Model name: model_name=EAM_Dynamo_FischerSchmitzEich_2019_CuNi__MO_266134052596_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.519999980926514
cohesive_energy=4.450349999665976
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 0.018161443269787726
Energy: 1.2957827706749
Energy: 1.2957827706745693
Energy: 0.018197499101404575
Energy: 1.2957827706752307
Energy: 0.018197499101404575
Energy: 1.2957827706742386
Energy: 0.018197499101404575
Energy: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 0.018161443269787726
Energy: 1.2957827706752307
Energy: 0.018161443269787726
Energy: 1.2957827706752307
Energy: 1.2957827706745693
Energy: 0.018197499101404575
Energy: 1.2957827706752307
Energy: 0.018197499101404575
Energy: 1.2957827706745693
Energy: 0.01819749910173534
Energy: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 0.018161443269787726
Energy: 1.2957827706745693
Energy: 1.2957827706745693
Energy: 0.0181974991007798
Energy: 1.2957827706752307
Energy: 0.01819749910173534
Energy: 1.2957827706752307
Energy: 0.0181974991007798

minimum gb energy = 0.018161443269787726 eV
minimum distance =  2.48797112108712 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.4207385046103587
Energy: 1.3551349798679628
Energy: 1.4207385046103587
Energy: 1.3551349798671666
Energy: 1.4207385046095622
Energy: 1.355134979868759
Energy: 1.5155732605279832
Energy: 1.2625554421627458
Energy: 1.276415103443585
Energy: 1.262555442163542
Energy: 1.2763464296048705
Energy: 1.2625554421627458
Energy: 1.3328722296455666
Energy: 1.417381186516868
Energy: 1.3328722296439741
Energy: 1.417381186516868
Energy: 1.332872229639197
Energy: 1.4173811865207766
Energy: 1.5441548947421586
Energy: 1.32288180323591
Energy: 1.5441548947397703
Energy: 1.3228818032351137
Energy: 1.5441548947421586
Energy: 1.3228818032351137
Energy: 1.3552896873158642
Energy: 1.4754942083691793
Energy: 1.355289687315068
Energy: 1.4754942083691793
Energy: 1.3552896873174567
Energy: 1.475494208368383
Energy: 1.4573131064421487
Energy: 1.2773274350482016
Energy: 1.4573131064437412
Energy: 1.2773274350489978
Energy: 1.457313106447722
Energy: 1.2773274350513866
Energy: 1.340689660904942
Energy: 1.3861971227123064
Energy: 1.3406896609041459
Energy: 1.386197122718676
Energy: 1.3406896609081267
Energy: 1.3861971227131027
Energy: 1.3102235160446212
Energy: 1.4880825779771885
Energy: 1.3102235160414362
Energy: 1.4880825779755962
Energy: 1.3102235160462137
Energy: 1.4880825779716151
Energy: 1.469768091926211
Energy: 1.3947272399485555
Energy: 1.4697680919254148
Energy: 1.3947272399469632
Energy: 1.469768091923026
Energy: 1.3947272399469632
Energy: 1.2500560406731533
Energy: 1.465928852728458
Energy: 1.2500560406699686
Energy: 1.4659288527268657
Energy: 1.2500560406707646
Energy: 1.4659288527308467
Energy: 1.6356796961618807
Energy: 1.2767940944131264
Energy: 1.6356796961618807
Energy: 1.2767940944123306
Energy: 1.6356796961610847
Energy: 1.2767940944131264
Energy: 1.2414182477355162
Energy: 1.5303678264232026
Energy: 1.2414182477363123
Energy: 1.5303678264144445
Energy: 1.2414182477363123
Energy: 1.5303678264120562
Energy: 1.5662165926149894
Energy: 1.2170588165327891
Energy: 1.566216592614193
Energy: 1.2170588165343816
Energy: 1.5662165926149894
Energy: 1.2170588165327891
Energy: 1.3066229903655628
Energy: 1.3411442149801065
Energy: 1.3066229903639703
Energy: 1.341144214978514
Energy: 1.3066229903647666
Energy: 1.3411442149777903
Energy: 1.563084212161816
Energy: 1.2588464930105085
Energy: 1.563084212162612
Energy: 1.2588464930089165
Energy: 1.5630842121610196
Energy: 1.2588464930089165
Energy: 1.5747809371256742
Energy: 1.4177979623277042
Energy: 1.5747809371256742
Energy: 1.4177979623277042
Energy: 1.5747809371264703
Energy: 1.4177979623292964
Energy: 1.3651225144304366
Energy: 1.3769888684186469
Energy: 1.3651225144328254
Energy: 1.3769888684130733
Energy: 1.3651225144288444
Energy: 1.3769888684138698
Energy: 1.364997205723367
Energy: 1.3383948372662275
Energy: 1.3649972057193858
Energy: 1.3383948372686163
Energy: 1.364997205720182
Energy: 1.338394837264635
Energy: 1.3228642938409427
Energy: 1.3219301333968227
Energy: 1.3228642938441275
Energy: 1.321930133397619
Energy: 1.3228642938425352
Energy: 1.3219301333920455
Energy: 1.4395827153457863
Energy: 1.2770839097345732
Energy: 1.4395827153617102
Energy: 1.2770839097329807
Energy: 1.4395827153545446
Energy: 1.2770839097361657
Energy: 1.2847820051558405
Energy: 1.729410312583704
Energy: 1.284782005157433
Energy: 1.7294103125805191
Energy: 1.2847820051566368
Energy: 1.7294103125860927
Energy: 1.4207096160635628
Energy: 1.3894813066636718
Energy: 1.420709616059582
Energy: 1.389481306664468
Energy: 1.4207096160579895
Energy: 1.3894813066636718
Energy: 1.2327658224111335
Energy: 1.5164483656727317
Energy: 1.2327658224119298
Energy: 1.5164483656719354
Energy: 1.2327658224119298
Energy: 1.5164483656727317

minimum gb energy = 1.2170588165327891 eV
minimum distance =  2.1955138208958 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.5550095468098386
Energy: 1.4791221792060443
Energy: 1.5550095468098386
Energy: 1.4791221792042328
Energy: 1.5550095468098386
Energy: 1.4791221792046854
Energy: 1.5221859841919252
Energy: 1.3298086039276509
Energy: 1.5221859841896608
Energy: 1.3298086039271984
Energy: 1.5221859841914722
Energy: 1.3298086039285568
Energy: 1.2970032628247237
Energy: 1.3285325464010154
Energy: 1.2970032628256296
Energy: 1.3285325464037325
Energy: 1.2970032628260826
Energy: 1.3285325464001096
Energy: 1.4483939646752426
Energy: 1.5123717545715476
Energy: 1.448393964673884
Energy: 1.5123717545710946
Energy: 1.4483939646747896
Energy: 1.5123717545710946
Energy: 1.3823143951595942
Energy: 1.4195406326130349
Energy: 1.3823143951614059
Energy: 1.4195406326116764
Energy: 1.3823143951600472
Energy: 1.4195406326152993
Energy: 1.2929226125601578
Energy: 1.2967921596335616
Energy: 1.2929226125601578
Energy: 1.2967921596276741
Energy: 1.292922612559705
Energy: 1.2967921596340142
Energy: 1.4631906830294892
Energy: 1.4811263294734176
Energy: 1.4631906830303951
Energy: 1.481126329475229
Energy: 1.4631906830322066
Energy: 1.4811263294688892
Energy: 1.2336660727108228
Energy: 1.5569623279109577
Energy: 1.2336660727117286
Energy: 1.5569623279009945
Energy: 1.2336660727103699
Energy: 1.5569623278996356
Energy: 1.3144031518248165
Energy: 1.3018737463841106
Energy: 1.3144031518257222
Energy: 1.3018737463836578
Energy: 1.3144031518248165
Energy: 1.301873746383205
Energy: 1.2461096678742432
Energy: 1.5365025189666852
Energy: 1.2461096678719787
Energy: 1.536502518967591
Energy: 1.2461096678728847
Energy: 1.5365025189689496
Energy: 1.5915854628938
Energy: 1.2490869925442292
Energy: 1.5915854628901769
Energy: 1.249086992544682
Energy: 1.591585462893347
Energy: 1.2490869925442292
Energy: 1.2983101035076368
Energy: 1.4081799512056747
Energy: 1.2983101035085425
Energy: 1.4081799512065805
Energy: 1.2983101035080895
Energy: 1.4081799512034103
Energy: 1.4042066484226132
Energy: 1.2516743333276779
Energy: 1.4042066484144615
Energy: 1.2516743333276779
Energy: 1.4042066484140086
Energy: 1.2516743333276779
Energy: 1.4032453048044273
Energy: 1.4592987268871482
Energy: 1.4032453048085032
Energy: 1.4592987268862423
Energy: 1.4032453048062388
Energy: 1.4592987268866953
Energy: 1.4209335360006234
Energy: 1.3281979299773377
Energy: 1.4209335360006234
Energy: 1.3281979299741677
Energy: 1.420933535998812
Energy: 1.3281979299723563
Energy: 1.2971379645639924
Energy: 1.3288237326978534
Energy: 1.2971379645612753
Energy: 1.328823732701929
Energy: 1.297137964561728
Energy: 1.3288237327064578
Energy: 1.4572714861368197
Energy: 1.437650890772897
Energy: 1.4572714861368197
Energy: 1.437650890772897
Energy: 1.457271486135914
Energy: 1.4376508907724441
Energy: 1.3819531319658438
Energy: 1.297616619680179
Energy: 1.381953131961768
Energy: 1.2976166196824435
Energy: 1.3819531319599565
Energy: 1.2976166196851608
Energy: 1.2957831557122097
Energy: 1.3270165322996623
Energy: 1.2957831557131154
Energy: 1.3270165322992094
Energy: 1.2957831557126624
Energy: 1.3270165322992094
Energy: 1.4733401002412883
Energy: 1.4836724154111884
Energy: 1.4733401002426467
Energy: 1.4836724154111884
Energy: 1.4733401002421942
Energy: 1.4836724154111884
Energy: 1.2329254721754337
Energy: 1.6186416718120775
Energy: 1.2329254721754337
Energy: 1.6186416718175116
Energy: 1.232925472174981
Energy: 1.6186416718206407
Energy: 1.5538704562538688
Energy: 1.3015921382769453
Energy: 1.5538704562543215
Energy: 1.3015921382764926
Energy: 1.55387045625251
Energy: 1.3015921382760396
Energy: 1.247069442657437
Energy: 1.536671754910222
Energy: 1.2470694426578899
Energy: 1.5366717549120334
Energy: 1.247069442657437
Energy: 1.5366717549079576
Energy: 1.6044159764572923
Energy: 1.3827228635984337
Energy: 1.6044159764563868
Energy: 1.3827228636025095
Energy: 1.6044159764554808
Energy: 1.382722863600698
Energy: 1.2970389765277097
Energy: 1.2931364679843254
Energy: 1.297038976533597
Energy: 1.2931364679793438
Energy: 1.2970389765317856
Energy: 1.2931364679829667
Energy: 1.557201214913751
Energy: 1.447176168533565
Energy: 1.557201214914657
Energy: 1.4471761685394522
Energy: 1.5572012149096752
Energy: 1.447176168530395
Energy: 1.5558341179853739
Energy: 1.4446544504121728
Energy: 1.5558341179867325
Energy: 1.4446544504130787
Energy: 1.5558341179912611
Energy: 1.4446544504148902
Energy: 1.297411763450573
Energy: 1.3278723776248036
Energy: 1.2974117634510258
Energy: 1.3278723776211805
Energy: 1.2974117634532902
Energy: 1.3278723776279737
Energy: 1.5367315620893296
Energy: 1.3290048363053026
Energy: 1.5367315620893296
Energy: 1.3290048363053026
Energy: 1.5367315620861592
Energy: 1.3290048363053026
Energy: 1.2471060740081794
Energy: 1.574983820271164
Energy: 1.247106074009085
Energy: 1.5749838202725224
Energy: 1.2471060740081794
Energy: 1.5749838202747868
Energy: 1.522963495533524
Energy: 1.3018827028236473
Energy: 1.5229634955326181
Energy: 1.3018827028241002
Energy: 1.5229634955317126
Energy: 1.3018827028231945
Energy: 1.2510075214532126
Energy: 1.4816050042326854
Energy: 1.2510075214527598
Energy: 1.4816050042290623
Energy: 1.2510075214545713
Energy: 1.4816050042281568
Energy: 1.4726155882834189
Energy: 1.4834639282996578
Energy: 1.4726155882811545
Energy: 1.4834639283001105
Energy: 1.4726155882834189
Energy: 1.4834639282996578
Energy: 1.3304328722825678
Energy: 1.4215683006298245
Energy: 1.3304328722771332
Energy: 1.4215683006266542
Energy: 1.3304328722807564
Energy: 1.4215683006248427
Energy: 1.3287054668537215
Energy: 1.2970323958036418
Energy: 1.3287054668645901
Energy: 1.2970323958045475
Energy: 1.3287054668564386
Energy: 1.2970323958054533
Energy: 1.517446628336252
Energy: 1.4488126988751187
Energy: 1.5174466283353463
Energy: 1.448812698874666
Energy: 1.5174466283357992
Energy: 1.448812698874213
Energy: 1.2981567679647803
Energy: 1.382161375318661
Energy: 1.2981567679656858
Energy: 1.3821613753173023
Energy: 1.2981567679661388
Energy: 1.3821613753159439
Energy: 1.2970375527356448
Energy: 1.293549506409343
Energy: 1.2970375527329276
Energy: 1.2935495064102487
Energy: 1.297037552732022
Energy: 1.2935495064102487
Energy: 1.4031475233337625
Energy: 1.4556809769660832
Energy: 1.4031475233251578
Energy: 1.4556809769651775
Energy: 1.4031475233333095
Energy: 1.4556809769620074
Energy: 1.620007893936897
Energy: 1.2290517540159631
Energy: 1.6200078939396139
Energy: 1.2290517540159631
Energy: 1.6200078939350855
Energy: 1.2290517540159631
Energy: 1.2983541540650718
Energy: 1.3124929536698393
Energy: 1.2983541540632604
Energy: 1.3124929536702923
Energy: 1.2983541540637134
Energy: 1.3124929536698393

