Model name: model_name=EAM_Dynamo_MendelevKramerBecker_2008_Al__MO_106969701023_005
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.045259781181812
cohesive_energy=3.410925190644327
mass=26.981538
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=[2.2851044242424998e-19, 2.93496328875924e-19, 3.3659488033052395e-19, 3.70210148288478e-19, 3.9732698781892794e-19, 4.1837798661305396e-19, 4.35067860609432e-19, 4.48878623194512e-19, 4.60670643220752e-19, 4.711600936435499e-19, 4.80906134108172e-19, 4.902932870067779e-19, 4.994705547663299e-19, 5.08244074014114e-19, 5.16319044249474e-19, 5.2347436509691795e-19, 5.295866689556279e-19, 5.34623912292924e-19, 5.38621342994754e-19, 5.4166387642272e-19, 5.43860460587934e-19, 5.45329656561312e-19, 5.46172401470796e-19, 5.46447975851844e-19, 5.461403579381159e-19, 5.45103749655918e-19, 5.43109039746588e-19, 5.3983739505996e-19, 5.348866692608999e-19, 5.27926813962804e-19, 5.19007496641326e-19, 5.088512989584e-19, 4.98888964648188e-19, 4.89602748877524e-19, 4.71759307704666e-19, 3.9299790655386e-19, 4.464048624716159e-20, -1.300267275618942e-18, -6.01386612631704e-18, -2.1597661461646797e-17, -7.15343027901588e-17, -2.29779366318378e-16, -7.338738028504319e-16, -2.37200648487066e-15, -7.88097868851528e-15, -2.73454701361218e-14, -1.00828179930888e-13, -4.03400839438422e-13, -1.79889188112252e-12, -9.27041830905276e-12, -5.8080184723807196e-11, -4.771842777873899e-10, -5.8266838301668195e-09, -1.322801889976152e-07]
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: 0.011885077376319327
Energy: 0.06208597506012634
Energy: 0.06200201663732131
Energy: 0.0620065282298838
Energy: 0.012584350436709111
Energy: 0.012745982112513677
Energy: 0.061963573458966775
Energy: 0.06186526549193705
Energy: 0.06202380879169321
Energy: 0.012559849159642953
Energy: 0.0619875085865331
Energy: 0.06171129843424592
Energy: 0.06252300630440981
Energy: 0.42553782721927735
Energy: 0.061680032086481824
Energy: 0.06216511769082911
Energy: 0.061590227233230425
Energy: 0.06230839980536997
Energy: 0.42547309464223204
Energy: 0.06168403070969759
Energy: 0.06163194125642851
Energy: 0.01242687450142558
Energy: 0.012184095584213602
Energy: 0.061933925383816354
Energy: 0.42565252481424376
Energy: 0.06163177453552453
Energy: 0.012332682810727373
Energy: 0.012159820511695153
Energy: 0.06181877660858162
Energy: 0.061535175946282175
Energy: 0.061576156604114016
Energy: 0.012761023560513724
Energy: 0.012260449706791217
Energy: 0.061730078662515765
Energy: 0.061716537340179324
Energy: 0.06167424507393254
Energy: 0.01240057089529813
Energy: 0.012228771131850844
Energy: 0.06161077779409739
Energy: 0.06162731171654331
Energy: 0.0615680302813921
Energy: 0.06187722779473078
Energy: 0.06170391925280241
Energy: 0.012229437268851647
Energy: 0.01235489920045348
Energy: 0.061621280074649495
Energy: 0.06202026244718152
Energy: 0.061744883713929215
Energy: 0.0123224431342959
Energy: 0.061708006141520055
Energy: 0.061665582007820824
Energy: 0.425879401991446
Energy: 0.0620756224256648
Energy: 0.01229212605366605
Energy: 0.012405863568696692
Energy: 0.06171872017689662
Energy: 0.4269888576618712
Energy: 0.06209982267857484
Energy: 0.012338842448893371
Energy: 0.01260140301931039
Energy: 0.01259160010107649
Energy: 0.06166678461129376
Energy: 0.4255730207018725
Energy: 0.062252189658834396
Energy: 0.06175013204920389
Energy: 0.012548268690273092
Energy: 0.06167542050985526
Energy: 0.061524985716141144
Energy: 0.06242035599153591
Energy: 0.06185185504592135

minimum gb energy = 0.011885077376319327 eV
minimum distance =  2.82626607251921 Angstroms
sigma value = 3


