.4948831952354742
Energy: 1.4349314835211842
Energy: 1.6066493886431528
Energy: 1.4221760974351734
Energy: 1.5712767777729242
Energy: 1.4255376151222414
Energy: 1.528503888034443
Energy: 1.4349314835846998
Energy: 1.6066493886448556
Energy: 1.4221760974402817
Energy: 1.5712767777712215
Energy: 1.505009988847228
Energy: 1.4330955814551516
Energy: 1.3887276860767268
Energy: 1.4917943389276365
Energy: 1.3534066598156458
Energy: 1.5038572092879303
Energy: 1.5050099888699304
Energy: 1.4330955814534487
Energy: 1.3887276860795645
Energy: 1.49179434445841
Energy: 1.4371663355513524
Energy: 1.4452411501094946
Energy: 1.3663759002521751
Energy: 1.4388904382909564
Energy: 1.3966061021465856
Energy: 1.4086795665883964
Energy: 1.4371663355519202
Energy: 1.4452411500589812
Energy: 1.3459974344134311
Energy: 1.4388904383023076
Energy: 1.4166472193834596
Energy: 1.3802328568202604
Energy: 1.3650188057502441
Energy: 1.474060074244919
Energy: 1.4193922873871172
Energy: 1.3923378718782178
Energy: 1.4166472193755135
Energy: 1.3802328568996682
Energy: 1.365018805750812
Energy: 1.4740600742511623

minimum gb energy = 1.3365324274206432 eV
minimum distance =  2.23228910878495 Angstroms
sigma value = 75


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

Energy: 1.8077089890165636
Energy: 1.505896270546989
Energy: 1.5671474070020368
Energy: 1.505289816880812
Energy: 1.573013557428787
Energy: 1.6886385654408256
Energy: 1.8077089890168407
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minimum gb energy = 1.3923822500176317 eV
minimum distance =  2.20987746525071 Angstroms
sigma value = 105


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

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Energy: 1.4739091578270378
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Energy: 1.525197808200761
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Energy: 1.4416363389300275
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Energy: 1.5057987384197284
Energy: 1.4350975901626353
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Energy: 1.4616987424242414
Energy: 1.4467691694701212
Energy: 1.4350975901670093
Energy: 1.4403085432202505
Energy: 1.6697687194038286
Energy: 1.4307150477978567
Energy: 1.6975065766929545
Energy: 1.573340211090211
Energy: 1.4396420646479096
Energy: 1.5570055298969228
Energy: 1.5191974968881437
Energy: 1.4649235440259887
Energy: 1.6975065766945168
Energy: 1.573340211053372
Energy: 1.4396420646616281
Energy: 1.557005529898485
Energy: 1.4125486052188185
Energy: 1.5874754872890742
Energy: 1.6664438075500916
Energy: 1.5871174749082486
Energy: 1.5050976832064988
Energy: 1.5251006073517792
Energy: 1.4125486117061274
Energy: 1.5874754885160907
Energy: 1.6664438075500916
Energy: 1.587117474910748
Energy: 1.5732968915595322
Energy: 1.4673280421732429
Energy: 1.5020605415397112
Energy: 1.470718513741062
Energy: 1.3831194143443195
Energy: 1.5170498080798862
Energy: 1.5732968915582823
Energy: 1.467328042238485
Energy: 1.5020605415437729
Energy: 1.4707185137394998
Energy: 1.4381756916774977
Energy: 1.4677694404450154
Energy: 1.4410318703895597
Energy: 1.4499804240193956
Energy: 1.6748906013715807
Energy: 1.372817564676952
Energy: 1.4381756916962152
Energy: 1.4677694407644941
Energy: 1.4410318703071336
Energy: 1.4499804240212704
Energy: 1.4364948671717883
Energy: 1.5176249616096475
Energy: 1.472264803716789
Energy: 1.4017804971594077
Energy: 1.6154873892410624
Energy: 1.4332411888073575
Energy: 1.4364948671677265
Energy: 1.5176249616102724
Energy: 1.4722648037155392
Energy: 1.401780497160657
Energy: 1.5228528205324956
Energy: 1.5052890371229366
Energy: 1.4668517187646213
Energy: 1.5192201605255033
Energy: 1.4640119687262902
Energy: 1.6674234838121313
Energy: 1.5228528205499923
Energy: 1.505289037123874
Energy: 1.4668517187668084
Energy: 1.5192201605239413

minimum gb energy = 1.3503898867331166 eV
minimum distance =  2.22085183863126 Angstroms
sigma value = 165


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

Energy: 1.4795371335502066
Energy: 1.825094859548606
Energy: 1.4231232618330305
Energy: 1.5852070867929569
Energy: 1.4065403598111799
Energy: 1.8243255151456041
Energy: 1.4795371325756534
Energy: 1.8250948595475331
Energy: 1.4231232618190868
Energy: 1.5852070867940293
Energy: 1.42548283412107
Energy: 1.4218793806145693
Energy: 1.420712107232557
Energy: 1.474299135405349
Energy: 1.3706706121616121
Energy: 1.375096930247416
Energy: 1.42548283412107
Energy: 1.4219093090233024
Energy: 1.420712104863187
Energy: 1.4742991389154765
Energy: 1.407624227168746
Energy: 1.6184852828866552
Energy: 1.4813469937744554
Energy: 1.4102417002268595
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Energy: 1.3808838336332494
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Energy: 1.4365350647313915
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Energy: 1.4006277744018532
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Energy: 1.4424122646978086
Energy: 1.4580842185398526
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Energy: 1.433444439968093
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Energy: 1.4580842182804055
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Energy: 1.4334444399541495
Energy: 1.4432821975758212
Energy: 1.4714499098837566
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Energy: 1.6175080521371703
Energy: 1.4347810231212297
Energy: 1.5485667716466842
Energy: 1.4714499094409685
Energy: 1.438124490022651
Energy: 1.524376842274208
Energy: 1.6175080521371703
Energy: 1.3830830518667505
Energy: 1.5937192255527612
Energy: 1.428816790708954
Energy: 1.4066070857184785
Energy: 1.3566950289856836
Energy: 1.3730925026390086
Energy: 1.3830830518656776
Energy: 1.5937192255527612
Energy: 1.4288167907110991
Energy: 1.406607085717406
Energy: 1.4071448962984394
Energy: 1.481346993770165
Energy: 1.62409393565821
Energy: 1.4065610076060358
Energy: 1.4820295243982422
Energy: 1.4204645644945795
Energy: 1.4071448963273994
Energy: 1.481346993770165
Energy: 1.62409393565821
Energy: 1.4065610076071084
Energy: 1.4745570802428418
Energy: 1.4238361839923943
Energy: 1.4359002209166578
Energy: 1.4237948871060573
Energy: 1.3774533385791425
Energy: 1.3654353502871948
Energy: 1.4745570761473195
Energy: 1.4238361839956124
Energy: 1.4359028388443018
Energy: 1.4237948871049848
Energy: 1.4434141764249135
Energy: 1.4065403598111799
Energy: 1.8243255151477493
Energy: 1.479537134073391
Energy: 1.8250948595475331
Energy: 1.4231232617879812
Energy: 1.4434141621849979
Energy: 1.4065403598111799
Energy: 1.8243255151477493
Energy: 1.4795371298996174