minimum gb energy = 1.2290517540159631 eV
minimum distance =  2.32959522097394 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.4134799642121338
Energy: 1.4255054436374173
Energy: 1.4134799642142324
Energy: 1.4255054436374173
Energy: 1.4134799642121338
Energy: 1.425505443636368
Energy: 1.515095160149198
Energy: 1.3294037685207925
Energy: 1.5150951353538642
Energy: 1.3294037685207925
Energy: 1.5150951882189956
Energy: 1.3294037685207925
Energy: 1.2962286766101598
Energy: 1.6304371832210147
Energy: 1.2962286766049134
Energy: 1.6304371832252116
Energy: 1.296228676608061
Energy: 1.6304371832241622
Energy: 1.4028988846605037
Energy: 1.2353986965962784
Energy: 1.4028988846636514
Energy: 1.2353986965962784
Energy: 1.4028988846636514
Energy: 1.2353986965962784
Energy: 1.4198840107084751
Energy: 1.3548329105892198
Energy: 1.4198840107147708
Energy: 1.3548329105892198
Energy: 1.4198840107084751
Energy: 1.3548329105913186
Energy: 1.4191812802906554
Energy: 1.3547322738218341
Energy: 1.4191812802896062
Energy: 1.3547322738218341
Energy: 1.419181280292754
Energy: 1.3547322738197354
Energy: 1.3511364400734398
Energy: 1.3543108670927517
Energy: 1.3511364400744892
Energy: 1.3543108670875053
Energy: 1.351136440076588
Energy: 1.3543108670875053
Energy: 1.3019875038277844
Energy: 1.35626511264577
Energy: 1.3019875038277844
Energy: 1.35626511264577
Energy: 1.3019875038256858
Energy: 1.3562651126447207
Energy: 1.5915319929781986
Energy: 1.2350617722856554
Energy: 1.5915319929781986
Energy: 1.2350617722856554
Energy: 1.5915319929761
Energy: 1.2350617722856554
Energy: 1.2807459486364088
Energy: 1.6038275686803505
Energy: 1.2807459486395567
Energy: 1.6038275686803505
Energy: 1.2807459486364088
Energy: 1.603827568682449
Energy: 1.4667518682728584
Energy: 1.2468441385346258
Energy: 1.4667473948030798
Energy: 1.2468441385346258
Energy: 1.4667491343521561
Energy: 1.2468441385346258
Energy: 1.4107691354144083
Energy: 1.4274715528550121
Energy: 1.4107691354144083
Energy: 1.427471552853963
Energy: 1.4107691354133591
Energy: 1.4274715528550121
Energy: 1.598656573948217
Energy: 1.3304360208816772
Energy: 1.598656573948217
Energy: 1.3304360208806278
Energy: 1.5986565739566116
Energy: 1.3304360208806278
Energy: 1.3244005116216848
Energy: 1.3399487321343415
Energy: 1.3244005116174875
Energy: 1.3399487321353907
Energy: 1.3244005116206354
Energy: 1.3399487321343415
Energy: 1.402396408776141
Energy: 1.4295135936864793
Energy: 1.4023964087750915
Energy: 1.4295135936875287
Energy: 1.4023964087750915
Energy: 1.4295135936864793
Energy: 1.41954721795128
Energy: 1.3546420067772094
Energy: 1.4195472179523294
Energy: 1.3546420067751106
Energy: 1.4195472179502309
Energy: 1.3546420067751106
Energy: 1.4193514841834167
Energy: 1.4643777481404558
Energy: 1.4193514841844659
Energy: 1.464377748141505
Energy: 1.4193514841834167
Energy: 1.464377748141505
Energy: 1.380773838015961
Energy: 1.3610347395414437
Energy: 1.380773838015961
Energy: 1.3610347395414437
Energy: 1.380773838015961
Energy: 1.3610347395414437

minimum gb energy = 1.2350617722856554 eV
minimum distance =  2.19662790388345 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.2028817194265893
Energy: 1.1815933205816784
Energy: 1.2028817194272117
Energy: 1.1815933205816784
Energy: 1.2028817194265893
Energy: 1.1815933205816784
Energy: 1.340169561015519
Energy: 1.4141789750445786
Energy: 1.340169561015519
Energy: 1.4141789750458236
Energy: 1.3401695610161415
Energy: 1.4141789750470686
Energy: 1.109973698506425
Energy: 1.412395209860174
Energy: 1.109973698506425
Energy: 1.4123952098564396
Energy: 1.10997369850767
Energy: 1.4123952098589292
Energy: 1.2672728363561416
Energy: 1.1103041947343781
Energy: 1.2672728363573864
Energy: 1.1103041947343781
Energy: 1.2672728363548966
Energy: 1.1103041947350003
Energy: 1.1647058097548235
Energy: 1.200124497858876
Energy: 1.1647058097517116
Energy: 1.2001244978594983
Energy: 1.164705809751089
Energy: 1.2001244978613654
Energy: 1.1651216862842402
Energy: 1.2002158606574236
Energy: 1.1651216862829956
Energy: 1.2002158606568012
Energy: 1.1651216862836178
Energy: 1.2002158606568012
Energy: 1.2673279246747318
Energy: 1.1102992123971225
Energy: 1.267327924675354
Energy: 1.1102992123965283
Energy: 1.2673279246716196
Energy: 1.1102992123971225
Energy: 1.1099851904359006
Energy: 1.4124661605217095
Energy: 1.1099851904359006
Energy: 1.4124661605229543
Energy: 1.1099851904365232
Energy: 1.4124661605217095
Energy: 1.3401258124716304
Energy: 1.4141603820237831
Energy: 1.3401258124734978
Energy: 1.4141603820212936
Energy: 1.3401258124685183
Energy: 1.4141603820225381
Energy: 1.2028817194265893
Energy: 1.1815933205823006
Energy: 1.2028817194272117
Energy: 1.1815933205823006
Energy: 1.2028817194265893
Energy: 1.181593320582923
Energy: 1.340169561015519
Energy: 1.414178975043334
Energy: 1.3401695610180087
Energy: 1.4141789750452012
Energy: 1.3401695610167639
Energy: 1.4141789750452012
Energy: 1.1099736985045863
Energy: 1.4123952098620414
Energy: 1.109973698505831
Energy: 1.4123952098595518
Energy: 1.1099736985070474
Energy: 1.4123952098583068
Energy: 1.267272836353652
Energy: 1.1103041947343781
Energy: 1.2672728363548966
Energy: 1.1103041947356227
Energy: 1.2672728363548966
Energy: 1.1103041947350003
Energy: 1.1647058097548235
Energy: 1.2001244978601207
Energy: 1.164705809752334
Energy: 1.2001244978594983
Energy: 1.164705809755446
Energy: 1.200124497858876
Energy: 1.1651216862861076
Energy: 1.2002158606561788
Energy: 1.1651216862805058
Energy: 1.2002158606568012
Energy: 1.165121686282373
Energy: 1.2002158606592908
Energy: 1.2673279246697524
Energy: 1.1102992123971225
Energy: 1.2673279246772213
Energy: 1.1102992123965283
Energy: 1.2673279246728644
Energy: 1.1102992123971225
Energy: 1.1099851904359006
Energy: 1.412466160519842
Energy: 1.1099851904334113
Energy: 1.4124661605217095
Energy: 1.1099851904340337
Energy: 1.412466160519842
Energy: 1.3401258124722528
Energy: 1.4141603820219157
Energy: 1.34012581247412
Energy: 1.4141603820219157
Energy: 1.3401258124697633
Energy: 1.4141603820225381
Energy: 1.202881719427834
Energy: 1.1815933205816784
Energy: 1.2028817194272117
Energy: 1.1815933205823006
Energy: 1.2028817194272117
Energy: 1.1815933205816784
Energy: 1.3401695610142743
Energy: 1.4141789750445786
Energy: 1.3401695610161415
Energy: 1.4141789750452012
Energy: 1.3401695610161415
Energy: 1.4141789750445786
Energy: 1.10997369850767
Energy: 1.4123952098589292
Energy: 1.10997369850767
Energy: 1.4123952098583068
Energy: 1.109973698505831
Energy: 1.4123952098589292
Energy: 1.267272836356764
Energy: 1.1103041947350003
Energy: 1.2672728363542742
Energy: 1.1103041947356227
Energy: 1.267272836352407
Energy: 1.1103041947343781
Energy: 1.164705809749222
Energy: 1.2001244978607433
Energy: 1.1647058097498442
Energy: 1.2001244978594983
Energy: 1.1647058097517116
Energy: 1.2001244978601207
Energy: 1.1651216862829956
Energy: 1.2002158606568012
Energy: 1.1651216862848628
Energy: 1.200215860658046
Energy: 1.1651216862842402
Energy: 1.200215860658046
Energy: 1.267327924672242
Energy: 1.1102992123971225
Energy: 1.2673279246709972
Energy: 1.1102992123983673
Energy: 1.267327924672242
Energy: 1.1102992123971225
Energy: 1.1099851904340337
Energy: 1.4124661605229543
Energy: 1.1099851904334113
Energy: 1.4124661605223316
Energy: 1.1099851904334113
Energy: 1.4124661605179751
Energy: 1.3401258124716304
Energy: 1.4141603820219157
Energy: 1.3401258124728752
Energy: 1.4141603820225381
Energy: 1.3401258124685183
Energy: 1.4141603820237831
Energy: 1.2028817194272117
Energy: 1.1815933205816784
Energy: 1.2028817194272117
Energy: 1.181593320582923
Energy: 1.2028817194272117
Energy: 1.181593320582923
Energy: 1.3401695610180087
Energy: 1.4141789750439564
Energy: 1.3401695610161415
Energy: 1.4141789750427116
Energy: 1.3401695610167639
Energy: 1.4141789750464462
Energy: 1.10997369850767
Energy: 1.4123952098576846
Energy: 1.109973698505831
Energy: 1.4123952098570622
Energy: 1.1099736985045863
Energy: 1.4123952098614188