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

Energy: 0.666737191733558
Energy: 0.5997244971386484
Energy: 0.5788856638851825
Energy: 0.5827058203677468
Energy: 0.452717749917448
Energy: 0.6082913064724906
Energy: 0.5974084146948427
Energy: 0.5793907497163691
Energy: 0.5820468601224963
Energy: 0.5359474002929847
Energy: 0.5821131908076111
Energy: 0.6608580721992001
Energy: 0.578045288037717
Energy: 0.5151350052776332
Energy: 0.48791783144090095
Energy: 0.4871559459909184
Energy: 0.6526343821000284
Energy: 0.5749992280586371
Energy: 0.5219293404952577
Energy: 0.5451224898087244
Energy: 0.5734746649259166
Energy: 0.6612451170611171
Energy: 0.5431668725499673
Energy: 0.5806995417280932
Energy: 0.5637862335736933
Energy: 0.4835386005180411
Energy: 0.5832408020633748
Energy: 0.520502174081212
Energy: 0.5604922284588398
Energy: 0.5606798054446325
Energy: 0.5737947389764454
Energy: 0.6209395278055426
Energy: 0.5655915219235534
Energy: 0.48607106175361664
Energy: 0.5652938170953616
Energy: 0.563963147057818
Energy: 0.6299512058777177
Energy: 0.5646483204780488
Energy: 0.4792512794777606
Energy: 0.5605795330029144
Energy: 0.6599986289943924
Energy: 0.5932539167755068
Energy: 0.6499567258275492
Energy: 0.6873329425117157
Energy: 0.4884932864871214
Energy: 0.6626205037810621
Energy: 0.594298975973672
Energy: 0.6012037832958557
Energy: 0.694858740559322
Energy: 0.49580879635925584
Energy: 0.5873637970979825
Energy: 0.6679487207257343
Energy: 0.6362459125203096
Energy: 0.5354598586701361
Energy: 0.6677240117912273
Energy: 0.5916258102362807
Energy: 0.6661219549864823
Energy: 0.48782262910387025
Energy: 0.48064872004968456
Energy: 0.6682374983999436
Energy: 0.5828671884512951
Energy: 0.6331762117968216
Energy: 0.6817255455839398
Energy: 0.538907904337974
Energy: 0.584198707489389
Energy: 0.5834536072275451
Energy: 0.5961172559379999
Energy: 0.6301399997617636
Energy: 0.4830591934821952
Energy: 0.5836014667899162
Energy: 0.5833766119158592
Energy: 0.5836580129271518
Energy: 0.6572240555206917
Energy: 0.5640344373892752
Energy: 0.5834207422754363
Energy: 0.5832978938082832
Energy: 0.5843705436180432
Energy: 0.6090216817295353
Energy: 0.45401295391173063
Energy: 0.5831829529113204
Energy: 0.5854257441199997
Energy: 0.5273941949721608
Energy: 0.48603049627535444
Energy: 0.6662730488189761
Energy: 0.6528211871477271
Energy: 0.5844390980534686
Energy: 0.5230472352880919
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Energy: 0.5726217029988988
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Energy: 0.6655578423632738
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Energy: 0.48234615436204953
Energy: 0.5139746901171444
Energy: 0.5841417237580414
Energy: 0.6258576077601736
Energy: 0.6529891864444762
Energy: 0.4809858729106532
Energy: 0.6570150920218791
Energy: 0.5853087906407407
Energy: 0.6352939863596982
Energy: 0.651029221770738
Energy: 0.6099677007909999
Energy: 0.5453356966686251
Energy: 0.5864472769696366
Energy: 0.5887103020983813
Energy: 0.6120446648359773
Energy: 0.6479180999845093
Energy: 0.6072986893602875
Energy: 0.5865338857028258
Energy: 0.5884001709308132
Energy: 0.6499041359185861
Energy: 0.45385436451805017
Energy: 0.5947538216694307
Energy: 0.5822821687190552
Energy: 0.527620664514851
Energy: 0.5394023566668212
Energy: 0.480969566884896
Energy: 0.6299450818026807
Energy: 0.5836558662593733
Energy: 0.5225309956367725
Energy: 0.48498458137788375
Energy: 0.4908582742610403
Energy: 0.7069294730160062
Energy: 0.516498129308922
Energy: 0.559072551394964
Energy: 0.559821288292395
Energy: 0.5443640579833983
Energy: 0.6771687922398459
Energy: 0.5167024898930124
Energy: 0.5595421153565887
Energy: 0.48146771267522015
Energy: 0.49797624048086553
Energy: 0.526031948284435
Energy: 0.5670519488098181
Energy: 0.585875381230571
Energy: 0.4866003255313791
Energy: 0.5359974138958169
Energy: 0.5207777133674982
Energy: 0.5662790467398319
Energy: 0.5126704611338685
Energy: 0.48624828468002435
Energy: 0.5367473305248299
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Energy: 0.6026579566766569
Energy: 0.6613744418151601
Energy: 0.48837252461989045
Energy: 0.557517735110375
Energy: 0.6340776729282965
Energy: 0.6507193556520844
Energy: 0.6609913840511078
Energy: 0.483419733605285
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Energy: 0.6660662496499369
Energy: 0.5972547600400734
Energy: 0.4822098503225078
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Energy: 0.6062372283697313
Energy: 0.6653466047207827
Energy: 0.6568377519557227
Energy: 0.5655158644920107
Energy: 0.6473824634733132
Energy: 0.5856222299335211
Energy: 0.5959559444743877
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Energy: 0.48400157203708954
Energy: 0.5835870949551986
Energy: 0.5836639161530532
Energy: 0.6309075661600768
Energy: 0.6861233695267814
Energy: 0.5374012244504422
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Energy: 0.5833161556173092
Energy: 0.5839291036848745
Energy: 0.6478793679454853
Energy: 0.45368696909144757
Energy: 0.584409645589447
Energy: 0.5821571444270913
Energy: 0.6055854024952537
Energy: 0.6573063860461824
Energy: 0.5632606531626578
Energy: 0.5855008173271701
Energy: 0.5844229464018144
Energy: 0.5217321958405147
Energy: 0.45872615191309246
Energy: 0.6103320087629679
Energy: 0.6094806931826682
Energy: 0.582927339171759
Energy: 0.526108253820529
Energy: 0.4980364722304193
Energy: 0.6820944307359662
Energy: 0.6018534211034793
Energy: 0.5318152026640358
Energy: 0.5627317922813091
Energy: 0.483673602798072
Energy: 0.5727412265559204
Energy: 0.563686843321484
Energy: 0.5380816370102839
Energy: 0.5607340618569359
Energy: 0.542584996915735
Energy: 0.583014909757062
Energy: 0.5866893661745527
Energy: 0.5851453683312576
Energy: 0.5030561824615134
Energy: 0.575957848610711
Energy: 0.48068278561934313
Energy: 0.5892387531179164
Energy: 0.5741800885080495
Energy: 0.5400337339321919
Energy: 0.5688888627273143
Energy: 0.53389643708565
Energy: 0.5856651018629744
Energy: 0.6624990044028323
Energy: 0.4820568793306119
Energy: 0.5382613885028655
Energy: 0.5962321088483135
Energy: 0.6239209638298243
Energy: 0.6604242959104089
Energy: 0.48589728086685813
Energy: 0.5630932348924248
Energy: 0.6396761644869314
Energy: 0.6490357164995731
Energy: 0.6553750840480832
Energy: 0.564477267000767
Energy: 0.666991946132048
Energy: 0.6648195521334896
Energy: 0.6155679926773914
Energy: 0.48662337944525125
Energy: 0.5652264549530304
Energy: 0.5963409904504493
Energy: 0.6660362531507318
Energy: 0.6032265212677634
Energy: 0.5761899955729934
Energy: 0.5421644878070083
Energy: 0.5766217796643252
Energy: 0.6636892106694473
Energy: 0.6580685432527803
Energy: 0.48946317300570924
Energy: 0.5824543237165246
Energy: 0.5760588463905846
Energy: 0.6627901745888374
Energy: 0.6579850794531855
Energy: 0.6695800669371439
Energy: 0.529075511513902
Energy: 0.5803390527627275
Energy: 0.5828400331924628
Energy: 0.6478473638714382
Energy: 0.6114350656047914
Energy: 0.6254917033679895
Energy: 0.5772535040536618
Energy: 0.5780205588286438
Energy: 0.6204858715863654

minimum gb energy = 0.452717749917448 eV
minimum distance =  2.44891894502329 Angstroms
sigma value = 75


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

Energy: 0.9033810164178244
Energy: 0.5500215052518158
Energy: 0.5299930229334799
Energy: 0.6295342673388232
Energy: 0.5311024502148076
Energy: 0.5448120454448558
Energy: 0.5382933153302385
Energy: 0.5350480135705643
Energy: 0.591357128923286
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Energy: 0.5986521700008566
Energy: 0.5509352988610928
Energy: 0.535904685954028
Energy: 0.5493611287540303
Energy: 0.5305378115328304
Energy: 0.5288840459734429
Energy: 0.5604612881851704
Energy: 0.5443635262224759
Energy: 0.5561690879760183
Energy: 0.5572422242900792
Energy: 0.5937870883333914
Energy: 0.6891743652048516
Energy: 0.5713202540151752
Energy: 0.5512748236826029
Energy: 0.5665374167885043
Energy: 0.5510939740783206
Energy: 0.6886766699571323
Energy: 0.571750360865149
Energy: 0.5518050266578818
Energy: 0.5676585345822188
Energy: 0.552633411331494
Energy: 0.545570061976835
Energy: 0.5790392267818267
Energy: 0.55713590790339
Energy: 0.566609155269971
Energy: 0.5341017098561415
Energy: 0.5393313119971883
Energy: 0.557516794548971
Energy: 0.5596433050523988
Energy: 0.566204642330407
Energy: 0.5583412332023249
Energy: 0.526711032010378
Energy: 0.5511613980431683
Energy: 0.6545621286144409
Energy: 0.5163457849872846
Energy: 0.5663257171903817
Energy: 0.5323474974445355
Energy: 0.5570147125599323
Energy: 0.6584911582196772
Energy: 0.5485384535323241
Energy: 0.53602444217725
Energy: 0.544114087786965
Energy: 0.5451477778554514
Energy: 0.5495503348822344
Energy: 0.6466328404728077
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Energy: 0.5386501481590062
Energy: 0.5493601212173141
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Energy: 0.5259592607671444
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Energy: 0.6892643439908429
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Energy: 0.5553213516311233
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Energy: 0.554130946881983
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Energy: 0.6497130320294361
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Energy: 0.5437142187393149
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Energy: 0.5577732416047616
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Energy: 0.5895959360600193
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Energy: 0.6093228706005227
Energy: 0.6917919980458289
Energy: 0.6003458753492529
Energy: 0.5591363954975748
Energy: 0.5356155718874573
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Energy: 0.5522427872234507
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Energy: 0.552378861061691
Energy: 0.5543595489845207
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Energy: 0.5630853129056446
Energy: 0.6728786185358732
Energy: 0.5577257198325182
Energy: 0.5375593908126433
Energy: 0.5352344302338112
Energy: 0.6725668548375782
Energy: 0.6738108447201808
Energy: 0.560790362708295
Energy: 0.6492708027086692
Energy: 0.5370182211791733
Energy: 0.660785954746824
Energy: 0.6504840901482284
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Energy: 0.5545028269594139
Energy: 0.536346826102042
Energy: 0.5564466425385137
Energy: 0.6466548880908778
Energy: 0.5534601280488465
Energy: 0.5354392423934091
Energy: 0.5428973795614415
Energy: 0.5526019933488715
Energy: 0.5619180219295592
Energy: 0.5642717778239981
Energy: 0.5513176613041363
Energy: 0.5932936380199613
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Energy: 0.552684475199396
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Energy: 0.5662990990696956
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minimum gb energy = 0.5061737516440723 eV
minimum distance =  2.43890872058431 Angstroms
sigma value = 105