minimum gb energy = 1.3566950289856836 eV
minimum distance =  2.21847640988732 Angstroms
sigma value = 41


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

Energy: 1.7595087487009398
Energy: 1.4021241603697063
Energy: 1.256169480636314
Energy: 1.4251685750432854
Energy: 1.2634541659048453
Energy: 1.3818912635629288
Energy: 1.7595087477537608
Energy: 1.402124160434173
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Energy: 1.4720243457331401
Energy: 1.3636438773091732
Energy: 1.345712986316486
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Energy: 1.4020037379536787
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Energy: 1.249406639991487
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Energy: 1.35953899880537
Energy: 1.3250982308462989
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Energy: 1.5598154457407583
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Energy: 1.453775011184638
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Energy: 1.4443754794180244
Energy: 1.296089652031496
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Energy: 1.2707736856917948
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Energy: 1.433985174825289
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Energy: 1.2833814457700232
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Energy: 1.3551432883758534
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Energy: 1.4103911233919264
Energy: 1.3132767263824543
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Energy: 1.4103911233798576
Energy: 1.3132767263787086
Energy: 1.308511860098202
Energy: 1.4818868941703764
Energy: 1.2940684421582345
Energy: 1.3854385628279653
Energy: 1.354648541360424
Energy: 1.2518821529891835
Energy: 1.3038772551097977
Energy: 1.453785026424164
Energy: 1.294068441956511
Energy: 1.3854385628342074
Energy: 1.3546485411411835
Energy: 1.251882153109832
Energy: 1.2488514868347447
Energy: 1.4811992419546414
Energy: 1.3260042565058572
Energy: 1.3586068830967246
Energy: 1.2690359508638276
Energy: 1.3992595167493347
Energy: 1.24885148682767
Energy: 1.4811992419542253
Energy: 1.327835563877961
Energy: 1.3586068839765233
Energy: 1.2895653032803915
Energy: 1.3411790980023244
Energy: 1.3574232638045056
Energy: 1.3645449613924496
Energy: 1.3244795670123464
Energy: 1.3942356107398821
Energy: 1.2895653032887147
Energy: 1.3411790980048217
Energy: 1.3574232637754122
Energy: 1.364544972669122
Energy: 1.2878572863800333
Energy: 1.4606977663041127
Energy: 1.3431337836249821
Energy: 1.3061635068725428
Energy: 1.444293386212443
Energy: 1.2685640760367198
Energy: 1.2878572863829463
Energy: 1.460697766307442
Energy: 1.3431337836199881
Energy: 1.3061635068721267
Energy: 1.4450061948460022
Energy: 1.298677242415705
Energy: 1.3360979476027581
Energy: 1.2582172732957873
Energy: 1.2499043313076594
Energy: 1.2717169442803709
Energy: 1.4450061948451698
Energy: 1.298677242410295
Energy: 1.3360979477054737
Energy: 1.2582172728773202
Energy: 1.3717930804672402
Energy: 1.2689677243726314
Energy: 1.4709173597493157
Energy: 1.3783950345705405
Energy: 1.36622818534421
Energy: 1.4435115198085304
Energy: 1.3717930804651595
Energy: 1.2689682785678034
Energy: 1.470917359746403
Energy: 1.3784304458401238
Energy: 1.3479394620450738
Energy: 1.2674210066158307
Energy: 1.455555956968659
Energy: 1.4022239187305723
Energy: 1.4437033026079547
Energy: 1.3315745852588468
Energy: 1.3479394620442415
Energy: 1.2674210066095881
Energy: 1.4555559569728205
Energy: 1.402223918740144

minimum gb energy = 1.1922702756870547 eV
minimum distance =  2.24513022293308 Angstroms
sigma value = 185