minimum gb energy = 1.1099736985045863 eV
minimum distance =  2.21428089329899 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.1794903970906891
Energy: 1.126453460999796
Energy: 1.1794903970891646
Energy: 1.1264534610013208
Energy: 1.1794903970906891
Energy: 1.1264534610013208
Energy: 1.4856428405043196
Energy: 1.1994015465692147
Energy: 1.4856428404982212
Energy: 1.1994015465676902
Energy: 1.4856428405073687
Energy: 1.1994015465722638
Energy: 1.1527024871760343
Energy: 1.3277540999574795
Energy: 1.1527024871790834
Energy: 1.3277540999574795
Energy: 1.1527024871775586
Energy: 1.3277540999574795
Energy: 1.289430927786763
Energy: 1.0913070545967711
Energy: 1.289430927783714
Energy: 1.0913070545952466
Energy: 1.2894309277852385
Energy: 1.0913070545967711
Energy: 1.2888826455244207
Energy: 1.0912427815507226
Energy: 1.2888826455244207
Energy: 1.0912427815522472
Energy: 1.2888826455274698
Energy: 1.0912427815522472
Energy: 1.2974732285066677
Energy: 1.3712914043497701
Energy: 1.2974732285066677
Energy: 1.3712914043512947
Energy: 1.2974732285051431
Energy: 1.3712914043512947
Energy: 1.2031251560052092
Energy: 1.2013875807491032
Energy: 1.2031251560052092
Energy: 1.2013875807491032
Energy: 1.2031251560036842
Energy: 1.201387580750628
Energy: 1.1749072671666032
Energy: 1.1268866933322341
Energy: 1.1749072671650787
Energy: 1.126886693329185
Energy: 1.1749072671635543
Energy: 1.126886693329185
Energy: 1.3335203510296338
Energy: 1.1536462553083422
Energy: 1.3335203510281093
Energy: 1.1536462553083422
Energy: 1.3335203510265845
Energy: 1.1536462553068176
Energy: 1.2769499584755204
Energy: 1.3471363487185386
Energy: 1.2769499584755204
Energy: 1.3471363487200634
Energy: 1.2769499584755204
Energy: 1.3471363487200634
Energy: 1.1276186124438639
Energy: 1.0916960174810777
Energy: 1.1276186124438639
Energy: 1.0916960174810777
Energy: 1.1276186124453884
Energy: 1.0916960174810777
Energy: 1.365537935144149
Energy: 1.242476090085622
Energy: 1.365537935144149
Energy: 1.2424760900886713
Energy: 1.365537935144149
Energy: 1.2424760900871465

minimum gb energy = 1.0912427815507226 eV
minimum distance =  2.19146278867774 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.143410800147565
Energy: 1.1213389052311016
Energy: 1.1434108001467085
Energy: 1.1213389052311016
Energy: 1.143410800147565
Energy: 1.1213389052306733
Energy: 1.4950431090546519
Energy: 1.0674100676112492
Energy: 1.4950431090559368
Energy: 1.0674100676112492
Energy: 1.495043109053795
Energy: 1.0674100676116776
Energy: 1.008161973270217
Energy: 1.44608222597336
Energy: 1.0081619732710347
Energy: 1.4460822259716466
Energy: 1.0081619732740335
Energy: 1.4460822259750734
Energy: 1.0676534359228131
Energy: 1.0112868516971256
Energy: 1.0676534359219565
Energy: 1.0112868516898434
Energy: 1.0676534359236698
Energy: 1.0112868517018379
Energy: 1.1137053290883554
Energy: 1.072139531657527
Energy: 1.1137053290887837
Energy: 1.072139531657099
Energy: 1.1137053290866419
Energy: 1.0721395316566704
Energy: 1.1244386499047092
Energy: 1.1120819243047213
Energy: 1.1244386498995687
Energy: 1.1120819243012943
Energy: 1.124438649908993
Energy: 1.112081924303436
Energy: 1.0569862917513972
Energy: 1.1733182666224353
Energy: 1.056986291750112
Energy: 1.1733182666228636
Energy: 1.0569862917471136
Energy: 1.1733182666228636
Energy: 0.9793356255836456
Energy: 1.184924633806805
Energy: 0.9793356255845024
Energy: 1.184924633806805
Energy: 0.9793356255836456
Energy: 1.1849246338063764
Energy: 1.3404405624562623
Energy: 1.0725245776068415
Energy: 1.3404405624584042
Energy: 1.0725245776064132
Energy: 1.3404405624549771
Energy: 1.0725245776068415
Energy: 1.1555046815780912
Energy: 1.4660153026591545
Energy: 1.1555046815832315
Energy: 1.4660153026612963
Energy: 1.1555046815840884
Energy: 1.466015302662153
Energy: 1.0681387569370788
Energy: 1.0179692439883647
Energy: 1.0681387569370788
Energy: 1.0179692439887933
Energy: 1.0681387569370788
Energy: 1.01796924398965
Energy: 1.0450802719074597
Energy: 1.1345761251511128
Energy: 1.0450802719074597
Energy: 1.1345761251464008
Energy: 1.0450802719074597
Energy: 1.1345761251425455
Energy: 1.0986791432261842
Energy: 1.0826141259601159
Energy: 1.0986791432287544
Energy: 1.0826141259596878
Energy: 1.0986791432330383
Energy: 1.0826141259618296
Energy: 1.139665158570679
Energy: 1.243975190098279
Energy: 1.1396651585689654
Energy: 1.2439751900974223
Energy: 1.1396651585685371
Energy: 1.2439751900965654
Energy: 1.0364833608267456
Energy: 1.1499766299616323
Energy: 1.0364833608271742
Energy: 1.1499766299620608
Energy: 1.0364833608276023
Energy: 1.149976629961204
Energy: 1.0298643345572263
Energy: 1.0871619488170072
Energy: 1.0298643345632235
Energy: 1.087161948819149
Energy: 1.0298643345619383
Energy: 1.0871619488144368
Energy: 1.3128528619213786
Energy: 1.2884745132043482
Energy: 1.31285286192095
Energy: 1.2884745131996362
Energy: 1.312852861919665
Energy: 1.2884745132056334
Energy: 1.0541536206616713
Energy: 1.0724758827885275
Energy: 1.0541536206586726
Energy: 1.0724758827885275
Energy: 1.054153620661243
Energy: 1.0724758827876706
Energy: 0.9750169186620296
Energy: 1.4075656826064833
Energy: 0.9750169186658849
Energy: 1.4075656826077685
Energy: 0.9750169186654565
Energy: 1.4075656826064833
Energy: 1.4589295925046375
Energy: 0.9721546948629837
Energy: 1.4589295925072079
Energy: 0.9721546948646972
Energy: 1.458929592505066
Energy: 0.9721546948646972
Energy: 0.9750747879056096
Energy: 1.4075693059236902
Energy: 0.9750747879056096
Energy: 1.4075693059254037
Energy: 0.9750747879043244
Energy: 1.4075693059228336
Energy: 1.0541471074951057
Energy: 1.0726017429285086
Energy: 1.0541471074972475
Energy: 1.072601742928937
Energy: 1.054147107501531
Energy: 1.072601742928937
Energy: 1.3127583555499478
Energy: 1.2883438982402486
Energy: 1.3127583555486628
Energy: 1.2883438982389634
Energy: 1.3127583555482345
Energy: 1.2883438982389634
Energy: 1.030420141845868
Energy: 1.0588164497808938
Energy: 1.0304201418570056
Energy: 1.058816449785606
Energy: 1.0304201418484382
Energy: 1.058816449785606
Energy: 1.0365124405031412
Energy: 1.1501496530460218
Energy: 1.0365124404988573
Energy: 1.150149653045165
Energy: 1.0365124405031412
Energy: 1.1501496530455935
Energy: 1.139882212078354
Energy: 1.243969854060552
Energy: 1.1398822120762122
Energy: 1.2439698540601236
Energy: 1.1398822120710717
Energy: 1.243969854060552
Energy: 1.098601305906854
Energy: 1.0824718531921858
Energy: 1.0986013058995718
Energy: 1.082471853191329
Energy: 1.0986013059042838
Energy: 1.082471853188759
Energy: 1.0450722238975887
Energy: 1.032836714128543
Energy: 1.0450722238958752
Energy: 1.0328367141302566
Energy: 1.0450722238975887
Energy: 1.032836714123831
Energy: 1.0680956456187822
Energy: 1.0179926309110638
Energy: 1.0680956456200672
Energy: 1.017992630911492
Energy: 1.0680956456204957
Energy: 1.0179926309110638
Energy: 1.1555414250398737
Energy: 1.5024697840291525
Energy: 1.155541425040302
Energy: 1.5024697840300094
Energy: 1.1555414250462603
Energy: 1.5024697840210133
Energy: 1.340327072716296
Energy: 1.0724642319909992
Energy: 1.3403270727218648
Energy: 1.0724642319909992
Energy: 1.3403270727226826
Energy: 1.0724642319909992
Energy: 0.9794197366891572
Energy: 1.18452418032506
Energy: 0.9794197366887288
Energy: 1.18452418032506
Energy: 0.9794197366891572
Energy: 1.1845241803246316
Energy: 1.0570703221711086
Energy: 1.1733033391130312
Energy: 1.057070322173679
Energy: 1.1733033391130312
Energy: 1.0570703221749642
Energy: 1.1733033391104608
Energy: 1.1244841196006516
Energy: 1.0391227450588485
Energy: 1.1244841195993664
Energy: 1.0391227450558496
Energy: 1.12448411960108
Energy: 1.0391227450592766
Energy: 1.1139008897841869
Energy: 1.0724402076420765
Energy: 1.1139008897837583
Energy: 1.0724402076412198
Energy: 1.1139008897829017
Energy: 1.0724402076412198
Energy: 1.0676796718749588
Energy: 1.011552215762181
Energy: 1.0676796718745303
Energy: 1.0115522157647514
Energy: 1.0676796718749588
Energy: 1.0115522157574688
Energy: 1.00805005810844
Energy: 1.446212399158426
Energy: 1.00805005810844
Energy: 1.446212399160996
Energy: 1.0080500581080116
Energy: 1.4462123991537135
Energy: 1.494961616657265
Energy: 1.1769562324632592
Energy: 1.4949616166594069
Energy: 1.1769562324658294
Energy: 1.4949616166581217
Energy: 1.1769562324632592
Energy: 1.1434108001458516
Energy: 1.1213389052272462
Energy: 1.1434108001454233
Energy: 1.1213389052268181
Energy: 1.1434108001449947
Energy: 1.1213389052276748
Energy: 1.4950431090546519
Energy: 1.068174290927171
Energy: 1.495043109053795
Energy: 1.068174290927171
Energy: 1.495043109053795
Energy: 1.0681742909275995
Energy: 1.008161973271463
Energy: 1.44608222597593
Energy: 1.008161973270217
Energy: 1.4460822259725032
Energy: 1.0081619732718916
Energy: 1.44608222597593
Energy: 1.0676534359257728
Energy: 1.0112868516975542
Energy: 1.0676534359257728
Energy: 1.0112868516992675
Energy: 1.0676534359244878
Energy: 1.0112868516984108
Energy: 1.1137053290892123
Energy: 1.072139531657099
Energy: 1.1137053290892123
Energy: 1.072139531657099
Energy: 1.1137053290862133
Energy: 1.072139531657527