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

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Energy: 0.5361451705750953
Energy: 0.592827922650872
Energy: 0.6103276143362305
Energy: 0.6061516354132185
Energy: 0.5960285672522208
Energy: 0.5270030201554111
Energy: 0.5955383659532711
Energy: 0.6096133288133848
Energy: 0.5678490229923778
Energy: 0.5538516113229672
Energy: 0.5384937868135146
Energy: 0.547731813362412
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Energy: 0.5573472362515766
Energy: 0.5610197210838878
Energy: 0.6230035815830502
Energy: 0.5727715572919161
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Energy: 0.5824814539656759
Energy: 0.5646133760567752
Energy: 0.5732659256232202
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Energy: 0.5735154939034443
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Energy: 0.5646432222721465
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Energy: 0.5354310668958864
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Energy: 0.5358427986559765
Energy: 0.5833583033955331
Energy: 0.5699937240704701
Energy: 0.5647148432133594
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Energy: 0.5556851363771589
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Energy: 0.5785375717792449
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Energy: 0.5763938969496049
Energy: 0.5668770007895442
Energy: 0.5717580487607553
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Energy: 0.5870609992784044
Energy: 0.5554514855955255
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Energy: 0.5717230337678817
Energy: 0.5267276680510405
Energy: 0.5657031415738556
Energy: 0.5620791454934387
Energy: 0.5804886568993286
Energy: 0.5891629055907809
Energy: 0.5558588154901098
Energy: 0.5603611176393319
Energy: 0.6131765091918109
Energy: 0.5806204108373871
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Energy: 0.5554303745688628
Energy: 0.6073878127073261
Energy: 0.5533296533144303
Energy: 0.5826215416036439
Energy: 0.6017073916198858
Energy: 0.6531755253110866
Energy: 0.6058834984694283
Energy: 0.5584288397519463
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Energy: 0.6609547111136034
Energy: 0.657961508631468
Energy: 0.5951051260025576
Energy: 0.512863880804537
Energy: 0.5495885714766008
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Energy: 0.5965288108247655
Energy: 0.5701218639053218
Energy: 0.51570119349022
Energy: 0.5432793602457988
Energy: 0.5395230076204954
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Energy: 0.5938617880799275
Energy: 0.5333799677368771
Energy: 0.5550015757903382
Energy: 0.5442711523777585
Energy: 0.541745420999848
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Energy: 0.5496365051301927
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Energy: 0.5390447577767584
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Energy: 0.5373135856698072
Energy: 0.5476060957061066
Energy: 0.5301630903407548
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Energy: 0.5397490272579354
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Energy: 0.5299029567135949
Energy: 0.6999778804763159
Energy: 0.5328685383353761
Energy: 0.5354743911933053
Energy: 0.52498108550551
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Energy: 0.5493893039876909
Energy: 0.5349159918383901
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Energy: 0.5324049749443986
Energy: 0.6051721370908272
Energy: 0.6405518211550578
Energy: 0.5299108506835246
Energy: 0.5217341887993925
Energy: 0.6428533256167462
Energy: 0.5734119092736861
Energy: 0.5450933920206821
Energy: 0.5333437842487673
Energy: 0.5214854076459127
Energy: 0.5584120588244987
Energy: 0.5717294743893869
Energy: 0.5303201924564678
Energy: 0.5296200865603344
Energy: 0.5226472346351312
Energy: 0.5571714724145211
Energy: 0.5730089808900248
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Energy: 0.5317013379214695
Energy: 0.6018630104121077
Energy: 0.5764141890553278
Energy: 0.5445775378439413
Energy: 0.5298001558407303
Energy: 0.5474488117499264
Energy: 0.5333811112180903
Energy: 0.6684943688147393
Energy: 0.5448431698181737
Energy: 0.5303769489686943
Energy: 0.5433760610747517
Energy: 0.5344348500581376
Energy: 0.8206275815724878
Energy: 0.6150129498600003
Energy: 0.5285908148430818
Energy: 0.5476758407123868
Energy: 0.5270280332499605
Energy: 0.5488110434909825
Energy: 0.5555703495456642
Energy: 0.5462249156300875
Energy: 0.5498473531833455
Energy: 0.5285108728392969
Energy: 0.556263054349055
Energy: 0.6802453653324949
Energy: 0.6709711805349277
Energy: 0.5471075881775951
Energy: 0.5873091815972618
Energy: 0.572806499874228
Energy: 0.5955797368245521
Energy: 0.5785835267144209
Energy: 0.5308349949831518
Energy: 0.5868062755069279
Energy: 0.5770380321413185
Energy: 0.5605743214254891
Energy: 0.5963115035081006
Energy: 0.5681785074688616
Energy: 0.5220422939259889
Energy: 0.6044125948957483
Energy: 0.5600799693768832
Energy: 0.5959613605009556
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Energy: 0.5268349700031536
Energy: 0.6123597018389618
Energy: 0.5346320386454679
Energy: 0.5732793199865229
Energy: 0.5730016228796238
Energy: 0.5586290228810927
Energy: 0.6098126650394494
Energy: 0.5358311946092449
Energy: 0.5727854995427498
Energy: 0.5711877567010555
Energy: 0.564503284602566
Energy: 0.5468368210789187
Energy: 0.6252305848102768
Energy: 0.5650482496105649
Energy: 0.5654570500784956
Energy: 0.5742131144338914
Energy: 0.5880547575564216
Energy: 0.6423854198585721
Energy: 0.5653332385234755
Energy: 0.5806347415754209
Energy: 0.5730129598309109
Energy: 0.5879839097527074
Energy: 0.6150502635438091
Energy: 0.571655456136486
Energy: 0.5631342340240408
Energy: 0.5656266875391031
Energy: 0.5716980770572347
Energy: 0.5811302372332735
Energy: 0.5711050431561191
Energy: 0.5486343609081139
Energy: 0.5655762477756797
Energy: 0.5726230129370724
Energy: 0.5697835391862587
Energy: 0.5775241217694442
Energy: 0.5986898622008362
Energy: 0.5983058301681565
Energy: 0.5868184466736402
Energy: 0.5714450534077039
Energy: 0.6053097059940787
Energy: 0.5980573542741818
Energy: 0.570373746694619
Energy: 0.5927313557028852
Energy: 0.5962020732105783
Energy: 0.5666983621883684
Energy: 0.5693793233416764
Energy: 0.5716596315757797
Energy: 0.5634082716734193
Energy: 0.6203394925987527
Energy: 0.5305448751516301
Energy: 0.5649017675433682
Energy: 0.5712209179550372
Energy: 0.5874459144599598
Energy: 0.5655567143475935
Energy: 0.5351179335322223
Energy: 0.5703653513805931
Energy: 0.5708740104255641
Energy: 0.5416013558471072
Energy: 0.5689902492188391
Energy: 0.5358754876749763
Energy: 0.5695706745109417
Energy: 0.5700155625336878
Energy: 0.5460472260339617
Energy: 0.5982750194993208
Energy: 0.5669515026831353
Energy: 0.5970432816443367
Energy: 0.6537858204444218
Energy: 0.5560302541565609
Energy: 0.5358306798022724
Energy: 0.5834502455556301
Energy: 0.6127151279246743
Energy: 0.6545381000920888
Energy: 0.5712449157875923
Energy: 0.5898763386984814
Energy: 0.5333699686987603
Energy: 0.5408379327643198
Energy: 0.5293927535925256
Energy: 0.5821774721719616
Energy: 0.5116106120028412
Energy: 0.5367248436584796
Energy: 0.5356704756179921
Energy: 0.5334644221639794
Energy: 0.5780224319270297
Energy: 0.632725160133198
Energy: 0.5336475827361664
Energy: 0.5413031811450066
Energy: 0.5407549400200744
Energy: 0.5310724254678162
Energy: 0.5526539235606903
Energy: 0.5311961710680329
Energy: 0.5365193574323133
Energy: 0.5372189936322583
Energy: 0.5968090750895931

minimum gb energy = 0.5116106120028412 eV
minimum distance =  2.54895657661227 Angstroms
sigma value = 165