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

Energy: 1.884776644449412
Energy: 1.4172595640886327
Energy: 1.5860851291811304
Energy: 1.6143821737958595
Energy: 1.5859718912065175
Energy: 1.3220322407755387
Energy: 1.8847766444523764
Energy: 1.4172595640807288
Energy: 1.5860851291756966
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Energy: 1.6526732522583256
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Energy: 1.5871308114114944
Energy: 1.5191867552418508
Energy: 1.3106203189606584
Energy: 1.284322513053999
Energy: 1.3478790935506448
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Energy: 1.5711280628103625
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Energy: 1.283723708836481
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Energy: 1.682726754530598
Energy: 1.4172595640471364
Energy: 1.5860851291826124
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Energy: 1.5854579581703818
Energy: 1.4060839716106004
Energy: 1.682726754530598
Energy: 1.283676361205354
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Energy: 1.632598982284262
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Energy: 1.3844552685718843
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Energy: 1.304683749749781
Energy: 1.2837766110038573
Energy: 1.320818970986101
Energy: 1.5711280628054225
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Energy: 1.3090286895365315
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Energy: 1.3484850717333448
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Energy: 1.4599788443332193
Energy: 1.5409174942629436
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Energy: 1.3484850717363088
Energy: 1.2823218578784235
Energy: 1.4599788443253152
Energy: 1.5409174942693658
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Energy: 1.4913046849565506
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Energy: 1.359267476572061
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Energy: 1.5589958224742364
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Energy: 1.4018233725921916
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Energy: 1.585729042444489
Energy: 1.4018233726726692
Energy: 1.5258045252980492
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Energy: 1.3246332620645824
Energy: 1.292212101402466
Energy: 1.3249364755626416
Energy: 1.6170773122465163
Energy: 1.5586454523033808
Energy: 1.3338932290953298
Energy: 1.3496199945416099
Energy: 1.2922121010928607
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Energy: 1.6170773122529383
Energy: 1.5586454522954767
Energy: 1.6242634221527514
Energy: 1.5117243494571189
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Energy: 1.2902953803881403
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Energy: 1.324640346672639
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Energy: 1.300667451507494
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Energy: 1.8847766444489182
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Energy: 1.8847766444553402
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Energy: 1.5191867552487666
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Energy: 1.2843225133754153
Energy: 1.347879093548175
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Energy: 1.4124513811274368
Energy: 1.5191867552532126
Energy: 1.3106203189591763
Energy: 1.284322513157201
Energy: 1.3478790935486689
Energy: 1.295687341108889
Energy: 1.3592674765745312
Energy: 1.2848944819244088
Energy: 1.5589958224826341
Energy: 1.588188237891162
Energy: 1.3257086861442966
Energy: 1.295687341124203
Energy: 1.359267476573543
Energy: 1.284894481954992
Energy: 1.558995822484116
Energy: 1.3538433283915472
Energy: 1.5857736041329622
Energy: 1.288643050938074
Energy: 1.324545070141122
Energy: 1.3087382510779597
Energy: 1.5228550204148084
Energy: 1.3538433285550173
Energy: 1.5857736041314803
Energy: 1.2886430506324213
Energy: 1.324545070135688
Energy: 1.3246157269298515
Energy: 1.2977641334786016
Energy: 1.5855860020342474
Energy: 1.40182337232552
Energy: 1.5061980864479065
Energy: 1.3051907396021434
Energy: 1.3246157269244176
Energy: 1.2977641334855177
Energy: 1.5855860020327655
Energy: 1.401823372343798
Energy: 1.5586454523018989
Energy: 1.39529508780251
Energy: 1.3479865432063547
Energy: 1.2643149352069676
Energy: 1.4562261516846693
Energy: 1.6083620927038647
Energy: 1.5586454523018989
Energy: 1.3952950879121335
Energy: 1.3479865432088247
Energy: 1.2643149353605125
Energy: 1.3491233684747648
Energy: 1.2902953803323178
Energy: 1.3163327970306569
Energy: 1.6371355699287362
Energy: 1.4533596890647464
Energy: 1.3246403464144105
Energy: 1.3491233684772348
Energy: 1.290295380347138
Energy: 1.3163327970276928
Energy: 1.6371355699267605
Energy: 1.585401281231201
Energy: 1.5711280628123385
Energy: 1.3194794560495628
Energy: 1.2850755076522404
Energy: 1.3006674514596206
Energy: 1.3141759086487115
Energy: 1.585401281228731
Energy: 1.5711280628138204
Energy: 1.319479456050057
Energy: 1.2850755076458182
Energy: 1.283723708834999
Energy: 1.3544192791372203
Energy: 1.596007458395862
Energy: 1.6205007211550526
Energy: 1.3844481960776704
Energy: 1.3231326629211013
Energy: 1.283723708837963
Energy: 1.3544192791377145
Energy: 1.596007458399814
Energy: 1.6205007211540645

minimum gb energy = 1.26431493512649 eV
minimum distance =  2.20217258560814 Angstroms
sigma value = 33


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

Energy: 1.4940244109106127
Energy: 1.5408502575715413
Energy: 1.3740953835521101
Energy: 1.550862323351796
Energy: 1.3905801889838831
Energy: 1.5615044045408988
Energy: 1.4940244109111551
Energy: 1.5408502575688294
Energy: 1.3740953655016233
Energy: 1.5508623210015846
Energy: 1.6820258109676607
Energy: 1.3848294922868465
Energy: 1.3774701481714515
Energy: 1.3854433785970628
Energy: 1.343232510145929
Energy: 1.3906360418254413
Energy: 1.6820258109657624
Energy: 1.384829453892045
Energy: 1.3774701379221888
Energy: 1.3854433785951645
Energy: 1.3498875558318624
Energy: 1.3269435716033817
Energy: 1.4062813304650321
Energy: 1.652171562327923
Energy: 1.3533280878630234
Energy: 1.3836371907715106
Energy: 1.3498875560335564
Energy: 1.3269435716166704
Energy: 1.4062813304747952
Energy: 1.6521715623273803
Energy: 1.4034508353282131
Energy: 1.3265729759884808
Energy: 1.3873876939562546
Energy: 1.3968580910304922
Energy: 1.3774303257015188
Energy: 1.6503441438622795
Energy: 1.403450835151469
Energy: 1.3265729759814298
Energy: 1.387387693956526
Energy: 1.3968573639039301
Energy: 1.3859621800699782
Energy: 1.3377799517811082
Energy: 1.4031031934741045
Energy: 1.6524079102645484
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Energy: 1.377132668575049
Energy: 1.385962180057232
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Energy: 1.4031031939810148
Energy: 1.6524079102631926
Energy: 1.6454356507288737
Energy: 1.3258191822694991
Energy: 1.4306152567241395
Energy: 1.3813361592965956
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Energy: 1.6821939161758606
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Energy: 1.5463992038938197
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Energy: 1.6820154756739019
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Energy: 1.3494524746637089
Energy: 1.3841074944092986
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Energy: 1.4754355509990256
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Energy: 1.3373122607860914
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Energy: 1.4754355312242415
Energy: 1.3780383740660878
Energy: 1.558546834527354
Energy: 1.3373122607852779
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Energy: 1.378618093951614
Energy: 1.3841427599766973
Energy: 1.3264677755955963
Energy: 1.4063055813655498
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Energy: 1.510279428872834
Energy: 1.3786180939640889
Energy: 1.3841427599745273
Energy: 1.3264677755961383
Energy: 1.3465093065638913
Energy: 1.3863459776665639
Energy: 1.6452704750323826
Energy: 1.3263995259775752
Energy: 1.4362519986323015
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Energy: 1.3465093065614504
Energy: 1.3863459776782254
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Energy: 1.3263995297403346
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Energy: 1.3889269247462483
Energy: 1.5081004972083345
Energy: 1.681965140921217
Energy: 1.3851770219160346
Energy: 1.3444469629008617
Energy: 1.3868572683701683
Energy: 1.388926924712374
Energy: 1.508100497253328
Energy: 1.3688477076612402
Energy: 1.385262990413176
Energy: 1.3667930695097983
Energy: 1.542217942988046
Energy: 1.4933528259314923
Energy: 1.4750218740284473
Energy: 1.3688477154708467
Energy: 1.38526299051295
Energy: 1.366793631987408
Energy: 1.542217942983978
Energy: 1.3612890249883178
Energy: 1.3789955360655404
Energy: 1.3452182668908135
Energy: 1.3852083068505683
Energy: 1.3784226142747598
Energy: 1.3791835208278407
Energy: 1.361289025281897
Energy: 1.3789955360671675
Energy: 1.3452182668970507
Energy: 1.3852083067800829
Energy: 1.4269318133302131
Energy: 1.6498969773409617
Energy: 1.3683588554602544
Energy: 1.3848271292030991
Energy: 1.3782163567426011
Energy: 1.325720301774283
Energy: 1.4269318133288573
Energy: 1.6498969773398773
Energy: 1.368358817668069
Energy: 1.3848271292033705
Energy: 1.389075171230937
Energy: 1.4686462930786643
Energy: 1.4765628569239015
Energy: 1.3657754690913453
Energy: 1.5588760792612066
Energy: 1.3293774095507362
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Energy: 1.3505764890466638
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Energy: 1.3699546394895188
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Energy: 1.4130012499553588
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Energy: 1.3588295645444655
Energy: 1.399343354712709