minimum gb energy = 0.9721546948629837 eV
minimum distance =  2.26628896352703 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.4999856660861389
Energy: 0.5124961562552508
Energy: 0.49998566608516376
Energy: 0.5124961562552508
Energy: 0.49998566608711403
Energy: 0.5124961562552508
Energy: 0.6611835691317723
Energy: 0.5012457230920038
Energy: 0.6611835691307971
Energy: 0.5012457230910287
Energy: 0.6611835691307971
Energy: 0.5012457230900534
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5133503632069659
Energy: 0.4993289913509077
Energy: 0.513350363207941
Energy: 0.4993289913518828
Energy: 0.5133503632069659
Energy: 0.4993289913509077
Energy: 0.6606559848738204
Energy: 0.6679614265256881
Energy: 0.6606559848738204
Energy: 0.6679614265256881
Energy: 0.6606559848728454
Energy: 0.6679614265256881
Energy: 0.49952581066710566
Energy: 0.5716861480516586
Energy: 0.49952581066808077
Energy: 0.5716861480516586
Energy: 0.49952581066710566
Energy: 0.5716861480516586
Energy: 0.499535096966506
Energy: 0.5717448286980163
Energy: 0.4995350969674811
Energy: 0.5717448286970411
Energy: 0.4995350969674811
Energy: 0.5717448286980163
Energy: 0.6607560663737415
Energy: 0.6680357192230845
Energy: 0.6607560663747167
Energy: 0.6680357192230845
Energy: 0.6607560663737415
Energy: 0.6680357192230845
Energy: 0.5133405114682524
Energy: 0.49931586975603953
Energy: 0.5133405114692275
Energy: 0.49931586975603953
Energy: 0.5133405114721529
Energy: 0.49931586974823855
Energy: 0.5719566477440398
Energy: 0.6357382713090752
Energy: 0.5719566477430645
Energy: 0.6357382713090752
Energy: 0.5719566477430645
Energy: 0.6357382713090752
Energy: 0.6609374276663544
Energy: 0.49943302256104516
Energy: 0.6609374276663544
Energy: 0.49943302256104516
Energy: 0.6609374276663544
Energy: 0.4994330225649457
Energy: 0.49998566608711403
Energy: 0.5124961562552508
Energy: 0.49998566608516376
Energy: 0.5124961562562259
Energy: 0.4999856660861389
Energy: 0.5124961562562259
Energy: 0.6611835691317723
Energy: 0.5012457230910287
Energy: 0.661183569129822
Energy: 0.5012457230900534
Energy: 0.6611835691307971
Energy: 0.5012457230949292
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5717472617465563
Energy: 0.6363937756816924
Energy: 0.5133503632059907
Energy: 0.4993289913489575
Energy: 0.5133503632098914
Energy: 0.4993289913509077
Energy: 0.5133503632089161
Energy: 0.4993289913509077
Energy: 0.6606559848738204
Energy: 0.6679614265256881
Energy: 0.6606559848738204
Energy: 0.6679614265256881
Energy: 0.6606559848728454
Energy: 0.6679614265256881
Energy: 0.49952581066710566
Energy: 0.5716861480516586
Energy: 0.49952581066710566
Energy: 0.5716861480506835
Energy: 0.49952581066710566
Energy: 0.5716861480516586
Energy: 0.4995350969674811
Energy: 0.5717448286970411
Energy: 0.4995350969674811
Energy: 0.5717448286970411
Energy: 0.4995350969674811
Energy: 0.5717448286970411
Energy: 0.6607560663747167
Energy: 0.6680357192230845
Energy: 0.6607560663747167
Energy: 0.6680357192230845
Energy: 0.660756066376667
Energy: 0.6680357192230845

minimum gb energy = 0.49931586974823855 eV
minimum distance =  2.41331222214629 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.0229197083488784
Energy: 1.1007711783683676
Energy: 1.0229197083481638
Energy: 1.1007711783676533
Energy: 1.0229197083474497
Energy: 1.1007711783676533
Energy: 1.1460627612021328
Energy: 1.0567546710519313
Energy: 1.1460627612042757
Energy: 1.0567546710519313
Energy: 1.1460627612035614
Energy: 1.0567546710519313
Energy: 1.1091576817731081
Energy: 1.440935606576577
Energy: 1.1091576817781084
Energy: 1.440935606572291
Energy: 1.1091576817766797
Energy: 1.44093560657872
Energy: 1.2322673331442053
Energy: 0.9014340766299764
Energy: 1.232267333145634
Energy: 0.9014340766299764
Energy: 1.2322673331449194
Energy: 0.9014340766306908
Energy: 1.0419663083859847
Energy: 0.8633677042697496
Energy: 1.0419663083881276
Energy: 0.8633677042697496
Energy: 1.0419663083859847
Energy: 0.8633677042690353
Energy: 1.0380377958372702
Energy: 1.166395889099438
Energy: 1.0380377958394131
Energy: 1.1663958890987236
Energy: 1.0380377958365559
Energy: 1.1663958890987236
Energy: 0.8649842530170381
Energy: 1.2021961550365317
Energy: 0.8649842530163238
Energy: 1.202196155035103
Energy: 0.8649842530163238
Energy: 1.2021961550401032
Energy: 1.104639776367827
Energy: 0.8282157359437043
Energy: 1.1046397763692557
Energy: 0.8282157359437043
Energy: 1.104639776367827
Energy: 0.82821573594299
Energy: 1.0859081309785859
Energy: 0.8306004081435283
Energy: 1.0859081309785859
Energy: 0.8306004081435283
Energy: 1.0859081309785859
Energy: 0.8306004081435283
Energy: 0.8534185452733505
Energy: 1.3317993606887997
Energy: 0.8534185452754933
Energy: 1.3317993606887997
Energy: 0.8534185452740648
Energy: 1.3317993606895138
Energy: 1.0547890000955646
Energy: 1.3191885406568309
Energy: 1.0547890000948503
Energy: 1.3191885406568309
Energy: 1.054789000096279
Energy: 1.319188540657545
Energy: 1.0432872138420166
Energy: 0.8657621816913711
Energy: 1.043287213844874
Energy: 0.8657621816906569
Energy: 1.0432872138427312
Energy: 0.8657621816906569
Energy: 1.1221142317095685
Energy: 0.9063998248427643
Energy: 1.1221142317109971
Energy: 0.9063998248434786
Energy: 1.1221142317109971
Energy: 0.9063998248441929
Energy: 1.1660607681290003
Energy: 1.4122842159519349
Energy: 1.1660607681290003
Energy: 1.4122842159433635
Energy: 1.166060768128286
Energy: 1.412284215944792
Energy: 1.147209040970457
Energy: 1.0594070297530764
Energy: 1.147209040968379
Energy: 1.0594070297530764
Energy: 1.1472090409690283
Energy: 1.0594070297523623
Energy: 0.9491206789783101
Energy: 1.099926710234397
Energy: 0.9491206789811673
Energy: 1.0999267102329686
Energy: 0.949120678980453
Energy: 1.099926710233683
Energy: 0.9820978641720157
Energy: 1.0560027512467738
Energy: 0.9820978641698729
Energy: 1.0560027512460592
Energy: 0.9820978641705872
Energy: 1.0560027512460592
Energy: 1.3550899570006536
Energy: 1.3785541023439751
Energy: 1.3550899570013681
Energy: 1.3785541023411179
Energy: 1.3550899570013681
Energy: 1.3785541023411179
Energy: 1.2197166694724242
Energy: 0.8990774393044103
Energy: 1.2197166694752815
Energy: 0.8990774393051246
Energy: 1.2197166694745671
Energy: 0.8990774393044103
Energy: 1.0432420007424552
Energy: 0.9910748968742462
Energy: 1.0432420007410264
Energy: 0.9910748968742462
Energy: 1.0432420007417407
Energy: 0.9910748968749604
Energy: 0.8520873386986328
Energy: 1.1671448156026625
Energy: 0.8520873386972041
Energy: 1.1671448156026625
Energy: 0.8520873386972041
Energy: 1.167144815603377
Energy: 1.072651548873241
Energy: 1.2023867827621253
Energy: 1.0726515488782413
Energy: 1.2023867827606967
Energy: 1.0726515488718125
Energy: 1.2023867827599823
Energy: 1.1941547209312031
Energy: 1.0042565883338272
Energy: 1.1941547209326318
Energy: 1.0042565883338272
Energy: 1.1941547209319174
Energy: 1.0042565883338272
Energy: 1.085700169282559
Energy: 0.9503860732859705
Energy: 1.0857001692811303
Energy: 0.9503860732852561
Energy: 1.0857001692789876
Energy: 0.9503860732852561
Energy: 0.8523470033190393
Energy: 1.3310044405662365
Energy: 0.8523470033190393
Energy: 1.3310044405662365
Energy: 0.8523470033197539
Energy: 1.3310044405655224
Energy: 1.5279573220655545
Energy: 1.3243403795199657
Energy: 1.5279573220684117
Energy: 1.3243403795199657
Energy: 1.527957322066983
Energy: 1.3243403795199657