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

Energy: 0.6216880736124799
Energy: 0.5341364644015231
Energy: 0.49619323270161014
Energy: 0.5422048098522326
Energy: 0.5567097610394933
Energy: 0.6218357390709428
Energy: 0.5331092111109004
Energy: 0.496275677570777
Energy: 0.5429447396402383
Energy: 0.556509099245382
Energy: 0.5760976832929263
Energy: 0.5391645808363097
Energy: 0.530236393057942
Energy: 0.5304879383558642
Energy: 0.541396608339299
Energy: 0.5367428149761438
Energy: 0.5386396464731287
Energy: 0.5303012562892128
Energy: 0.5312569661621591
Energy: 0.5762743935460598
Energy: 0.5292456466251266
Energy: 0.5639866051979467
Energy: 0.5579872038134782
Energy: 0.5302403614023541
Energy: 0.5682476748447346
Energy: 0.5293136010279427
Energy: 0.5299380754478972
Energy: 0.5308907718800028
Energy: 0.5451440617257739
Energy: 0.5694056188904404
Energy: 0.6066163581896111
Energy: 0.528589464746051
Energy: 0.5291286980998772
Energy: 0.5296844332988472
Energy: 0.6292744728538956
Energy: 0.5635025214721489
Energy: 0.5289196690919221
Energy: 0.5298704359011265
Energy: 0.5295851787063858
Energy: 0.6300344789211708
Energy: 0.5286332777815637
Energy: 0.5296315675326546
Energy: 0.5288279007966933
Energy: 0.5334201645641067
Energy: 0.5330372885223315
Energy: 0.5294805926324135
Energy: 0.5297290871501809
Energy: 0.5287754914366402
Energy: 0.5322172902042099
Energy: 0.5330945268068336
Energy: 0.5282075637646793
Energy: 0.5899532347000946
Energy: 0.5303791182969418
Energy: 0.4884418159700628
Energy: 0.5331996806837321
Energy: 0.5284126383546939
Energy: 0.5285618036881332
Energy: 0.5321629093736354
Energy: 0.4913234325102449
Energy: 0.5327249252509854
Energy: 0.5302347803368226
Energy: 0.5418195726615896
Energy: 0.5403735112351298
Energy: 0.5117547886540883
Energy: 0.5370147809116319
Energy: 0.5367685333557108
Energy: 0.5429707631562272
Energy: 0.537156652326799
Energy: 0.5115341657941072
Energy: 0.5374184393363178
Energy: 0.6323164146251098
Energy: 0.5283063299959457
Energy: 0.5634675996444315
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Energy: 0.5419574740893525
Energy: 0.4885032331261468
Energy: 0.5284442522778685
Energy: 0.5610553782646991
Energy: 0.5603743847207416
Energy: 0.48940815412537475
Energy: 0.5266297369830716
Energy: 0.5423104320269361
Energy: 0.49779101071714965
Energy: 0.5356417752172435
Energy: 0.5286116067061147
Energy: 0.5275008258838144
Energy: 0.510943189817278
Energy: 0.5303870231936448
Energy: 0.532554487807932
Energy: 0.5555405636570175
Energy: 0.5711670873238562
Energy: 0.5410026925661109
Energy: 0.5286502459813504
Energy: 0.5290187016316885
Energy: 0.5373670631868099
Energy: 0.5724281153866054
Energy: 0.54205739333679
Energy: 0.5284186871013434
Energy: 0.5289848878395136
Energy: 0.5371064047812026
Energy: 0.4895569643575286
Energy: 0.5299106483898413
Energy: 0.5291493028859464
Energy: 0.5642396287374292
Energy: 0.623801226845384
Energy: 0.5302777796132229
Energy: 0.5295395568842508
Energy: 0.5290295846497617
Energy: 0.565358383048252
Energy: 0.6233275004302274
Energy: 0.5379399480692906
Energy: 0.5314462969347516
Energy: 0.5297156492723877
Energy: 0.5307402316638523
Energy: 0.5357248201126216
Energy: 0.5290799025619402
Energy: 0.5742473747291685
Energy: 0.529937367080594
Energy: 0.5287568748709541
Energy: 0.5355016643519136
Energy: 0.5282879843761156
Energy: 0.5295122955249828
Energy: 0.5289945083536637
Energy: 0.5326179888143944
Energy: 0.4955951113823235
Energy: 0.5281631487247193
Energy: 0.5281718859651299
Energy: 0.5300914332706459
Energy: 0.5314769409583667
Energy: 0.49561403401756227
Energy: 0.5290792834892685
Energy: 0.537569611736771
Energy: 0.5110599025845657
Energy: 0.4922796921308397
Energy: 0.5291040134030436
Energy: 0.5290522346401185
Energy: 0.5383960414777289
Energy: 0.5107191066880892
Energy: 0.4906966541175785
Energy: 0.5293558324464323
Energy: 0.4890248657302776
Energy: 0.5293311173932798
Energy: 0.53835338129385
Energy: 0.5134688914330643
Energy: 0.5383288290313735
Energy: 0.5520133809546686
Energy: 0.5290246518691355
Energy: 0.5663635235413725
Energy: 0.5116855361015006
Energy: 0.5414967518293508

minimum gb energy = 0.4884418159700628 eV
minimum distance =  2.57433098872375 Angstroms
sigma value = 41


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

Energy: 0.8627810845764587
Energy: 0.5115286642310023
Energy: 0.47133853627252975
Energy: 0.4650365315462326
Energy: 0.45366452852552286
Energy: 0.4747244375001652
Energy: 0.4719615872775419
Energy: 0.47193348174700367
Energy: 0.46499581027638087
Energy: 0.4762713757645273
Energy: 0.5111658978708636
Energy: 0.48721536985822744
Energy: 0.4645053144561775
Energy: 0.46422696223078075
Energy: 0.47864701677329846
Energy: 0.5114589786490359
Energy: 0.4992510060121595
Energy: 0.4660106470709333
Energy: 0.46421560650221333
Energy: 0.48890133992857876
Energy: 0.4892785843538705
Energy: 0.48845367279309165
Energy: 0.5235095272409976
Energy: 0.5102683073293983
Energy: 0.47632173856383325
Energy: 0.489185169226463
Energy: 0.5126183235408419
Energy: 0.5272201969045306
Energy: 0.5092846877478328
Energy: 0.47604310628612995
Energy: 0.48932329654502144
Energy: 0.4799551783636371
Energy: 0.4880233484489204
Energy: 0.4876820152940385
Energy: 0.4736521068396695
Energy: 0.48918324473381897
Energy: 0.479415876503018
Energy: 0.4879752452014012
Energy: 0.48781302565547496
Energy: 0.45674191810937936
Energy: 0.510223164732706
Energy: 0.48682241548763105
Energy: 0.48896682803068886
Energy: 0.4902612457309564
Energy: 0.4958182914274649
Energy: 0.5236084185788102
Energy: 0.48647772004042794
Energy: 0.49171203437072025
Energy: 0.4898944766272034
Energy: 0.4946325198872834
Energy: 0.507794520676151
Energy: 0.4908917331277316
Energy: 0.49401515851362565
Energy: 0.48976334997441395
Energy: 0.4852442074096918
Energy: 0.5082468014210152
Energy: 0.49082328521614405
Energy: 0.4905159357821773
Energy: 0.5371976961374266
Energy: 0.48947190240417726
Energy: 0.49600281867519785
Energy: 0.48960696070384174
Energy: 0.48914117432113535
Energy: 0.4743570048636002
Energy: 0.46475452560285885
Energy: 0.4946853651266996
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Energy: 0.4892310157455159
Energy: 0.47524315192320105
Energy: 0.509559859775501
Energy: 0.49891561663127404
Energy: 0.4882090068959305
Energy: 0.4887295237977334
Energy: 0.4802468611576377
Energy: 0.5090305215054461
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Energy: 0.4887350714786389
Energy: 0.47989710396336277
Energy: 0.4927866789887673
Energy: 0.5300290720305171
Energy: 0.5099856780610637
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Energy: 0.5305963450147942
Energy: 0.49806040358288245
Energy: 0.5270879802950473
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Energy: 0.48872033345294785
Energy: 0.5006881694330636
Energy: 0.46452176772819187
Energy: 0.46495683021785555
Energy: 0.4872205384618102
Energy: 0.47931552728065835
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Energy: 0.4646284037616366
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Energy: 0.48964391110352506
Energy: 0.48726319126013995
Energy: 0.46472237911390935
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Energy: 0.46465567325499735
Energy: 0.4594094120097052
Energy: 0.4658791422663843
Energy: 0.5268961361675089
Energy: 0.4889650600006456
Energy: 0.4648313319564983
Energy: 0.49186330695030017
Energy: 0.46491423013837
Energy: 0.512603342792074
Energy: 0.4880947236582988
Energy: 0.4998267226654762
Energy: 0.497843292010368
Energy: 0.4651703577481608
Energy: 0.5113188375648381
Energy: 0.4644588176876326
Energy: 0.4922637764786477
Energy: 0.46548187458809515
Energy: 0.4896967514797477
Energy: 0.48884365325577805
Energy: 0.49053934204936217
Energy: 0.4923051144148936
Energy: 0.4661007136666156
Energy: 0.489760536917058
Energy: 0.4887254202013106
Energy: 0.4589599755862412
Energy: 0.4650650652303208
Energy: 0.465002568699063
Energy: 0.4903515340723798
Energy: 0.4745688115286861
Energy: 0.4590039073748865
Energy: 0.4652782032591909
Energy: 0.46519922532943336
Energy: 0.48976058023144364
Energy: 0.4937274881807301
Energy: 0.46529699611385
Energy: 0.4653139842219181
Energy: 0.46511162227013736
Energy: 0.5572913358216977
Energy: 0.48735182463959253
Energy: 0.46480179825744855
Energy: 0.46483027220491524
Energy: 0.46527660691621436
Energy: 0.4904967053341879
Energy: 0.4875994658124452
Energy: 0.6021561063171401
Energy: 0.4875893654772871
Energy: 0.49137962970873683
Energy: 0.4892719803829801
Energy: 0.4874711989196003
Energy: 0.5130636844218027
Energy: 0.48803241406695924
Energy: 0.4910870348809849
Energy: 0.4892826407419676
Energy: 0.48775436071537703
Energy: 0.4886338753888089
Energy: 0.48744461464730643
Energy: 0.4838761955919953
Energy: 0.4887974737065613
Energy: 0.49034795315947405
Energy: 0.48832576534377664
Energy: 0.4875398138657848
Energy: 0.4832634526978444
Energy: 0.4901114203514034
Energy: 0.48889648363819427
Energy: 0.48912656253088205
Energy: 0.4903313209449013
Energy: 0.5651702286348204
Energy: 0.5120462909328252
Energy: 0.5502048136770985
Energy: 0.48922665537172655
Energy: 0.4902412987004105
Energy: 0.564848914430667
Energy: 0.5086533581851758
Energy: 0.5487029873857359
Energy: 0.5099817495918942
Energy: 0.49119160306970383
Energy: 0.4777466807475697
Energy: 0.4910321642656196
Energy: 0.5179790137659591
Energy: 0.4883584376145221
Energy: 0.4539199370161566
Energy: 0.485172272408506
Energy: 0.49115494991006686
Energy: 0.4913225363907491
Energy: 0.4922959913025744
Energy: 0.4882327226496382
Energy: 0.48926448853545274
Energy: 0.48923567803327084
Energy: 0.489785169737609
Energy: 0.49173385270883513
Energy: 0.48956565711955263
Energy: 0.465585865821506
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Energy: 0.48988764368143006
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Energy: 0.49879374070431404
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Energy: 0.48906420914162313
Energy: 0.5100352966708614
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Energy: 0.4891432871491483
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Energy: 0.46500605142211954
Energy: 0.46705252958427723
Energy: 0.4644010584335649
Energy: 0.48791946268561714
Energy: 0.48973629303011923
Energy: 0.4647266256223067
Energy: 0.46615597032600214
Energy: 0.4647716508595898
Energy: 0.4871885817844263
Energy: 0.49908150804240725
Energy: 0.45897968783573145
Energy: 0.4740875532663814
Energy: 0.47400215847898036
Energy: 0.48762582156998
Energy: 0.4967709848701791
Energy: 0.4590273444377737
Energy: 0.4944301541388951
Energy: 0.4651920783669171
Energy: 0.4647712054637157
Energy: 0.508510101979021
Energy: 0.4765868696275348
Energy: 0.5003306491548574
Energy: 0.46479870740874946
Energy: 0.5154062317954639
Energy: 0.5008999945720953
Energy: 0.47564619514508005
Energy: 0.5013130205859899
Energy: 0.4646489128801241
Energy: 0.47526157217608767
Energy: 0.46524226329236174
Energy: 0.4923151263584768
Energy: 0.49938474635915125
Energy: 0.48902338349177266
Energy: 0.5395569669142436
Energy: 0.4651720621476049
Energy: 0.4943178419343257
Energy: 0.4893596503818026
Energy: 0.49074874315248307