minimum gb energy = 1.324393517613506 eV
minimum distance =  2.2025144620444 Angstroms
sigma value = 219


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

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Energy: 1.3212621900166162
Energy: 1.2451580281226045
Energy: 1.320114713422119
Energy: 1.24694136599618
Energy: 1.4199535922341875

minimum gb energy = 1.2371466160171989 eV
minimum distance =  2.27875880142807 Angstroms
sigma value = 15


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

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minimum gb energy = 1.4011103459416232 eV
minimum distance =  2.21182419256048 Angstroms
sigma value = 293


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

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Energy: 1.3680399393300056
Energy: 1.5229681945485263
Energy: 1.4726974392399845
Energy: 1.378576126283536
Energy: 1.5752244928812984
Energy: 1.4733719195666166
Energy: 1.4345592567225973
Energy: 1.4754047285751393
Energy: 1.7095775684402568
Energy: 1.3785761235973282
Energy: 1.5752244928812984
Energy: 1.4733719195662112
Energy: 1.4345592567213812
Energy: 1.6692614985010095
Energy: 1.567708809212932
Energy: 1.4734361643392304
Energy: 1.622066134625048
Energy: 1.474570075871625
Energy: 1.5780356579593295
Energy: 1.6692614985018204
Energy: 1.5677088097384833
Energy: 1.4734361643363927
Energy: 1.6220700452857348
Energy: 1.3684313471786413
Energy: 1.7076861073134433
Energy: 1.4814915383036094
Energy: 1.433044010545605
Energy: 1.4725293458772104
Energy: 1.5761837642799297
Energy: 1.3684315251007906
Energy: 1.707686107316281
Energy: 1.4814915383027987
Energy: 1.4330440105419562
Energy: 1.560879876921508
Energy: 1.5303542830148213
Energy: 1.549157929674684
Energy: 1.475006177940513
Energy: 1.5016185890120717
Energy: 1.3669264931455676
Energy: 1.560944419509719
Energy: 1.5303542830120205
Energy: 1.549157929674684
Energy: 1.4750061705788158
Energy: 1.5806223624394866
Energy: 1.5247548277733853
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Energy: 1.4882797932707401
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Energy: 1.6072397223492774
Energy: 1.5565585058773188
Energy: 1.4225895103454511
Energy: 1.593756335261632
Energy: 1.5233576707593004
Energy: 1.5321817009044874
Energy: 1.7092861250622033
Energy: 1.3887679011587724
Energy: 1.4225895103547757
Energy: 1.5937563352697397
Energy: 1.523357670756868
Energy: 1.5321817009048928
Energy: 1.418724946272816
Energy: 1.4706127179675053
Energy: 1.464144670680659
Energy: 1.5899483938536219
Energy: 1.5274616843744804
Energy: 1.5357737551636206
Energy: 1.4187249462691671
Energy: 1.4706127179691268
Energy: 1.464144670680659
Energy: 1.5899483939261523
Energy: 1.4664129144786235
Energy: 1.5000675379895625
Energy: 1.525735514659033
Energy: 1.6510456332100278
Energy: 1.5374560095128926
Energy: 1.60514426705995
Energy: 1.4664129144778129
Energy: 1.5000675379928057
Energy: 1.525735514658222
Energy: 1.6510456332242172
Energy: 1.482656370309919
Energy: 1.4870522419681653
Energy: 1.4872899458550952
Energy: 1.4811842986826225
Energy: 1.4112905333716756
Energy: 1.4181658525526815
Energy: 1.4826563702965407
Energy: 1.4870522419673544
Energy: 1.4872899458550952
Energy: 1.4811842986850547
Energy: 1.6507027372300154
Energy: 1.533131190698874
Energy: 1.524187688397808
Energy: 1.467706073500212
Energy: 1.6059940483190394
Energy: 1.539916188752486
Energy: 1.65070273722434
Energy: 1.533131190699685
Energy: 1.524187688397808
Energy: 1.4677060734969687
Energy: 1.6706600764852206
Energy: 1.4631443389922296
Energy: 1.470851948067588
Energy: 1.4185412856969737
Energy: 1.5331513062179556
Energy: 1.5203485120373652
Energy: 1.6706600764240414
Energy: 1.4631443389922296
Energy: 1.4708519480683986
Energy: 1.4185412856981898
Energy: 1.5251821311080915
Energy: 1.5424602967590357
Energy: 1.5937563352563615
Energy: 1.4246202308391185
Energy: 1.383408521650108
Energy: 1.7092861250565274
Energy: 1.5251821311097133
Energy: 1.542460296757009
Energy: 1.593756335258794
Energy: 1.4246202308249292
Energy: 1.5499268210634585
Energy: 1.584558371312833
Energy: 1.5190539378478316
Energy: 1.5739936454229315
Energy: 1.479184404474662
Energy: 1.548274242691763
Energy: 1.5499268210598096
Energy: 1.5845583712868874
Energy: 1.5190539379183352
Energy: 1.5739936453528331

minimum gb energy = 1.3669264931447567 eV
minimum distance =  2.20262669110594 Angstroms
sigma value = 293