minimum gb energy = 0.82821573594299 eV
minimum distance =  2.27646101598775 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.149256459220038
Energy: 0.9575381628237503
Energy: 1.149256459220038
Energy: 0.9575381628237503
Energy: 1.1492564592194752
Energy: 0.9575381628243133
Energy: 1.21257164117261
Energy: 1.2372746627750384
Energy: 1.212571641170358
Energy: 1.2372746627750384
Energy: 1.2125716411709209
Energy: 1.2372746627750384
Energy: 1.4440055750480245
Energy: 1.6546804070040266
Energy: 1.4440055750474616
Energy: 1.654680407003464
Energy: 1.4440055750468983
Energy: 1.6546804070017747
Energy: 1.1080240341807783
Energy: 0.9543542818243621
Energy: 1.1080240341802154
Energy: 0.9543542818237991
Energy: 1.1080240341790895
Energy: 0.9543542818232362
Energy: 0.9129546942131466
Energy: 1.0067816174888677
Energy: 0.9129546942125836
Energy: 1.0067816174888677
Energy: 0.9129546942137095
Energy: 1.0067816174888677
Energy: 1.183436326771397
Energy: 1.4086764290473293
Energy: 1.1834363267719599
Energy: 1.4086764290467662
Energy: 1.183436326771397
Energy: 1.4086764290467662
Energy: 0.9550599837308478
Energy: 1.3994997674471181
Energy: 0.9550599837302848
Energy: 1.3994997674471181
Energy: 0.9550599837308478
Energy: 1.399499767446555
Energy: 0.9407502892704265
Energy: 0.9545546375081309
Energy: 0.9407502892721155
Energy: 0.9545546375086938
Energy: 0.9407502892709896
Energy: 0.9545546375086938
Energy: 0.9327874287302692
Energy: 0.9877343694116721
Energy: 0.9327874287302692
Energy: 0.9877343694122351
Energy: 0.9327874287308322
Energy: 0.9877343694122351
Energy: 1.0270366379490625
Energy: 1.5060785958746283
Energy: 1.0270366379501885
Energy: 1.5060785958740655
Energy: 1.0270366379490625
Energy: 1.5060785958746283
Energy: 1.0230398658091815
Energy: 1.5074735369152488
Energy: 1.0230398658108701
Energy: 1.5074735369152488
Energy: 1.0230398658103073
Energy: 1.5074735369152488
Energy: 0.9226029101124191
Energy: 1.1139110801638734
Energy: 0.9226029101141081
Energy: 1.1139110801638734
Energy: 0.9226029101129821
Energy: 1.1139110801638734
Energy: 0.937208187411005
Energy: 0.9545695070675039
Energy: 0.9372081874132568
Energy: 0.9545695070641259
Energy: 0.9372081874132568
Energy: 0.954569507063
Energy: 0.8917707317021935
Energy: 1.3093614520371761
Energy: 0.8917707317010675
Energy: 1.3093614520371761
Energy: 0.8917707317016305
Energy: 1.3093614520388652
Energy: 1.186387344100561
Energy: 1.4101673033398552
Energy: 1.186387344100561
Energy: 1.4101673033398552
Energy: 1.186387344099435
Energy: 1.4101673033398552
Energy: 0.8924308758131385
Energy: 1.1416271388616577
Energy: 0.8924308758091977
Energy: 1.1416271388610948
Energy: 0.8924308758125755
Energy: 1.1416271388610948
Energy: 0.9462099153156741
Energy: 0.9544669033946028
Energy: 0.9462099153100443
Energy: 0.9544669033929138
Energy: 0.9462099153151111
Energy: 0.9544669033884098
Energy: 1.2496933210724033
Energy: 1.6577307527987735
Energy: 1.2496933210712773
Energy: 1.6577307528004623
Energy: 1.2496933210718404
Energy: 1.6577307527976473
Energy: 1.2327576419577262
Energy: 1.2360253420620109
Energy: 1.2327576419577262
Energy: 1.2360253420620109
Energy: 1.2327576419577262
Energy: 1.2360253420620109
Energy: 1.0232111692070636
Energy: 1.048109297450956
Energy: 1.0232111692053747
Energy: 1.048109297449267
Energy: 1.0232111692070636
Energy: 1.048109297448141
Energy: 0.9319616651851136
Energy: 1.218653483035401
Energy: 0.9319616651907434
Energy: 1.218653483034275
Energy: 0.9319616651963735
Energy: 1.2186534830348381
Energy: 1.093671162393812
Energy: 1.5500359717985106
Energy: 1.093671162392686
Energy: 1.5500359717956957
Energy: 1.0936711623915603
Energy: 1.5500359717911918
Energy: 1.1094474786575141
Energy: 0.9521789474411945
Energy: 1.1094474786558253
Energy: 0.9521789474406315
Energy: 1.1094474786575141
Energy: 0.9521789474406315
Energy: 0.8926372765291225
Energy: 1.1269316214964349
Energy: 0.8926372765319376
Energy: 1.1269316214975609
Energy: 0.8926372765274335
Energy: 1.1269316214975609
Energy: 0.8934402089181731
Energy: 1.3212223375247523
Energy: 0.893440208916484
Energy: 1.3212223375247523
Energy: 0.8934402089176101
Energy: 1.3212223375253151
Energy: 0.9549657370526564
Energy: 1.303067348823168
Energy: 0.9549657370543455
Energy: 1.303067348823168
Energy: 0.9549657370537825
Energy: 1.303067348823731
Energy: 0.9365105281272008
Energy: 0.9518892702635127
Energy: 0.9365105281266378
Energy: 0.9518892702629497
Energy: 0.9365105281272008
Energy: 0.9518892702629497
Energy: 0.9331551649346115
Energy: 1.1085156163735976
Energy: 0.9331551649329224
Energy: 1.1085156163735976
Energy: 0.9331551649351745
Energy: 1.1085156163741605
Energy: 1.0235449270256123
Energy: 1.2625281483225756
Energy: 1.023544927023923
Energy: 1.2625281483225756
Energy: 1.0235449270261752
Energy: 1.2625281483231388
Energy: 1.3756167844255458
Energy: 1.2515524792019574
Energy: 1.375616784424983
Energy: 1.2515524792008315
Energy: 1.3756167844255458
Energy: 1.2515524792025203
Energy: 0.9162450370947703
Energy: 1.115598161254557
Energy: 0.9162450370947703
Energy: 1.115598161254557
Energy: 0.9162450370947703
Energy: 1.1155981612551198
Energy: 0.9491554352547771
Energy: 0.9700347787384096
Energy: 0.9491554352542141
Energy: 0.9700347787384096
Energy: 0.9491554352542141
Energy: 0.9700347787384096
Energy: 0.8930960132220486
Energy: 1.1618607130114555
Energy: 0.8930960132243005
Energy: 1.1618607130114555
Energy: 0.8930960132226116
Energy: 1.1618607130114555