minimum gb energy = 0.45366452852552286 eV
minimum distance =  2.64834254163389 Angstroms
sigma value = 185


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

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Energy: 0.2869154832818171
Energy: 0.3119589497940062
Energy: 0.2675708744801737
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Energy: 0.22282500519979873
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Energy: 0.31307880121056936
Energy: 0.29023933024677084
Energy: 0.20305289018752143
Energy: 0.20554313570454588
Energy: 0.30903447732967737
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Energy: 0.29344271964099455
Energy: 0.22062197445726844
Energy: 0.2205800988289701
Energy: 0.31617701324690173
Energy: 0.28221418610156906
Energy: 0.28716609461146964
Energy: 0.2786061757020645
Energy: 0.2805587838951186
Energy: 0.29262557999872
Energy: 0.2900306544415571
Energy: 0.28106320525404904
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Energy: 0.2903221500011877
Energy: 0.2817525309736427
Energy: 0.28230247621894783
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Energy: 0.2394949785983927
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Energy: 0.2809966908710552
Energy: 0.2026497808302746
Energy: 0.3223981451842071
Energy: 0.28388526915929596
Energy: 0.3070530121847317
Energy: 0.23959857859485922

minimum gb energy = 0.20257223244161668 eV
minimum distance =  2.71932212023971 Angstroms
sigma value = 33


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

Energy: 0.7436777804037848
Energy: 0.43476573501861515
Energy: 0.45804229193799845
Energy: 0.42631861871458443
Energy: 0.43447456462471445
Energy: 0.4349293822944582
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Energy: 0.43995606446636487
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Energy: 0.4554185183822419
Energy: 0.4704050812962543
Energy: 0.4425344956913644
Energy: 0.4657728962033807
Energy: 0.5378340263215514
Energy: 0.4554570131476499
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Energy: 0.43528404698595813
Energy: 0.47697218992233853
Energy: 0.48790067676619875

minimum gb energy = 0.4254510459678843 eV
minimum distance =  2.5288118948777 Angstroms
sigma value = 219


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

Energy: 0.7241537251354512
Energy: 0.5381464499580013
Energy: 0.5395454030915662
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Energy: 0.5393699509877469
Energy: 0.5438018878802869
Energy: 0.5252658435218167
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Energy: 0.5430241677819819
Energy: 0.5327755827447532
Energy: 0.5441955546130807
Energy: 0.525390780908067
Energy: 0.5363452323666761
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Energy: 0.537862382499545
Energy: 0.5442458481950648
Energy: 0.5440239658572483
Energy: 0.5319062638665631
Energy: 0.5431402315528797
Energy: 0.5401647235026024
Energy: 0.54341647934293
Energy: 0.5448376786835146
Energy: 0.53378858937477
Energy: 0.5433919314937605
Energy: 0.5398172464558445
Energy: 0.5446841721976732
Energy: 0.5415057226356874
Energy: 0.5532645464921693
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Energy: 0.5133849685369497
Energy: 0.5393847636238422
Energy: 0.5419436434862044
Energy: 0.5524636456493168
Energy: 0.5130937482000605
Energy: 0.5457863769593488
Energy: 0.5395259847800968

minimum gb energy = 0.4980228239013314 eV
minimum distance =  2.61022826655673 Angstroms
sigma value = 15


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

Energy: 0.8510737653630677
Energy: 0.5922419009108365
Energy: 0.5923245799987921
Energy: 0.5728297364414439
Energy: 0.5911958813699244
Energy: 0.6134748725001624
Energy: 0.5917308599200977
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Energy: 0.6299903729367812
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Energy: 0.5753036343330292
Energy: 0.5767499330992456
Energy: 0.599678396330594
Energy: 0.6053737253123702
Energy: 0.6211839948314698
Energy: 0.6016158223395784
Energy: 0.5874347864840376
Energy: 0.5996641431224325
Energy: 0.6046988164253637
Energy: 0.6193024341927449
Energy: 0.6029574136378326
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minimum gb energy = 0.5632575478848991 eV
minimum distance =  2.48927368377131 Angstroms
sigma value = 293