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

Energy: 1.1223418824603353
Energy: 1.4405103253814586
Energy: 1.1223835445868153
Energy: 1.6309025030365423
Energy: 1.1223872156744765
Energy: 1.436899259912619
Energy: 1.1223418824618008
Energy: 1.4405253692214326
Energy: 1.1223835445868153
Energy: 1.4605278225869094
Energy: 1.1227147406140414
Energy: 1.652900266632319
Energy: 1.1226783285201523
Energy: 1.6849920551651636
Energy: 1.7540625853224467
Energy: 1.1209473636587604
Energy: 1.1227147406162399
Energy: 1.4886521285866012
Energy: 1.1226783285201523
Energy: 1.6922358360020582
Energy: 1.1949511098723782
Energy: 1.121712704834041
Energy: 1.7255388234446174
Energy: 1.1221972792452504
Energy: 1.1525490715515858
Energy: 1.1236778635556806
Energy: 1.1949511098709127
Energy: 1.1217127048333082
Energy: 1.7255388234453501
Energy: 1.1221972792452504
Energy: 1.7257992823948785
Energy: 1.1218105281415285
Energy: 1.1950427231578424
Energy: 1.123671214092816
Energy: 1.152505946271731
Energy: 1.122144329363942
Energy: 1.7257992823956112
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Energy: 1.195042723161506
Energy: 1.1236712140935488
Energy: 1.122532039147585
Energy: 1.574995707074036
Energy: 1.1227891021819985
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Energy: 1.7540650334854573
Energy: 1.4286736068485084
Energy: 1.1225320391468523
Energy: 1.7740783004076117
Energy: 1.122789102182731
Energy: 1.1210226318707568
Energy: 1.1223872156752095
Energy: 1.4684972431791175
Energy: 1.122341882461068
Energy: 1.4405379576051907
Energy: 1.1223835445875483
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Energy: 1.436899251324524
Energy: 1.1223418824618008
Energy: 1.4405214686863526
Energy: 1.7540625853224467
Energy: 1.1209473636602256
Energy: 1.1227147406147744
Energy: 1.708398491500034
Energy: 1.1226783285201523
Energy: 1.6849920551702928
Energy: 1.7540625853224467
Energy: 1.1209473636616911
Energy: 1.1227147406140414
Energy: 1.4886521285858685
Energy: 1.1525490715523183
Energy: 1.123677863554948
Energy: 1.1949511098716454
Energy: 1.121712704834041
Energy: 1.7255388234446174
Energy: 1.1221972792445178
Energy: 1.1525490715523183
Energy: 1.1236778635556806
Energy: 1.1949511098738437
Energy: 1.1217127048333082
Energy: 1.1525059462746619
Energy: 1.1221443293654074
Energy: 1.7257992823956112
Energy: 1.1218105281422615
Energy: 1.195042723159308
Energy: 1.123671214092816
Energy: 1.1525059462709981
Energy: 1.122144329363942
Energy: 1.7257992823956112
Energy: 1.121810528140796
Energy: 1.7540650334854573
Energy: 1.5089108222863454
Energy: 1.122532039147585
Energy: 1.5749957070733032
Energy: 1.1227891021812655
Energy: 1.1210226317916558
Energy: 1.7540650334854573
Energy: 1.4286736068485084
Energy: 1.1225320391468523
Energy: 1.774078300403948
Energy: 1.1223835445860828
Energy: 1.6394390439034103
Energy: 1.122387215675942
Energy: 1.4368991881228899
Energy: 1.122341882461068
Energy: 1.4405199853110529
Energy: 1.1223835445868153
Energy: 1.6441023881020345
Energy: 1.1223872156752095
Energy: 1.436899133876279
Energy: 1.1226783285201523
Energy: 1.6849920551724908
Energy: 1.7540625853224467
Energy: 1.1209473636653549
Energy: 1.1227147406140414
Energy: 1.7646850203280533
Energy: 1.1226783285201523
Energy: 1.692235835715663
Energy: 1.7540625853224467
Energy: 1.1209473636580276
Energy: 1.7255388234453501
Energy: 1.1221972792423198
Energy: 1.1525490715552493
Energy: 1.123677863554948
Energy: 1.1949511098723782
Energy: 1.121712704834041
Energy: 1.7255388234446174
Energy: 1.1221972792445178
Energy: 1.1525490715545168
Energy: 1.1236778635556806
Energy: 1.1950427231600405
Energy: 1.1236712140935488
Energy: 1.152505946271731
Energy: 1.122144329366873
Energy: 1.7257992823948785
Energy: 1.121810528140796
Energy: 1.1950427231607732
Energy: 1.1236712140935488
Energy: 1.1525059462753946
Energy: 1.122144329366873
Energy: 1.1227891021798002
Energy: 1.1210226318319223
Energy: 1.7540650334854573
Energy: 1.4286736068485084
Energy: 1.122532039147585
Energy: 1.5045929547241108
Energy: 1.1227891021761367
Energy: 1.1210226317975176
Energy: 1.7540650334854573
Energy: 1.4286736068485084
Energy: 1.122341882461068
Energy: 1.4405362347691284
Energy: 1.1223835445868153
Energy: 1.4836444702944598
Energy: 1.122387215675942
Energy: 1.436899515085555
Energy: 1.1223418824603353
Energy: 1.4405381967700657
Energy: 1.1223835445875483
Energy: 1.7288978911730208
Energy: 1.1227147406140414
Energy: 1.842985953434543
Energy: 1.1226783285201523
Energy: 1.6922358352308327
Energy: 1.7540625853224467
Energy: 1.1209473636616911
Energy: 1.1227147406140414
Energy: 1.764685020326588
Energy: 1.1226783285201523
Energy: 1.692235835388302
Energy: 1.1949511098716454
Energy: 1.1217127048333082
Energy: 1.7255388234453501
Energy: 1.1221972792437849
Energy: 1.152549071550853
Energy: 1.123677863554948
Energy: 1.194951109873111
Energy: 1.121712704834041
Energy: 1.7255388234446174
Energy: 1.1221972792423198
Energy: 1.7257992823948785
Energy: 1.1218105281400632
Energy: 1.1950427231600405
Energy: 1.1236712140935488
Energy: 1.1525059462775928
Energy: 1.1221443293624764
Energy: 1.7257992823948785
Energy: 1.121810528140796
Energy: 1.1950427231600405
Energy: 1.123671214092816
Energy: 1.1225320391468523
Energy: 1.5045929547057928
Energy: 1.122789102180533
Energy: 1.1210226317674759
Energy: 1.7540650334861903
Energy: 1.4286736068485084
Energy: 1.122532039147585
Energy: 1.504592954726309
Energy: 1.1227891021812655
Energy: 1.1210226317967849
Energy: 1.1223872156766748
Energy: 1.436899522162739
Energy: 1.1223418824618008
Energy: 1.4405296476656313
Energy: 1.1223835445868153
Energy: 1.483644470299589
Energy: 1.1223872156752095
Energy: 1.4368992189473688
Energy: 1.1223418824603353
Energy: 1.4405418507130106
Energy: 1.7540625853224467
Energy: 1.1209473636675529
Energy: 1.122714740613309
Energy: 1.8429859534360085
Energy: 1.1226783285201523
Energy: 1.6922358348345954
Energy: 1.7540625853224467
Energy: 1.1209473636609586
Energy: 1.1227147406147744
Energy: 1.7646850203302515