minimum gb energy = 0.8917707317010675 eV
minimum distance =  2.30525145048516 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.083197263562344
Energy: 0.9906703016167908
Energy: 1.0831972635615539
Energy: 0.9906703016164318
Energy: 1.0831972635627032
Energy: 0.9906703016144202
Energy: 1.1170116676547224
Energy: 0.9490758221273095
Energy: 1.1170116676511304
Energy: 0.9490758221277406
Energy: 1.1170116676495498
Energy: 0.9490758221277406
Energy: 1.0388296439201037
Energy: 1.5356011259508608
Energy: 1.0388296439169427
Energy: 1.53560112595122
Energy: 1.038829643917733
Energy: 1.535601125951651
Energy: 1.0284655034098817
Energy: 0.9732151001872654
Energy: 1.0284655034075112
Energy: 0.9732151001872654
Energy: 1.0284655034079422
Energy: 0.9732151001872654
Energy: 0.9937780452383181
Energy: 0.9730327718413432
Energy: 0.9937780452387491
Energy: 0.9730327694874749
Energy: 0.9937780452379589
Energy: 0.9730327726797733
Energy: 1.3244427135675287
Energy: 1.0096841978088147
Energy: 1.3244427135667385
Energy: 1.0096841978084554
Energy: 1.3244427135667385
Energy: 1.0096841978092457
Energy: 1.003407216478958
Energy: 1.108993513890051
Energy: 1.003407216479389
Energy: 1.1089935138884706
Energy: 1.0034072164809695
Energy: 1.1089935138889015
Energy: 1.0656755503719761
Energy: 1.0712337519180914
Energy: 1.0656755503715452
Energy: 1.0712337519177324
Energy: 1.0656755503707551
Energy: 1.0712337519180914
Energy: 1.0375962057920698
Energy: 1.02466025943916
Energy: 1.0375962057936503
Energy: 1.0246602594411716
Energy: 1.0375962057940094
Energy: 1.0246602594415306
Energy: 1.3935254462274282
Energy: 0.9882426202632308
Energy: 1.3935254462269973
Energy: 0.9882426202628716
Energy: 1.3935254462282185
Energy: 0.9882426202632308
Energy: 1.061395691148946
Energy: 1.0630491487301168
Energy: 1.061395691148587
Energy: 1.0630491487296858
Energy: 1.0613956911473654
Energy: 1.0630491487304758
Energy: 1.5697579944233562
Energy: 0.973265326784045
Energy: 1.5697579944217757
Energy: 0.973265326784404
Energy: 1.5697579944217757
Energy: 0.9732653267848351
Energy: 1.025613122401725
Energy: 1.037677383969417
Energy: 1.0256131224033056
Energy: 1.037677383963526
Energy: 1.025613122401366
Energy: 1.0376773839670461
Energy: 1.0822850769578776
Energy: 1.0624993657051924
Energy: 1.0822850769586676
Energy: 1.062499365704043
Energy: 1.0822850769582366
Energy: 1.0624993657056232
Energy: 1.0726986046564464
Energy: 1.0045088980425347
Energy: 1.072698604658458
Energy: 1.0045088980425347
Energy: 1.0726986046568774
Energy: 1.0045088980421035
Energy: 1.013150678692538
Energy: 1.3276290455411435
Energy: 1.0131506786909577
Energy: 1.3276290455419335
Energy: 1.013150678692179
Energy: 1.3276290455415742
Energy: 0.9746418839993094
Energy: 0.9905768694155402
Energy: 0.9746419678375
Energy: 0.9905768694159713
Energy: 0.9746418787340321
Energy: 0.9905768694155402
Energy: 0.9708844388264429
Energy: 1.0338193426165825
Energy: 0.9708844388292448
Energy: 1.0338193426170135
Energy: 0.9708844388292448
Energy: 1.0338193426162232
Energy: 1.5385977887056812
Energy: 1.0380232560136196
Energy: 1.5385977887092013
Energy: 1.0380232560139786
Energy: 1.538597788707621
Energy: 1.0380232560136196
Energy: 1.2798890068674753
Energy: 1.0503913347502865
Energy: 1.2798890068662543
Energy: 1.0503913347498555
Energy: 1.2798890068686248
Energy: 1.0503913347506457
Energy: 0.9855212434792534
Energy: 1.0828115101394198
Energy: 0.9855212434673999
Energy: 1.0828115101386295
Energy: 0.9855212434756615
Energy: 1.0828115101381985
Energy: 0.9459107304492701
Energy: 1.1177545515053764
Energy: 0.9459107304476897
Energy: 1.1177545515116982
Energy: 0.9459107304481206
Energy: 1.1177545515085374
Energy: 1.4724788299079983
Energy: 1.268686327272793
Energy: 1.472478829905987
Energy: 1.2686863272731523
Energy: 1.4724788299056277
Energy: 1.268686327272793
Energy: 0.9773636827534656
Energy: 1.0277716746242738
Energy: 0.977363682751095
Energy: 1.0277716746242738
Energy: 0.9773636827531066
Energy: 1.0277716746226933
Energy: 0.9734102602580883
Energy: 0.9905668392989735
Energy: 0.9734102602545683
Energy: 0.9905668392989735
Energy: 0.973410260253347
Energy: 0.9905668392989735
Energy: 1.0081328352436538
Energy: 1.3234821507727568
Energy: 1.0081328352476049
Energy: 1.3234821507727568
Energy: 1.0081328352463839
Energy: 1.3234821507723975
Energy: 1.1221175944341415
Energy: 1.0041489291264685
Energy: 1.1221175944329203
Energy: 1.0041489291260377
Energy: 1.12211759443213
Energy: 1.0041489291256784
Energy: 1.0734726323013644
Energy: 0.9787211481480811
Energy: 1.0734726323025139
Energy: 0.9787211481492306
Energy: 1.0734726322989936
Energy: 0.9787211481484404
Energy: 1.0268568145465138
Energy: 1.0379175986182176
Energy: 1.0268568145488843
Energy: 1.0379175986182176
Energy: 1.0268568145417725
Energy: 1.0379175986174276
Energy: 0.9861865411660107
Energy: 1.3918147232798808
Energy: 0.9861865411663698
Energy: 1.3918147232795217
Energy: 0.9861865411671601
Energy: 1.3918147232795217
Energy: 1.027960409977407
Energy: 0.9708931665751702
Energy: 1.0279604099766166
Energy: 0.9708931665751702
Energy: 1.027960409977407
Energy: 0.9708931665740207
Energy: 0.977702177222451
Energy: 1.5659733062655212
Energy: 0.9777021772232413
Energy: 1.5659733062655212
Energy: 0.977702177222451
Energy: 1.5659733062655212
Energy: 1.2800093718604424
Energy: 1.0205313383621004
Energy: 1.2800093718600831
Energy: 1.0205313383605201
Energy: 1.2800093718604424
Energy: 1.0205313383625316
Energy: 1.0599530028916997
Energy: 1.0769597000300148
Energy: 1.05995300289249
Energy: 1.0769597000300148
Energy: 1.0599530028909094
Energy: 1.0769597000300148
Energy: 1.0600314832974465
Energy: 1.0763428483960282
Energy: 1.060031483296225
Energy: 1.076342848395597
Energy: 1.0600314832974465
Energy: 1.0763428483963873
Energy: 1.279951984871423
Energy: 1.0205908547671538
Energy: 1.2799519848737937
Energy: 1.0205908547651423
Energy: 1.2799519848722132
Energy: 1.0205908547671538
Energy: 0.9776410451517943
Energy: 1.5659459436062486
Energy: 0.9776410451497828
Energy: 1.5659459436062486
Energy: 0.9776410451474121
Energy: 1.5659459436062486
Energy: 1.0279604115338652
Energy: 0.9710938142595311
Energy: 1.0279604115358048
Energy: 0.9710938142598902
Energy: 1.0279604115346554
Energy: 0.9710938142598902
Energy: 0.9863909470162877
Energy: 1.3915807734342063
Energy: 0.9863909470186586
Energy: 1.391580773433847
Energy: 0.9863909470158568
Energy: 1.391580773433057
Energy: 1.026842471673487
Energy: 1.038129222617652
Energy: 1.0268424716758575
Energy: 1.0381292226180112
Energy: 1.026842471674708
Energy: 1.0381292226108991
Energy: 1.073369039321075
Energy: 0.9787477821781734
Energy: 1.0733690393266067
Energy: 0.9787477821773832
Energy: 1.0733690393278281
Energy: 0.9787477821785326
Energy: 1.1221054115350535
Energy: 1.004185143614068
Energy: 1.1221054115346225
Energy: 1.0041851436148581
Energy: 1.1221054115354128
Energy: 1.0041851436148581
Energy: 1.0081337528797922
Energy: 1.3238209575719098
Energy: 1.0081337528797922
Energy: 1.3238209575719098
Energy: 1.0081337528774215
Energy: 1.3238209575723408
Energy: 0.9734711534601639
Energy: 0.9906157847533901
Energy: 0.9734711533353799
Energy: 0.9906157847533901
Energy: 0.973471153405279
Energy: 0.9906157847533901
Energy: 0.9773144154801322
Energy: 1.0280176570782786
Energy: 0.9773144154785518
Energy: 1.028017657073537
Energy: 0.9773144154793421
Energy: 1.0280176570715975
Energy: 1.472565338296449
Energy: 1.2686789868572463
Energy: 1.4725653382988195
Energy: 1.2686789868576773
Energy: 1.4725653382996098
Energy: 1.2686789868576773
Energy: 0.9458113947347491
Energy: 1.118665983593785
Energy: 0.945811394734318
Energy: 1.1186659835922046
Energy: 0.9458113947339587
Energy: 1.118665983590265

minimum gb energy = 0.9458113947339587 eV
minimum distance =  2.2979017355742 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1041021434035516
Energy: 1.0008525947577134
Energy: 1.104102143400911
Energy: 1.0008525947577134
Energy: 1.104102143400911
Energy: 1.0008525947577134
Energy: 1.0949841273530085
Energy: 1.2635776852109586
Energy: 1.0949841273530085
Energy: 1.2635776852109586
Energy: 1.0949841273530085
Energy: 1.2635776852109586
Energy: 1.1041208907972766
Energy: 1.0008180446219632
Energy: 1.1041208907972766
Energy: 1.0008180446219632
Energy: 1.1041208907972766
Energy: 1.0008180446219632
Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1261974595116342
Energy: 1.0383616715315853
Energy: 1.1041021434035516
Energy: 1.000852594760354
Energy: 1.1041021434035516
Energy: 1.000852594760354
Energy: 1.1041021434035516
Energy: 1.000852594760354
Energy: 0.99575638679243
Energy: 1.2635776852083178
Energy: 0.99575638679243
Energy: 1.2635776852083178
Energy: 0.99575638679243
Energy: 1.2635776852083178

minimum gb energy = 0.99575638679243 eV
minimum distance =  2.2964602727404 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.3873588581256144
Energy: 1.2284583601454286
Energy: 1.341458736295319
Energy: 1.2284583601382415
Energy: 1.3873588581220209
Energy: 1.2284583601382415
Energy: 1.265288741761259
Energy: 1.1773580482818722
Energy: 1.265288741761259
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Energy: 1.202734274428132
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Energy: 1.2132364247134906
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Energy: 1.2132363998324982
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Energy: 1.222672603636991
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Energy: 1.2751767859541323
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Energy: 1.1755064050224944
Energy: 1.306025254868569
Energy: 1.1755064050081203
Energy: 1.306025254868569
Energy: 1.3166648590667487
Energy: 1.2678409557634889
Energy: 1.3166648625364912
Energy: 1.267840955777863
Energy: 1.3166648551695117
Energy: 1.267840955777863
Energy: 1.2047778881891678
Energy: 1.215358209065689
Energy: 1.2047784262476604
Energy: 1.2153582498983104
Energy: 1.2047778882035416
Energy: 1.2153581216713134
Energy: 1.3908678413243456
Energy: 1.1836101156032866
Energy: 1.3908678413243456
Energy: 1.183610115599693
Energy: 1.3908678413243456
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Energy: 1.218450649307572
Energy: 1.473233351750685
Energy: 1.218450649307572
Energy: 1.4732333517470915
Energy: 1.2184506493111655
Energy: 1.4732333517470915
Energy: 1.3027471098573613
Energy: 1.1789813928256199
Energy: 1.3027471098537677
Energy: 1.1789813928364004
Energy: 1.3027471098573613
Energy: 1.1789813928364004
Energy: 1.2677843313556196
Energy: 1.2343831339553175
Energy: 1.2677843313520263
Energy: 1.2343831339625047
Energy: 1.267784331348433
Energy: 1.2343831339625047
Energy: 1.352154857421479
Energy: 1.1845065871393647
Energy: 1.352154857421479
Energy: 1.1845065871501452
Energy: 1.3521548574250724
Energy: 1.1845065871501452
Energy: 1.2984859774114572
Energy: 1.3464652645019106
Energy: 1.298485929017873
Energy: 1.346465264498317
Energy: 1.2984859774078639
Energy: 1.346465264498317
Energy: 1.2502768675739435
Energy: 1.2224291147128445
Energy: 1.2502768675775369
Energy: 1.222429114723625
Energy: 1.2502768675883176
Energy: 1.222429114723625
Energy: 1.2048787470179343
Energy: 1.2832942212736662
Energy: 1.2048787470215279
Energy: 1.2832942212879748
Energy: 1.2048787470251214
Energy: 1.2832942212879748
Energy: 1.2767393419562498
Energy: 1.2792911197027512
Energy: 1.2767393419634365
Energy: 1.2792911196919705
Energy: 1.2767393419598432
Energy: 1.2792911196955643
Energy: 1.2506469440546628
Energy: 1.266189925466489
Energy: 1.250804327524213
Energy: 1.2661899254844564
Energy: 1.2506469440654433
Energy: 1.2661899254844564