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

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Energy: 0.6021293723218653
Energy: 0.6387490011171189
Energy: 0.5786614782378496
Energy: 0.5820663837262176
Energy: 0.570633597784327
Energy: 0.5988191094396312
Energy: 0.6219621953506758
Energy: 0.5696897082528937
Energy: 0.6014817560260518
Energy: 0.622802461975113
Energy: 0.6223203048389434
Energy: 0.6501830377234736
Energy: 0.5695908011786321
Energy: 0.601414015333566
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Energy: 0.6224896525624687
Energy: 0.6500757396693637
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Energy: 0.6224011514724818
Energy: 0.6187968310995928
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Energy: 0.6089263629000159
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Energy: 0.6105718953404546
Energy: 0.7917871735849719
Energy: 0.6268630316030027
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Energy: 0.5894206424897871
Energy: 0.6109737594504788
Energy: 0.55786452127212
Energy: 0.6123960745514363
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Energy: 0.5860280036264979
Energy: 0.5884771254852307
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Energy: 0.5710084091989931
Energy: 0.5709817298119075
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Energy: 0.5902472938424911
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Energy: 0.5721788749182244
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Energy: 0.611622775830638
Energy: 0.5697694942255092
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Energy: 0.6114292290621747
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Energy: 0.5702563970618059
Energy: 0.6116588502137453
Energy: 0.6208271583601388
Energy: 0.639055599912292
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Energy: 0.6046985336478841
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Energy: 0.6221863536802903
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Energy: 0.6184337091902175
Energy: 0.5706837877655193
Energy: 0.6481524886115414
Energy: 0.6099762402562058
Energy: 0.5904988752306619
Energy: 0.5694954934589517
Energy: 0.5715541051592519
Energy: 0.6482227467979328
Energy: 0.5593313140804765
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Energy: 0.5699936683290445
Energy: 0.569791728582727
Energy: 0.6101368894714928
Energy: 0.5584326135460156
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Energy: 0.570128233125894
Energy: 0.5700311633154185
Energy: 0.6098281712549818
Energy: 0.5581588050385204
Energy: 0.5691687758751776
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Energy: 0.5716678717679107
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Energy: 0.5686219884230465
Energy: 0.6174343324037715
Energy: 0.5853623016834746
Energy: 0.5858781086939926
Energy: 0.6014867074136901
Energy: 0.5683724852492659
Energy: 0.6176734144932476
Energy: 0.5848021497332123
Energy: 0.5853658301696358
Energy: 0.6100933529868631
Energy: 0.6016638380643675
Energy: 0.6311412892404779
Energy: 0.6047000806993547
Energy: 0.5586073475017046
Energy: 0.6009072753134761
Energy: 0.5696897310713288
Energy: 0.6316399981178349
Energy: 0.6020392775496484
Energy: 0.6110830333146333
Energy: 0.5704573391833576
Energy: 0.5758802598560641
Energy: 0.5852901439681616
Energy: 0.5916808092006638
Energy: 0.5603120135683745
Energy: 0.6066280723527746
Energy: 0.584867461952527
Energy: 0.5851189987340355
Energy: 0.5918405443995839
Energy: 0.5624392888924372
Energy: 0.5705132799944364
Energy: 0.5717437115300922
Energy: 0.584442161784934
Energy: 0.6500164740480786
Energy: 0.6196627958116193
Energy: 0.570074643429853
Energy: 0.5731504119575204
Energy: 0.5848363341102274
Energy: 0.6389504871131827
Energy: 0.6213458352760051
Energy: 0.5711681360121169
Energy: 0.6004708559627868
Energy: 0.5701134057886076
Energy: 0.5847562563982913
Energy: 0.6165934277367031
Energy: 0.5906963398255828
Energy: 0.600221321189863
Energy: 0.5700346981255652
Energy: 0.6116348756528895
Energy: 0.618377303264065
Energy: 0.5710347825592641
Energy: 0.5792514083432306
Energy: 0.619333489774485
Energy: 0.585086377698636
Energy: 0.639491083277952
Energy: 0.578352026620473
Energy: 0.5804473290901176
Energy: 0.6193133961604959
Energy: 0.5861773759086637
Energy: 0.6388205304624385
Energy: 0.5697295846534969
Energy: 0.6003775264789534
Energy: 0.5691721039762903
Energy: 0.6225735301363929
Energy: 0.6512215002786363
Energy: 0.5699917273936996
Energy: 0.6012782025687161
Energy: 0.6217390681319646
Energy: 0.6223603827111348
Energy: 0.6512390819957322
Energy: 0.5593325115565502
Energy: 0.5703053055207957
Energy: 0.569771693653889
Energy: 0.5695953954793985
Energy: 0.6223235720151746
Energy: 0.589450358651405
Energy: 0.5704795609786081
Energy: 0.6190474969787084
Energy: 0.5694948996708893
Energy: 0.559053220637785

minimum gb energy = 0.5574592878232622 eV
minimum distance =  2.51667476020886 Angstroms
sigma value = 293


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

Energy: 0.5358661776269917
Energy: 0.546774718567275
Energy: 0.5886903166899389
Energy: 0.6013836284309001
Energy: 0.5364844836502727
Energy: 0.5362876782818738
Energy: 0.5498374401208173
Energy: 0.5886023025516426
Energy: 0.6022573425100267
Energy: 0.5367328118790118
Energy: 0.5746857802392311
Energy: 0.5432908848886685
Energy: 0.5427002411782248
Energy: 0.555746348544511
Energy: 0.5427754465029404
Energy: 0.5744714322020574
Energy: 0.5434541219302362
Energy: 0.5509444012832447
Energy: 0.601329843318228
Energy: 0.5427418856215277
Energy: 0.5474166476051116
Energy: 0.6036185967151795
Energy: 0.5435234868912474
Energy: 0.5447671810519658
Energy: 0.5987099831215592
Energy: 0.5532362457299004
Energy: 0.6014460404498629
Energy: 0.5430434696000512
Energy: 0.5909605652933572
Energy: 0.5987111870476567
Energy: 0.5923992811462657
Energy: 0.5369023964145552
Energy: 0.5405030368923618
Energy: 0.5433484030608852
Energy: 0.5981023439362784
Energy: 0.590558440212647
Energy: 0.5363406047965997
Energy: 0.5366336167645475
Energy: 0.5554602426279774
Energy: 0.5408347860375773
Energy: 0.6028606389382972
Energy: 0.5366799220086195
Energy: 0.5361962235721972
Energy: 0.5752977145742905
Energy: 0.5537649402950755
Energy: 0.6018199575705555
Energy: 0.5373888246066726
Energy: 0.5365947421219722
Energy: 0.5751192981998201
Energy: 0.5546189679561319
Energy: 0.5441759351934956
Energy: 0.5946247708798467
Energy: 0.5547219272888769
Energy: 0.5445180960309604
Energy: 0.5500524435294828
Energy: 0.6010238612490759
Energy: 0.5913902702426217
Energy: 0.6031049819245201
Energy: 0.5519246979851503
Energy: 0.5495416776725708
Energy: 0.5886846297845795
Energy: 0.5408101098339833
Energy: 0.5429476560439221
Energy: 0.5430047065708233
Energy: 0.5755362174314327
Energy: 0.5444934300677767
Energy: 0.5406054005288164
Energy: 0.5427124039962669
Energy: 0.5433089408148102
Energy: 0.5428085254951579
Energy: 0.5429300468108377
Energy: 0.5980894430965934
Energy: 0.5486601383372905
Energy: 0.5359325666921568
Energy: 0.536442480830607
Energy: 0.5429195335300928
Energy: 0.633339994011144
Energy: 0.5445254019983594
Energy: 0.5358195072080955
Energy: 0.5363794616493583
Energy: 0.5427701763692515
Energy: 0.5511376125693521
Energy: 0.5431115897886446
Energy: 0.5396587444515805
Energy: 0.5751216281687394
Energy: 0.5426600048638497
Energy: 0.5556331622194791
Energy: 0.5564464674260621
Energy: 0.5382944777864748
Energy: 0.5974346513412024
Energy: 0.5519455326352022
Energy: 0.543933341594129
Energy: 0.6340766059841065
Energy: 0.5923812757018446
Energy: 0.6052489842893733
Energy: 0.5453965288774696
Energy: 0.5438801837034519
Energy: 0.633108019737374
Energy: 0.5429239567428097
Energy: 0.6036596462971303
Energy: 0.5370322685118686
Energy: 0.5579635837723207
Energy: 0.5541773680788722
Energy: 0.589134654493339
Energy: 0.5445903860623422
Energy: 0.5379328386693748
Energy: 0.5430468515838452
Energy: 0.5395913659603732
Energy: 0.5885723619940665
Energy: 0.5439796427329173
Energy: 0.5360067105110888
Energy: 0.5466866560066036
Energy: 0.5901935060470549
Energy: 0.6017716273068003
Energy: 0.5365829318268309
Energy: 0.5365257541769294
Energy: 0.5502057897604911
Energy: 0.5450739857548239
Energy: 0.6026244707224038
Energy: 0.536831885830448
Energy: 0.5747049045831296
Energy: 0.5432524927172845
Energy: 0.5426716571104347
Energy: 0.5562869582878935
Energy: 0.5427243970409907
Energy: 0.5748973019897647
Energy: 0.5434390369382477
Energy: 0.5509385261984736
Energy: 0.5432047819108419
Energy: 0.5833463863081256
Energy: 0.546997243445108
Energy: 0.6014399241380995
Energy: 0.5433520944104153
Energy: 0.5441710866738179
Energy: 0.5987028097803466
Energy: 0.5518694821891145
Energy: 0.6010319886248944
Energy: 0.5431193460949931
Energy: 0.590330327256957
Energy: 0.598712174627672
Energy: 0.5935836799993987
Energy: 0.5368871611638811
Energy: 0.5404562748961494
Energy: 0.5574323941332225
Energy: 0.5985583407690114
Energy: 0.5911932009000845
Energy: 0.5364257314959043
Energy: 0.5368226525737292
Energy: 0.5581365744621597
Energy: 0.5991538467037435
Energy: 0.6022904530506313
Energy: 0.537171575321909
Energy: 0.5361504774095178
Energy: 0.5747776783766473
Energy: 0.553478217199933
Energy: 0.6016929324052547
Energy: 0.5376407185141857
Energy: 0.5365561266326988
Energy: 0.5432609679250737
Energy: 0.5548947388848318
Energy: 0.5527310130634933
Energy: 0.5936290783669269
Energy: 0.5580553959702416
Energy: 0.5449599499400394
Energy: 0.5502805230565273
Energy: 0.6011623718307937
Energy: 0.5905797979332255
Energy: 0.6039241995852679
Energy: 0.5516071014000506
Energy: 0.5495871950824381
Energy: 0.5885582420021376
Energy: 0.5406517799522792
Energy: 0.5625260414782924
Energy: 0.543014787167767
Energy: 0.5755019340774545
Energy: 0.5885451757655463
Energy: 0.5405074268131754
Energy: 0.5428651522304284
Energy: 0.5433411862538301
Energy: 0.544761226770707
Energy: 0.5432936473297296
Energy: 0.5997157055905765
Energy: 0.5507659493934387
Energy: 0.5360010967473834
Energy: 0.5367013707471506
Energy: 0.5429187952077864
Energy: 0.6334189243960979
Energy: 0.5454540461743109
Energy: 0.5358327587324199
Energy: 0.5366457478043076
Energy: 0.5428793700015866
Energy: 0.5509490655930811
Energy: 0.5542235768518664
Energy: 0.5398651369514728
Energy: 0.574440195227778
Energy: 0.5426403051023965
Energy: 0.55544072515202
Energy: 0.5431530114996883
Energy: 0.5384884402606448
Energy: 0.5426641035105354
Energy: 0.544592253257125
Energy: 0.5432831275942125
Energy: 0.633295512221599
Energy: 0.5834422699536771
Energy: 0.6055081951873332
Energy: 0.5453298970410771
Energy: 0.5439049763824294
Energy: 0.6333700205505606
Energy: 0.5453013648178823
Energy: 0.6032734715894841
Energy: 0.5373456078456481
Energy: 0.55772089475453
Energy: 0.5558490045575425
Energy: 0.5429625301674118
Energy: 0.5748963500974023
Energy: 0.5381819354738641
Energy: 0.5580056677821945
Energy: 0.5396490256392319
Energy: 0.5526350283303529
Energy: 0.5749270319152908