minimum gb energy = 1.1209473636580276 eV
minimum distance =  2.23147973522786 Angstroms
sigma value = 15


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

Energy: 1.6957530694765364
Energy: 1.480682811462951
Energy: 1.4707900859277077
Energy: 1.4569236470359153
Energy: 1.4708586944738873
Energy: 1.4783871615484945
Energy: 1.6957530694742111
Energy: 1.4806828114805244
Energy: 1.4707900859297003
Energy: 1.4580397109463092
Energy: 1.4564570253015583
Energy: 1.6455235452138948
Energy: 1.4652455088622742
Energy: 1.4244482083515613
Energy: 1.4294788881882654
Energy: 1.3820353576023818
Energy: 1.4564570253052118
Energy: 1.6455235462905504
Energy: 1.4652455088612777
Energy: 1.4244482083508974
Energy: 1.543624253779889
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Energy: 1.6367356293981496
Energy: 1.4692499204225087
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Energy: 1.426907683528965
Energy: 1.6367377163717278
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Energy: 1.524717359480515
Energy: 1.408739611118639
Energy: 1.4400074185002634
Energy: 1.4146557151782237
Energy: 1.4935124743746153
Energy: 1.3866563144499116
Energy: 1.5247173594791863
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Energy: 1.582115242001331
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Energy: 1.5726078238361412
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Energy: 1.6702483020383143
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Energy: 1.4583520500071165
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Energy: 1.5379981255352304
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Energy: 1.6420508444519504
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Energy: 1.5379981255355626
Energy: 1.6631982947913777
Energy: 1.6420508444506214
Energy: 1.3854257708849247
Energy: 1.4936400977782893
Energy: 1.352078138438437
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Energy: 1.413768468655251
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Energy: 1.5749721175127878
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Energy: 1.539697837083027
Energy: 1.615794841280004
Energy: 1.4133996434908689
Energy: 1.5422500120415812
Energy: 1.3789135802117998
Energy: 1.462727572352772
Energy: 1.5396978370833592
Energy: 1.6157948411927106
Energy: 1.4133996434915332
Energy: 1.5494558018741273
Energy: 1.4631944719542016
Energy: 1.5923345452173383
Energy: 1.593482934706434
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Energy: 1.4617569484508248
Energy: 1.6551606801268353
Energy: 1.6028128298990028
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Energy: 1.5244981013243224
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Energy: 1.4617569484494963
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Energy: 1.5059839688560512
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Energy: 1.438875820184462
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Energy: 1.5059839688560512
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Energy: 1.5507877081089914
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Energy: 1.4787069340765724
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Energy: 1.373976176942687
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Energy: 1.467102408138593
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Energy: 1.4654496935887762
Energy: 1.5327552193295841
Energy: 1.4160186391985317
Energy: 1.474392517398782
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Energy: 1.5752980427763619
Energy: 1.4654496935901047
Energy: 1.5327552198149654
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Energy: 1.4660454782089065
Energy: 1.4821899244294279
Energy: 1.349674759028169
Energy: 1.4302200614372256
Energy: 1.3396285547436075
Energy: 1.6035284104130476
Energy: 1.4660454782065817
Energy: 1.482189924431753
Energy: 1.3496747590291653
Energy: 1.4302200614601435
Energy: 1.554137171480567
Energy: 1.3875434213486115
Energy: 1.48158645167733
Energy: 1.4684491701178068
Energy: 1.5461340741540015
Energy: 1.420226548674907
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Energy: 1.3875434213532616
Energy: 1.48158645167733
Energy: 1.4684491701184712
Energy: 1.5353206031916427
Energy: 1.4137710115227924
Energy: 1.4877484104107372
Energy: 1.4556377361875334
Energy: 1.563073897902411
Energy: 1.435290937093916
Energy: 1.535320603196625
Energy: 1.4137710115211317
Energy: 1.4877484104123981
Energy: 1.455637736189526
Energy: 1.3444309213383192
Energy: 1.505807000648322
Energy: 1.3787397803399153
Energy: 1.3698722332507436
Energy: 1.4598686436070416
Energy: 1.574390783836747
Energy: 1.3444309213373227
Energy: 1.505807000648986
Energy: 1.3787397803402472
Energy: 1.369872233246426
Energy: 1.6003757380839783
Energy: 1.4690902762326001
Energy: 1.469181036616728
Energy: 1.5484133425209765
Energy: 1.4659287068197648
Energy: 1.5417850463703764
Energy: 1.600375738083314
Energy: 1.469090276232268
Energy: 1.469181036616728
Energy: 1.548413342522305
Energy: 1.3328657897129765
Energy: 1.5318245250733347
Energy: 1.4674579285266132
Energy: 1.4603635222936628
Energy: 1.5466102639613788
Energy: 1.4427003597241486
Energy: 1.3328657897159657