minimum gb energy = 1.140571694334951 eV
minimum distance =  2.24378682603083 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.3183098121664922
Energy: 1.2189826292218366
Energy: 1.3183098121684653
Energy: 1.2189826292218366
Energy: 1.3183098121674788
Energy: 1.2189826292223296
Energy: 1.1951058945935498
Energy: 1.1679190489069549
Energy: 1.1951058945905906
Energy: 1.1679190489099143
Energy: 1.1951058945920703
Energy: 1.1679190489084348
Energy: 1.3647902612976646
Energy: 1.3486810111219387
Energy: 1.364790261298158
Energy: 1.3486810111214456
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Energy: 1.3486810111209522
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Energy: 1.249199942315864
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Energy: 1.2491999423203028
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Energy: 1.2491999423168503
Energy: 1.2478756987559605
Energy: 1.1641901784823978
Energy: 1.2478756987574402
Energy: 1.1641901784809183
Energy: 1.247875698756947
Energy: 1.1641901784819046
Energy: 1.1595537832611578
Energy: 1.1278218376879574
Energy: 1.159553783264117
Energy: 1.1278218376879574
Energy: 1.1595537832586917
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Energy: 1.1727057116861899
Energy: 1.1940558238394443
Energy: 1.2371084746626428
Energy: 1.1940558238404306
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Energy: 1.194055823838458
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Energy: 1.3005710025492339
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Energy: 1.221364314409477
Energy: 1.163916141526516
Energy: 1.2213643144055313
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Energy: 1.2213643144079973
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Energy: 1.2598243929158595
Energy: 1.1281984838363062
Energy: 1.2598243929148731
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Energy: 1.325677173721785
Energy: 1.2485858526127935
Energy: 1.3715586314787995
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Energy: 1.3715586314768267
Energy: 1.2485858526093412
Energy: 1.3715586314797859
Energy: 1.2016083520026248
Energy: 1.2472082012197387
Energy: 1.2016083520021317
Energy: 1.2472082012197387
Energy: 1.2016083520036112
Energy: 1.2472082012212184
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Energy: 1.1578480338916621
Energy: 1.2278392986277413
Energy: 1.1578480338921555
Energy: 1.2278392986282347
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Energy: 1.193574822451612
Energy: 1.0961874840031374
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Energy: 1.2233122621093053
Energy: 1.1982515372307543
Energy: 1.2233122621073322
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Energy: 1.3379161405807696
Energy: 1.2871239817148294
Energy: 1.3379161405891542
Energy: 1.2871239817133497
Energy: 1.3379161405787967
Energy: 1.3004762326262689
Energy: 1.4698859606183539
Energy: 1.3004762326272552
Energy: 1.4698859606178607
Energy: 1.3004762326267618
Energy: 1.469885960618847
Energy: 1.1344930431732956
Energy: 1.2195953412309646
Energy: 1.1344930431728022
Energy: 1.2195953412309646
Energy: 1.1344930431718159
Energy: 1.219595341231458
Energy: 1.1735767000284476
Energy: 1.1282553026800004
Energy: 1.1735767000323933
Energy: 1.1282553026819733
Energy: 1.1735767000245019
Energy: 1.1282553026829596
Energy: 1.2371370122767982
Energy: 1.1941373335979153
Energy: 1.237137012280744
Energy: 1.1941373335979153
Energy: 1.2371370122802505
Energy: 1.1941373335984082
Energy: 1.3488568344482192
Energy: 1.096540822914041
Energy: 1.34885683444526
Energy: 1.0965408229120681
Energy: 1.348856834447233
Energy: 1.096540822914041
Energy: 1.248455993672469
Energy: 1.3009516630737248
Energy: 1.2484559936739485
Energy: 1.3009516630737248
Energy: 1.2484559936744417
Energy: 1.3009516630737248
Energy: 1.1640315557223178
Energy: 1.2231917630710394
Energy: 1.164031555723304
Energy: 1.2231917630715325
Energy: 1.1640315557228111
Energy: 1.2231917630725189
Energy: 1.1290714765297833
Energy: 1.213312242394278
Energy: 1.1290714765312628
Energy: 1.213311502939784
Energy: 1.1290714765278107
Energy: 1.2133095637214624
Energy: 1.1294533419481176
Energy: 1.11090549541956
Energy: 1.1294533419466382
Energy: 1.1109054954200532
Energy: 1.1294533419471313
Energy: 1.11090549541956
Energy: 1.1848712973563005
Energy: 1.596353362105347
Energy: 1.1848712973612323
Energy: 1.5963533621023878
Energy: 1.1848712973607392
Energy: 1.5963533621068267
Energy: 1.3724720962003663
Energy: 1.2486645447487599
Energy: 1.3724720961988865
Energy: 1.2486645447497462
Energy: 1.3724720961998729
Energy: 1.2486645447487599
Energy: 1.237058084137106
Energy: 1.1800455200445124
Energy: 1.2370580841405583
Energy: 1.180045520045499
Energy: 1.2370580841410515
Energy: 1.1800455200450055
Energy: 1.154903877419406
Energy: 1.1336677347001933
Energy: 1.1549038774208857
Energy: 1.1336677347011799
Energy: 1.1549038774198992
Energy: 1.1336677347001933

minimum gb energy = 1.0961874840031374 eV
minimum distance =  2.30972949563547 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.4189093145974936
Energy: 1.2009700107034211
Energy: 1.4189093145980995
Energy: 1.2009700107034211
Energy: 1.4189093145987053
Energy: 1.2009700107034211
Energy: 1.2341765404566047
Energy: 1.136809665833888
Energy: 1.2341765404572107
Energy: 1.1368096658332822
Energy: 1.2341765404566047
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Energy: 1.3280243465353048
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Energy: 1.1690282372698722
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Energy: 1.23092085429043
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Energy: 1.1710034932432956
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Energy: 1.1710034932402664
Energy: 1.2310176281004315
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Energy: 1.2716498691003542
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Energy: 1.272758241040982
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Energy: 1.3268720965097751
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Energy: 1.1387565778454907
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Energy: 1.274222606580729
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Energy: 1.3476021951304211
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Energy: 1.2245343579892793
Energy: 1.2044067117114168
Energy: 1.2245343579886738
Energy: 1.204406711710811
Energy: 1.2245343579886738
Energy: 1.1894233594500352
Energy: 1.2621755399772425
Energy: 1.189423359450641
Energy: 1.2621755399760308
Energy: 1.1894233594500352
Energy: 1.2621755399760308
Energy: 1.2918781511969146
Energy: 1.1370144296343943
Energy: 1.291878151195703
Energy: 1.1370144296337883
Energy: 1.2918781511969146
Energy: 1.1370144296337883
Energy: 1.298059392766695
Energy: 1.1990963246615558
Energy: 1.2980593927679065
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Energy: 1.2980593927685122
Energy: 1.1990963246615558
Energy: 1.2585436145301494
Energy: 1.1580763002561343
Energy: 1.2585436145295437
Energy: 1.1580763002561343
Energy: 1.2585436145271203
Energy: 1.15807630025674
Energy: 1.2918052652184482
Energy: 1.2478970762788626
Energy: 1.2918052652166305
Energy: 1.2478970762788626
Energy: 1.2918052652178422
Energy: 1.2478970762782566
Energy: 1.1892492382664623
Energy: 1.2002823876453383
Energy: 1.1892492382658564
Energy: 1.2002823876459443
Energy: 1.1892492382658564
Energy: 1.2002823876441266
Energy: 1.2597848185669773
Energy: 1.235724226482894
Energy: 1.2597848185669773
Energy: 1.235724226482288
Energy: 1.2597848185663718
Energy: 1.235724226482288
Energy: 1.1118632615775412
Energy: 1.2602981019254158
Energy: 1.1118632615763295
Energy: 1.2602981019254158
Energy: 1.1118632615775412
Energy: 1.2602981019254158
Energy: 1.2767610908264306
Energy: 1.231113307948746
Energy: 1.2767610908276423
Energy: 1.2311133079475343
Energy: 1.2767610908270366
Energy: 1.2311133079481402
Energy: 1.1779764161241557
Energy: 1.178590618538632
Energy: 1.1779764161259731
Energy: 1.1785906185392376
Energy: 1.1779764161271848
Energy: 1.178590618538632
Energy: 1.297404058104175
Energy: 1.2166197117070288
Energy: 1.2974040581053867
Energy: 1.216619711708846
Energy: 1.2974040581047808
Energy: 1.2166197117082405
Energy: 1.215044550897348
Energy: 1.32532714195681
Energy: 1.2150445508961363
Energy: 1.32532714195681
Energy: 1.215044550897348
Energy: 1.32532714195681
Energy: 1.3261769468160294
Energy: 1.2094067879271135
Energy: 1.3261769468160294
Energy: 1.2094067879277195
Energy: 1.326176946817241
Energy: 1.2094067879277195
Energy: 1.1778603926429134
Energy: 1.2764991959417111
Energy: 1.1778603926435192
Energy: 1.276499195942317
Energy: 1.1778603926441251
Energy: 1.276499195942317
Energy: 1.246132194978365
Energy: 1.2705638819512377
Energy: 1.2461321949777593
Energy: 1.2705638819512377
Energy: 1.2461321949771536
Energy: 1.2705638819518437
Energy: 1.1711210026283176
Energy: 1.2317298276661022
Energy: 1.171121002627106
Energy: 1.2317298276661022
Energy: 1.1711210026295291
Energy: 1.2317298276667077

minimum gb energy = 1.1106618249140798 eV
minimum distance =  2.25964108778407 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.246699386810078
Energy: 1.1005835346493478
Energy: 1.246699386810078
Energy: 1.1005835346501323
Energy: 1.2466993868092933
Energy: 1.1005835346501323
Energy: 1.1669976922806164
Energy: 1.0444753191302574
Energy: 1.1669976922798322
Energy: 1.0444753191302574
Energy: 1.1669976922814007
Energy: 1.0444753191310419
Energy: 1.2182027871732066
Energy: 1.3094919598326338
Energy: 1.2182027871779129
Energy: 1.3094919598326338
Energy: 1.2182027871771286
Energy: 1.3094919598326338
Energy: 1.515241478352707
Energy: 1.2149885769446818
Energy: 1.515241478351923
Energy: 1.2149885769438973
Energy: 1.515241478352707
Energy: 1.2149885769446818
Energy: 1.1969649043151938
Energy: 1.2145903240120994
Energy: 1.1969649043151938
Energy: 1.2145903240120994
Energy: 1.1969649043144095
Energy: 1.2145903240120994
Energy: 1.2183804448924946
Energy: 1.1700668943952195
Energy: 1.2183804448924946
Energy: 1.1700668943952195
Energy: 1.2183804448940634
Energy: 1.1700668943952195
Energy: 1.2143934404041636
Energy: 1.1687923094206423
Energy: 1.2143934404057324
Energy: 1.1687923094237442
Energy: 1.214393440404948
Energy: 1.1687923094245287
Energy: 1.2483499919935004
Energy: 1.1043340325553814
Energy: 1.2483499919927163
Energy: 1.1043340325561657
Energy: 1.2483499919935004
Energy: 1.1043340325561657
Energy: 1.1966386671732037
Energy: 1.0447482698605928
Energy: 1.1966386671724192
Energy: 1.0447482698598085
Energy: 1.1966386671716347
Energy: 1.0447482698598085
Energy: 1.05291906073247
Energy: 1.1709750544669224
Energy: 1.0529190607309014
Energy: 1.170975054467707
Energy: 1.0529190607309014
Energy: 1.1709750544669224
Energy: 1.214114425127591
Energy: 1.2171151869678014
Energy: 1.214114425127591
Energy: 1.2171151869678014
Energy: 1.214114425127591
Energy: 1.2171151869670167
Energy: 1.203192880329508
Energy: 1.2630535215715628
Energy: 1.203192880327939
Energy: 1.2630535215715628
Energy: 1.203192880329508
Energy: 1.2630535215786223
Energy: 1.2022422242959592
Energy: 1.044702681646692
Energy: 1.2022422242990611
Energy: 1.044702681646692
Energy: 1.2022422242959592
Energy: 1.044702681646692
Energy: 1.3387139749762769
Energy: 1.0535014382585368
Energy: 1.3387139749770611
Energy: 1.053501438259321
Energy: 1.3387139749762769
Energy: 1.053501438259321
Energy: 1.1986339146306568
Energy: 1.0504324303176233
Energy: 1.1986339146298723
Energy: 1.0504324303176233
Energy: 1.1986339146306568
Energy: 1.050432430316839
Energy: 1.1916424684476847
Energy: 1.1449656009883828
Energy: 1.1916424684476847
Energy: 1.1449656009883828
Energy: 1.1916424684469005
Energy: 1.1449656009883828
Energy: 1.0520009262237981
Energy: 1.1674796665233453
Energy: 1.0520009262237981
Energy: 1.1674796665233453
Energy: 1.0520009262245829
Energy: 1.1674796665233453
Energy: 1.2115099304691004
Energy: 1.2080566957020629
Energy: 1.211509930468316
Energy: 1.2080566957044159
Energy: 1.211509930468316
Energy: 1.2080566957028471
Energy: 1.0519955453373884
Energy: 1.1673754966268695
Energy: 1.0519955453373884
Energy: 1.1673754966276537
Energy: 1.0519955453373884
Energy: 1.1673754966276537
Energy: 1.1916459870594345
Energy: 1.1449524388533423
Energy: 1.1916459870594345
Energy: 1.1449524388541263
Energy: 1.1916459870602187
Energy: 1.1449524388533423
Energy: 1.1986516518872348
Energy: 1.0504239610443322
Energy: 1.1986516518872348
Energy: 1.0504239610466855
Energy: 1.1986516518880193
Energy: 1.0504239610482542
Energy: 1.338719649310665
Energy: 1.1156271332369567
Energy: 1.338719649310665
Energy: 1.1156271332385255
Energy: 1.3387196493114495
Energy: 1.1156271332385255
Energy: 1.2023366833925069
Energy: 1.0447672655807334
Energy: 1.2023366833940756
Energy: 1.0447672655799491
Energy: 1.2023366833925069
Energy: 1.0447672655807334
Energy: 1.2032247357154287
Energy: 1.263013355273167
Energy: 1.2032247357169976
Energy: 1.2630133552739515
Energy: 1.2032247357169976
Energy: 1.2630133552739515