minimum gb energy = 0.5358195072080955 eV
minimum distance =  2.52867314672901 Angstroms
sigma value = 15


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

Energy: 0.9458380116216122
Energy: 0.6286138678462797
Energy: 0.6334884167038769
Energy: 0.6097960442778273
Energy: 0.5846878322018366
Energy: 0.5862986828838227
Energy: 0.6168741749000071
Energy: 0.5723659329327442
Energy: 0.6154298225019357
Energy: 0.5762101950790598
Energy: 0.5618101923852336
Energy: 0.6297040446294505
Energy: 0.5913496630221929
Energy: 0.5913469746164878
Energy: 0.6208789626812514
Energy: 0.5583002796127491
Energy: 0.621598497181131
Energy: 0.591103246425024
Energy: 0.6168835936096903
Energy: 0.6011219234754501
Energy: 0.6382861485859506
Energy: 0.6123386501218885
Energy: 0.6144881304442585
Energy: 0.5968854755621578
Energy: 0.6385073102103119
Energy: 0.6463504025484175
Energy: 0.6131353721685017
Energy: 0.6219193085765342
Energy: 0.5914343544126309
Energy: 0.6354979187778985
Energy: 0.6037870792353893
Energy: 0.5620335947480941
Energy: 0.6005532936127764
Energy: 0.6418578848533797
Energy: 0.6379790240877079
Energy: 0.5966111187157963
Energy: 0.5872602165942588
Energy: 0.6131162102985463
Energy: 0.6387810658627706
Energy: 0.6393233814729652
Energy: 0.6416269606966364
Energy: 0.6105637749266891
Energy: 0.5992395265688801
Energy: 0.5619260208129765
Energy: 0.6687995932624554
Energy: 0.637738016776637
Energy: 0.6154802905636613
Energy: 0.6001795547753015
Energy: 0.5637736914201127
Energy: 0.6826570893836168
Energy: 0.6728136842477255
Energy: 0.5589504978677056
Energy: 0.5657947918926478
Energy: 0.6405595412748566
Energy: 0.6835449479889812
Energy: 0.6054051075120613
Energy: 0.5592653743726902
Energy: 0.5670250785861467
Energy: 0.6460013120647131
Energy: 0.7241884957189444
Energy: 0.569901470766834
Energy: 0.559430471298991
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Energy: 0.5734791788106303
Energy: 0.6298953311199491
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Energy: 0.5596561280748361
Energy: 0.5667777625087546
Energy: 0.566629366798426
Energy: 0.5615717226463326
Energy: 0.5627680427983813
Energy: 0.5589031639660439
Energy: 0.5620533248112685
Energy: 0.5976532036175636
Energy: 0.6103830485026038
Energy: 0.5629983449555369
Energy: 0.5596918477078118
Energy: 0.5615792510086534
Energy: 0.6266364919920888
Energy: 0.6048555000322569
Energy: 0.5753978395916618
Energy: 0.666427282515327
Energy: 0.5995435792648135
Energy: 0.6880621170670436
Energy: 0.5857122456963254
Energy: 0.575202394327681
Energy: 0.6666637276166802
Energy: 0.6074160043873836
Energy: 0.6689404226534776
Energy: 0.5624469753533381
Energy: 0.6206794541691147
Energy: 0.5845912644440121
Energy: 0.5621752534404199
Energy: 0.5844071206091553
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Energy: 0.5826185102936036
Energy: 0.6103429883121473
Energy: 0.5618633504285167
Energy: 0.5838347827348666
Energy: 0.570395247470999
Energy: 0.6135156588833159
Energy: 0.6032839722809847
Energy: 0.5720094640701099
Energy: 0.5719759910783553
Energy: 0.5684105241556983
Energy: 0.6093317391125248
Energy: 0.5738398924582009
Energy: 0.571756223721025
Energy: 0.5727236617606707
Energy: 0.5626129487559627
Energy: 0.6456339176327682
Energy: 0.6014281347603164
Energy: 0.5715906528565642
Energy: 0.5483019232874129
Energy: 0.6072590726461659
Energy: 0.6454281165089775
Energy: 0.6129315703627791
Energy: 0.5712791325628528
Energy: 0.5494780012666275
Energy: 0.6039997523103694
Energy: 0.6209195008382528
Energy: 0.5994785778187842
Energy: 0.587154503544703
Energy: 0.5779621226629885
Energy: 0.6114319521917116
Energy: 0.6215389736375653
Energy: 0.6097606328915522
Energy: 0.5827392106313168
Energy: 0.5790303650788717
Energy: 0.6111797034938411
Energy: 0.5889822033715578
Energy: 0.6056353034093935
Energy: 0.5486935476801659
Energy: 0.6276706049484339
Energy: 0.6013021186964839
Energy: 0.5875460264498072
Energy: 0.6053050328242368
Energy: 0.5416762996791616
Energy: 0.620952113167625
Energy: 0.603050765128032
Energy: 0.5751634570049031
Energy: 0.6171440620830573
Energy: 0.6420110305408974
Energy: 0.6183507758045637
Energy: 0.6037784277302523
Energy: 0.5684907531369563
Energy: 0.6176699945173226
Energy: 0.6426587357078817
Energy: 0.6160661165218104
Energy: 0.6032019626557878
Energy: 0.674367583319074
Energy: 0.650191581920487
Energy: 0.6520541761397414
Energy: 0.6424372577602835
Energy: 0.6266134464718565
Energy: 0.6746965107177634
Energy: 0.6501840626171356
Energy: 0.651519194567962
Energy: 0.6449746338983446
Energy: 0.5697736201787119
Energy: 0.6004084058834471
Energy: 0.5942662771015704
Energy: 0.6908834722858501
Energy: 0.6767338645087553
Energy: 0.6235870080588317
Energy: 0.6019796827455455
Energy: 0.6480204640037259
Energy: 0.693082426060992
Energy: 0.6727759045785316
Energy: 0.6229679834282913
Energy: 0.5797817757896087
Energy: 0.6663752147251644
Energy: 0.6845326527038311
Energy: 0.5632432448579767
Energy: 0.5650582337403546
Energy: 0.6532586597286272
Energy: 0.6661126768089042
Energy: 0.6686212945201608
Energy: 0.5629296433250448
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Energy: 0.5673493668970064
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Energy: 0.5922020567263582
Energy: 0.5842752797073874
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Energy: 0.5755696707257387
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Energy: 0.6051993551962469
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Energy: 0.6222129559449222
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Energy: 0.5851226140195981
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Energy: 0.6468008337206708
Energy: 0.6487722861206696
Energy: 0.5503496920031006
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Energy: 0.6115078910650256
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Energy: 0.6628929752344203
Energy: 0.5625318341897692
Energy: 0.6367392852670283
Energy: 0.6673950236032684
Energy: 0.6668033618473116
Energy: 0.6284790698839728
Energy: 0.5634452921116417
Energy: 0.5741508440840243
Energy: 0.6490453940455212
Energy: 0.5633653864698608
Energy: 0.5600475782745664
Energy: 0.564670589912132
Energy: 0.574605637841001
Energy: 0.6656318393745004
Energy: 0.5633182289676798
Energy: 0.5594024058732191
Energy: 0.5612246309001541
Energy: 0.564139156214261
Energy: 0.6129372166680356
Energy: 0.6188206334000815
Energy: 0.5619065689064734
Energy: 0.5601188639662847
Energy: 0.6006390922833797
Energy: 0.6179174610035841
Energy: 0.5695537719749365
Energy: 0.5610724653222027
Energy: 0.5603469102843122
Energy: 0.6122449679128066
Energy: 0.6022645164602517
Energy: 0.5636719702247341
Energy: 0.6027759161077845
Energy: 0.5812715728220117
Energy: 0.6378860287201211
Energy: 0.6121012614318224
Energy: 0.5601160888808817
Energy: 0.6081135772567503
Energy: 0.6097057398995035
Energy: 0.5597048713595015
Energy: 0.5648352754166417
Energy: 0.5940151254628487
Energy: 0.6807084581016795
Energy: 0.5746401977062389
Energy: 0.5630447592808423
Energy: 0.5678911027988096
Energy: 0.59890865669999
Energy: 0.6826472559720903
Energy: 0.5756429834811218
Energy: 0.5626889566078191
Energy: 0.5608412204608069
Energy: 0.5603779642066165
Energy: 0.6819478904922299
Energy: 0.5668691588486104
Energy: 0.5653019038415734
Energy: 0.569560998623884
Energy: 0.5634853439602021
Energy: 0.6265914308959168
Energy: 0.5639115854917193
Energy: 0.5623255161187968
Energy: 0.5519368177727493
Energy: 0.6530124817483113
Energy: 0.6492181277842676
Energy: 0.5715048432525943
Energy: 0.564033197802628
Energy: 0.5681043628498513
Energy: 0.6527843422817935
Energy: 0.6164858113949888
Energy: 0.5693155278040749
Energy: 0.6737295600926456
Energy: 0.632743944459087
Energy: 0.6152120440127012
Energy: 0.6023173419409081
Energy: 0.5439078544662295
Energy: 0.5876402030857466
Energy: 0.6160715710234181
Energy: 0.6900258183976944
Energy: 0.6239759165990987
Energy: 0.5537673786147777