Energy: 1.5318245250733347
Energy: 1.467457928526281
Energy: 1.4603635222956557
Energy: 1.5049978365886887
Energy: 1.4678919048692185
Energy: 1.4668265389670885
Energy: 1.4516057518880094
Energy: 1.4604185699998293
Energy: 1.6070760425118298
Energy: 1.5049978365886887
Energy: 1.4678919048688863
Energy: 1.4667617462201845
Energy: 1.451605751887345
Energy: 1.5728426646378542
Energy: 1.4671574918902204
Energy: 1.3905844554904758
Energy: 1.3400102536085785
Energy: 1.4965222494115338
Energy: 1.4176890973235625
Energy: 1.572842664638851
Energy: 1.4671574918905526
Energy: 1.3905844722376273
Energy: 1.3400102536085785
Energy: 1.3619988219751744
Energy: 1.5336300812127104
Energy: 1.4690139674375833
Energy: 1.4899267214909457
Energy: 1.4669032312867198
Energy: 1.5521494394540962
Energy: 1.3619988185483065
Energy: 1.5336300788227017
Energy: 1.4690139674379152
Energy: 1.4899267214909457
Energy: 1.367311039793274
Energy: 1.5944496359973677
Energy: 1.4656420212651278
Energy: 1.4828388856600567
Energy: 1.3698896405263679
Energy: 1.4704180014282142
Energy: 1.3673110397919457
Energy: 1.594449635998032
Energy: 1.4656420212624706
Energy: 1.482838885666035
Energy: 1.6372677113690575
Energy: 1.3343701648742143
Energy: 1.4452663257257923
Energy: 1.3399925517094908
Energy: 1.4714183784941435
Energy: 1.4674877593565938
Energy: 1.637267711367729
Energy: 1.334370164870561
Energy: 1.445266325696926
Energy: 1.339992551710155
Energy: 1.5821177960242494
Energy: 1.5993538664722102
Energy: 1.4612555710421136
Energy: 1.4138709637853546
Energy: 1.5091688919308197
Energy: 1.4672746638384015
Energy: 1.5821178081563376
Energy: 1.5993538664715459
Energy: 1.4612555710460995
Energy: 1.4138709637863511
Energy: 1.4023287349408915
Energy: 1.4424462680624672
Energy: 1.539075836471266
Energy: 1.473625658505699
Energy: 1.458607880810517
Energy: 1.5364388489455822
Energy: 1.4023287349329203
Energy: 1.442446268059478
Energy: 1.5390758364715982
Energy: 1.473625658505699
Energy: 1.5968442951208355
Energy: 1.5676718583728302
Energy: 1.5281357037334449
Energy: 1.516991730395626
Energy: 1.4648997679033318
Energy: 1.5132805533926748
Energy: 1.5968442951211677
Energy: 1.5676718583738267
Energy: 1.5281357037370984
Energy: 1.5169917301243863
Energy: 1.41540727517399
Energy: 1.5500033004850293
Energy: 1.4636707761476209
Energy: 1.3643602554445458
Energy: 1.3798399482120882
Energy: 1.4746860261063697
Energy: 1.4154072751700042
Energy: 1.5500033004846971
Energy: 1.4636707761472887
Energy: 1.3643602554438816
Energy: 1.4869912861538686
Energy: 1.6589489683055982
Energy: 1.5916913713546885
Energy: 1.461965838141711
Energy: 1.5326687009079318
Energy: 1.4124610565681726
Energy: 1.4869912861296224
Energy: 1.6589489683082552
Energy: 1.5916913675875253
Energy: 1.4619658381413791
Energy: 1.455143821866404
Energy: 1.3621147281134862
Energy: 1.6191583149254092
Energy: 1.4665726293477528
Energy: 1.4779272691799967
Energy: 1.3849057929049737
Energy: 1.4551438220396917
Energy: 1.3621147281118255
Energy: 1.6191583149264055
Energy: 1.4665726293460921
Energy: 1.4793739102381616
Energy: 1.5309454476190716
Energy: 1.3432179181256987
Energy: 1.4287523133848863
Energy: 1.3544097990119504
Energy: 1.4784441477835832
Energy: 1.4793739102381616
Energy: 1.5309454382810286
Energy: 1.3432179181303487
Energy: 1.4287523133838895
Energy: 1.4608796619627882
Energy: 1.6221434804880832
Energy: 1.6610375504968153
Energy: 1.5054777201386131
Energy: 1.413385465494395
Energy: 1.5494095387194942
Energy: 1.4608796619627882
Energy: 1.6221434805136583
Energy: 1.6610375504905046
Energy: 1.5054777201369525
Energy: 1.44168113423743
Energy: 1.4582940624262741
Energy: 1.509560056557487
Energy: 1.5110173691647617
Energy: 1.463331532065746
Energy: 1.3793602535777205
Energy: 1.44168113423743
Energy: 1.458294062426606
Energy: 1.509560056553501
Energy: 1.5110173691660902
Energy: 1.4439735396267195
Energy: 1.5281660353678612
Energy: 1.5332553277152166
Energy: 1.5924144060683558
Energy: 1.5103161556162226
Energy: 1.4615020730773693
Energy: 1.4439737411395455
Energy: 1.5281660353678612
Energy: 1.5332553276816705
Energy: 1.5924144060673595
Energy: 1.4709583291669333
Energy: 1.4191678646356989
Energy: 1.454303315000278
Energy: 1.3916127484235057
Energy: 1.5329472325884845
Energy: 1.3780783378117594
Energy: 1.4709583291685937
Energy: 1.4191678646373598
Energy: 1.4543033156241025
Energy: 1.391612748132005
Energy: 1.4164003529520135
Energy: 1.4660172546307704
Energy: 1.604079891930349
Energy: 1.606928632009917
Energy: 1.4613807068128635
Energy: 1.581731744329873
Energy: 1.416400352952678
Energy: 1.466017254623131
Energy: 1.6040798919316774
Energy: 1.6069286337711493
Energy: 1.3402452205727882
Energy: 1.5837498283705567
Energy: 1.3830406161772328
Energy: 1.6702496113457805
Energy: 1.5388405967360503
Energy: 1.4738422612547801
Energy: 1.3402452205721236
Energy: 1.5837498283705567
Energy: 1.383040596344173
Energy: 1.6702496113537522
Energy: 1.4842690141240538
Energy: 1.466463745493875
Energy: 1.5754114703554973
Energy: 1.35773105233145
Energy: 1.4008484933276806
Energy: 1.3437122433813735
Energy: 1.4842690141240538
Energy: 1.466463745493875
Energy: 1.5754114703508473
Energy: 1.357731052333111