minimum gb energy = 0.539865554226189 eV
minimum distance =  2.47968010055954 Angstroms
sigma value = 437


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

Energy: 0.7345251186780106
Energy: 0.6315598544536591
Energy: 0.6320071076685597
Energy: 0.656248271019126
Energy: 0.5355563055769249
Energy: 0.7355150373405765
Energy: 0.6323212535871331
Energy: 0.6203005582701807
Energy: 0.6564877011412336
Energy: 0.6187305576825355
Energy: 0.5795317482742063
Energy: 0.6532520395446524
Energy: 0.6204135677207221
Energy: 0.6182924001476876
Energy: 0.5899507049629154
Energy: 0.588199798764482
Energy: 0.653174760710555
Energy: 0.6183218528107972
Energy: 0.6020372440614661
Energy: 0.5521828687029549
Energy: 0.5805264253294588
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Energy: 0.6022334143483423
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Energy: 0.5815159618805859
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Energy: 0.602186338595046
Energy: 0.5524366411753704
Energy: 0.5751627961188568
Energy: 0.5516156920470532
Energy: 0.5531088099638738
Energy: 0.6017297788082335
Energy: 0.5807624191393302
Energy: 0.5719551767868407
Energy: 0.5531791503696931
Energy: 0.5541744704933037
Energy: 0.6011306158365343
Energy: 0.5808329957502479
Energy: 0.5839975356259062
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Energy: 0.6037418008084801
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Energy: 0.5806893176764325
Energy: 0.6040481655557903
Energy: 0.5512974213460357
Energy: 0.5497132754310454
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Energy: 0.5936034664905251
Energy: 0.5508096993801259
Energy: 0.5772658392397942
Energy: 0.5517461100111102
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Energy: 0.5952888612454635
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Energy: 0.5809971543767121
Energy: 0.7347196191863694
Energy: 0.5937402208661031
Energy: 0.5776590687264129
Energy: 0.5763585967101561
Energy: 0.5562239514675699
Energy: 0.5997962154032623
Energy: 0.5793593336493466
Energy: 0.5768617961717364
Energy: 0.5766239567216025
Energy: 0.5512393922216144
Energy: 0.6002028947769467
Energy: 0.593285646986778
Energy: 0.5786358068369698
Energy: 0.553957058082702
Energy: 0.6796073680215922
Energy: 0.6030736326432966
Energy: 0.5931318828052314
Energy: 0.5774840870223868
Energy: 0.5515738238176641
Energy: 0.677762470133454
Energy: 0.6553496845508565
Energy: 0.5507533557268772
Energy: 0.6718311985656262
Energy: 0.5719696067912031
Energy: 0.6052214721245355
Energy: 0.5995329067790772
Energy: 0.550435746608239
Energy: 0.6701526216627994
Energy: 0.5720943979207173
Energy: 0.6036708203604458
Energy: 0.5513069421902342
Energy: 0.6343397488080953
Energy: 0.6832203250464027
Energy: 0.5373635312591115
Energy: 0.5828760606402911
Energy: 0.602136324271665
Energy: 0.5778850835468031
Energy: 0.5516826165329468
Energy: 0.5376723150358966
Energy: 0.5830658735969384
Energy: 0.6024685643065328
Energy: 0.5331759166376053
Energy: 0.5332831353613118
Energy: 0.5388259983944738
Energy: 0.5823945675776084
Energy: 0.5337866429999125
Energy: 0.5327942926258779
Energy: 0.5334596825481502
Energy: 0.5403294580748917
Energy: 0.7298757868421929
Energy: 0.5513226427446228
Energy: 0.5347024664427446
Energy: 0.536311585843627
Energy: 0.5385043073223865
Energy: 0.6253459947579927
Energy: 0.5389192819304198
Energy: 0.5344037432500841
Energy: 0.5354914918666221
Energy: 0.5373656587555458
Energy: 0.5366472400892032
Energy: 0.5389418429208288
Energy: 0.5330705776145638
Energy: 0.535758704681232
Energy: 0.677674764694768
Energy: 0.602257550495582
Energy: 0.5382726650270349
Energy: 0.5328623746748291
Energy: 0.5375810511425482
Energy: 0.6770838764460992
Energy: 0.6023310655030182
Energy: 0.5368816186658352
Energy: 0.6191716163783422
Energy: 0.6326332079420857
Energy: 0.6432786431647751
Energy: 0.5897264511249256
Energy: 0.5374174175227636
Energy: 0.6153017085106992
Energy: 0.5395807460084657
Energy: 0.6208056320133788
Energy: 0.5903292117226258
Energy: 0.5622090379634361

minimum gb energy = 0.5327942926258779 eV
minimum distance =  2.63747426067195 Angstroms
sigma value = 33