minimum gb energy = 1.3328657897129765 eV
minimum distance =  2.25540451093833 Angstroms
sigma value = 437


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

Energy: 1.5645028296635795
Energy: 1.6023347386431812
Energy: 1.439749469376492
Energy: 1.558073483120589
Energy: 1.4357595366489397
Energy: 1.6029910418241662
Energy: 1.5645028296405885
Energy: 1.6023347386504414
Energy: 1.439749469375282
Energy: 1.547336157354125
Energy: 1.3962320961376529
Energy: 1.8617184679788346
Energy: 1.4357318032498463
Energy: 1.4094106298118168
Energy: 1.6292968350826256
Energy: 1.4051523452866646
Energy: 1.3962320961340777
Energy: 1.8617184679812548
Energy: 1.4357318032498463
Energy: 1.409410629817867
Energy: 1.4160336377622167
Energy: 1.41429421366337
Energy: 1.8624437619247551
Energy: 1.4227114497338913
Energy: 1.452710804999333
Energy: 1.5091026922258706
Energy: 1.4160336377585867
Energy: 1.4142942136621601
Energy: 1.8624437619126548
Energy: 1.4227114497387316
Energy: 1.4110582384244796
Energy: 1.4101936032744107
Energy: 1.4310703904970172
Energy: 1.4060556412862533
Energy: 1.4518573517272046
Energy: 1.4050528461748333
Energy: 1.4099593210968955
Energy: 1.4101936032707805
Energy: 1.4310703904982276
Energy: 1.4060556412838334
Energy: 1.4081431120858312
Energy: 1.6988563074418177
Energy: 1.4390935897514932
Energy: 1.4033123378286165
Energy: 1.4005025068388395
Energy: 1.4717236615896208
Energy: 1.4081431120325885
Energy: 1.4789654984970444
Energy: 1.439093589750283
Energy: 1.4033123378939045
Energy: 1.4074047630089974
Energy: 1.533117799909475
Energy: 1.4114689271883794
Energy: 1.4002064756771229
Energy: 1.4208841713832967
Energy: 1.4090125048013322
Energy: 1.4074047630114175
Energy: 1.5331177997897347
Energy: 1.4114689271920093
Energy: 1.4002064756734929
Energy: 1.7247760057262926
Energy: 1.4141475882133347
Energy: 1.4675728629149531
Energy: 1.4147734304443733
Energy: 1.4342228277347933
Energy: 1.4128698835904085
Energy: 1.7247731666871915
Energy: 1.4141475882072847
Energy: 1.4675728629149531
Energy: 1.4147734304431636
Energy: 1.541309102466302
Energy: 1.4692085588305814
Energy: 1.4362403310601461
Energy: 1.405626040964482
Energy: 1.4430097095026237
Energy: 1.410337589393596
Energy: 1.541309102463882
Energy: 1.4692085588293713
Energy: 1.4362403312826861
Energy: 1.405626040963272
Energy: 1.397076663536223
Energy: 1.4093884543313728
Energy: 1.805910900978331
Energy: 1.7605697772939028
Energy: 1.4385210629491407
Energy: 1.8134186182697678
Energy: 1.3970766635386433
Energy: 1.4093884543277424
Energy: 1.805910900979541
Energy: 1.7605697772902726
Energy: 1.4906548677217382
Energy: 1.4359292929441194
Energy: 1.4181273898554483
Energy: 1.4029113937772144
Energy: 1.4382821362587666
Energy: 1.600671048194109
Energy: 1.4906548677277884
Energy: 1.4359292929429095
Energy: 1.4181273902884828
Energy: 1.402911393859443
Energy: 1.632032742874715
Energy: 1.4124119478709114
Energy: 1.4391972600173846
Energy: 1.4079641295161522
Energy: 1.4613097200446317
Energy: 1.414695420394087
Energy: 1.632032742875925
Energy: 1.4124119478757515
Energy: 1.4391972600161747
Energy: 1.4079641295113123
Energy: 1.3966674163529802
Energy: 1.47319385596288
Energy: 1.6129888360642453
Energy: 1.4099901979066076
Energy: 1.612435370847749
Energy: 1.4732887850895953
Energy: 1.39666741635056
Energy: 1.4731938559665103
Energy: 1.6129888360847613
Energy: 1.4099901979041873
Energy: 1.6328648374327388
Energy: 1.4209211179786219
Energy: 1.4613097200543124
Energy: 1.4125670642267127
Energy: 1.4412214798651122
Energy: 1.4121937717614736
Energy: 1.6328648376020916
Energy: 1.4209211179786219
Energy: 1.4613097200410017
Energy: 1.4125670642315526
Energy: 1.4937633503428551
Energy: 1.6007949279731624
Energy: 1.434463983883326
Energy: 1.4051002310969785
Energy: 1.4117375100811154
Energy: 1.4342802862796455
Energy: 1.4937632659814404
Energy: 1.600794927969532
Energy: 1.4344639838809057
Energy: 1.4051002310824576

minimum gb energy = 1.3962320961340777 eV
minimum distance =  2.2390981059226 Angstroms
sigma value = 33