minimum gb energy = 1.0444753191302574 eV
minimum distance =  2.24506602401473 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.1721715895427265
Energy: 1.044092134420133
Energy: 1.1721715895416174
Energy: 1.044092134420133
Energy: 1.1721715895427265
Energy: 1.044092134420133
Energy: 1.0030860122229592
Energy: 0.991552899554427
Energy: 1.0030860122240683
Energy: 0.9915528995533177
Energy: 1.0030860122229592
Energy: 0.991552899554427
Energy: 1.1513171444492403
Energy: 1.1740952793114363
Energy: 1.1513171444503496
Energy: 1.1740952793103272
Energy: 1.151317144451459
Energy: 1.1740952793103272
Energy: 0.9421664469380727
Energy: 1.1800374946353223
Energy: 0.9421664469380727
Energy: 1.1800374946364314
Energy: 0.9421664469380727
Energy: 1.1800374946364314
Energy: 1.1645395337230804
Energy: 1.1058198557305063
Energy: 1.1645395337230804
Energy: 1.1058198557305063
Energy: 1.1645395337230804
Energy: 1.1058198557305063
Energy: 1.0699647527634073
Energy: 1.1390571809815566
Energy: 1.0699647527656255
Energy: 1.139057180982666
Energy: 1.0699647527634073
Energy: 1.1390571809815566
Energy: 1.089680338669715
Energy: 1.0028617220094571
Energy: 1.089680338669715
Energy: 1.0028617220094571
Energy: 1.089680338669715
Energy: 1.0028617220094571
Energy: 0.9420968613514684
Energy: 1.173653802842729
Energy: 0.9420968613514684
Energy: 1.1736534065601387
Energy: 0.9420968613503591
Energy: 1.1736524642048902
Energy: 1.147175641560062
Energy: 0.9914700060143901
Energy: 1.1471756415589527
Energy: 0.9914700060143901
Energy: 1.1471756415589527
Energy: 0.9914700060143901
Energy: 1.0687724611714378
Energy: 1.005540681412375
Energy: 1.0687724611714378
Energy: 1.005540681412375
Energy: 1.0687724611703284
Energy: 1.005540681412375
Energy: 1.0513394802445362
Energy: 1.0521924983842208
Energy: 1.0513394802445362
Energy: 1.0521924983842208
Energy: 1.0513394802456455
Energy: 1.0521924983842208
Energy: 1.1356674620055307
Energy: 1.1133262222086628
Energy: 1.1356674619855633
Energy: 1.1133262222086628
Energy: 1.1356674619334766
Energy: 1.1133262222086628
Energy: 0.9423682574995809
Energy: 1.1374171214639692
Energy: 0.9423682574984716
Energy: 1.1374171214639692
Energy: 0.9423682574984716
Energy: 1.1374171214639692
Energy: 1.0677250953690867
Energy: 1.1519789599322314
Energy: 1.0677250953690867
Energy: 1.1519789599322314
Energy: 1.0677250953690867
Energy: 1.1519789599322314
Energy: 1.067833550975036
Energy: 1.1151559135718936
Energy: 1.0678335509739267
Energy: 1.1151559135718936
Energy: 1.067833550975036
Energy: 1.1151559135707843
Energy: 1.067783708041245
Energy: 1.407609673842507
Energy: 1.067783708042354
Energy: 1.407609673842507
Energy: 1.067783708042354
Energy: 1.407609673841398
Energy: 1.0661556271451267
Energy: 1.1499316310190548
Energy: 1.0661556271451267
Energy: 1.1499316310190548
Energy: 1.0661556271451267
Energy: 1.1499316310190548

minimum gb energy = 0.9420968613503591 eV
minimum distance =  2.30193491601291 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.0626680963433752
Energy: 0.9504663639067059
Energy: 1.0626680963433752
Energy: 0.9504663639071342
Energy: 1.0626680963425184
Energy: 0.9504663639067059
Energy: 0.9828649122517026
Energy: 0.919134689521523
Energy: 0.9828649122517026
Energy: 0.9191346895210947
Energy: 0.9828649122529876
Energy: 0.919134689521523
Energy: 1.0195652894458243
Energy: 1.0254418374362
Energy: 1.0195652894423974
Energy: 1.0254418374357717
Energy: 1.0195652894423974
Energy: 1.0254418374357717
Energy: 0.9881189873965904
Energy: 1.0472617293689186
Energy: 0.9881189873983038
Energy: 1.0472617293689186
Energy: 0.9881189873974471
Energy: 1.0472617293697755
Energy: 0.9588095429426974
Energy: 0.9120256444468016
Energy: 0.9588095429405554
Energy: 0.9120256444463731
Energy: 0.9588095429435541
Energy: 0.9120256444459448
Energy: 1.0212119443259813
Energy: 0.9621494663170189
Energy: 1.021211944324696
Energy: 0.9621494663170189
Energy: 1.021211944324696
Energy: 0.9621494663170189
Energy: 0.9612359329799887
Energy: 0.9601502385849682
Energy: 0.9612359329778467
Energy: 0.960150238585825
Energy: 0.9612359329787036
Energy: 0.9601502385862533
Energy: 1.0678784141949882
Energy: 1.0700229802963872
Energy: 1.0678784141945599
Energy: 1.0700229802976724
Energy: 1.0678784141945599
Energy: 1.070022980298101
Energy: 1.0010342538789516
Energy: 1.0131349510411147
Energy: 1.0010342538785233
Energy: 1.0131349510406862
Energy: 1.0010342538785233
Energy: 1.0131349510406862
Energy: 0.9627519211605831
Energy: 0.8692019838715763
Energy: 0.9627519211622966
Energy: 0.8692019838715763
Energy: 0.9627519211605831
Energy: 0.869201983871148
Energy: 0.8838121058409896
Energy: 0.9288952161852719
Energy: 0.8838121058397044
Energy: 0.9292807297788593
Energy: 0.8838121058409896
Energy: 0.9285032722227167
Energy: 1.0790585659289889
Energy: 0.9331583523477632
Energy: 1.079058565928132
Energy: 0.9331583523477632
Energy: 1.0790585659285603
Energy: 0.933158352347335
Energy: 0.9650739570871265
Energy: 0.9377050696502919
Energy: 0.9650739570862698
Energy: 0.9377050696502919
Energy: 0.9650739570858413
Energy: 0.9377050696511485
Energy: 0.9783780989638737
Energy: 0.9527726203178926
Energy: 0.9783780989651589
Energy: 0.952772620318321
Energy: 0.9783780989638737
Energy: 0.9527726203178926
Energy: 1.0437277984575586
Energy: 1.036671384239437
Energy: 1.043727798460557
Energy: 1.036671384240722
Energy: 1.043727798463556
Energy: 1.036671384240722
Energy: 0.8842548501185767
Energy: 0.9967487675190865
Energy: 0.8842548501185767
Energy: 0.9967487675195148
Energy: 0.8842548501202904
Energy: 0.9967487675195148
Energy: 0.9769406476970316
Energy: 1.0145677877839197
Energy: 0.9769406476961748
Energy: 1.0145677877843478
Energy: 0.9769406476966032
Energy: 1.0145677877843478
Energy: 1.0254061206272287
Energy: 1.0122402241201442
Energy: 1.0254061206259435
Energy: 1.0122402241201442
Energy: 1.0254061206255154
Energy: 1.0122402241201442
Energy: 0.9748263418086853
Energy: 0.9951362148645639
Energy: 0.974826341810399
Energy: 0.9951362148697045
Energy: 0.9748263418078287
Energy: 0.9951362148649924
Energy: 0.9755051182212969
Energy: 0.971645470439394
Energy: 0.9755051182217255
Energy: 0.971645470439394
Energy: 0.9755051182217255
Energy: 0.9716454704398222
Energy: 0.9747994331810746
Energy: 0.9952633552400755
Energy: 0.9747994331827883
Energy: 0.9952633552392187
Energy: 0.9747994331806464
Energy: 0.995263355238362
Energy: 1.0253418054952181
Energy: 1.0122519507350205
Energy: 1.0253418054952181
Energy: 1.0122519507354488
Energy: 1.0253418054930763
Energy: 1.0122519507354488
Energy: 0.976810937922401
Energy: 1.0142269695192654
Energy: 0.9768109379215444
Energy: 1.0142269695192654
Energy: 0.9768109379215444
Energy: 1.0142269695192654
Energy: 0.884036861377538
Energy: 1.0727343868055028
Energy: 0.8840368613745394
Energy: 1.0727343868055028
Energy: 0.8840368613766812
Energy: 1.0727343868059311
Energy: 1.0437405669654882
Energy: 1.0367498221069613
Energy: 1.0437405669676298
Energy: 1.0367498221073896
Energy: 1.0437405669667732
Energy: 1.0367498221078182
Energy: 0.9785244345720415
Energy: 0.9525376606212448
Energy: 0.978524434571613
Energy: 0.9525376606216732
Energy: 0.9785244345728982
Energy: 0.9525376606212448
Energy: 0.9651405818752314
Energy: 0.9377346182234428
Energy: 0.9651405818748031
Energy: 0.9377346182238712
Energy: 0.9651405818739464
Energy: 0.9377346182230144
Energy: 1.0790711179424821
Energy: 0.9332856605154751
Energy: 1.0790711179416252
Energy: 0.9332856605154751
Energy: 1.079071117941197
Energy: 0.9332856605150468
Energy: 0.8836295376681454
Energy: 0.927527461831713
Energy: 0.8836295376672887
Energy: 0.9275370083827866
Energy: 0.8836295376681454
Energy: 0.9283418553166308
Energy: 0.9630102607727709
Energy: 1.040511541225943
Energy: 0.9630102607706289
Energy: 1.0405115412229444
Energy: 0.9630102607710572
Energy: 1.0405115412238013
Energy: 1.0010747759904257
Energy: 1.0130122559966235
Energy: 1.0010747759899976
Energy: 1.0130122559961952
Energy: 1.0010747759904257
Energy: 1.0130122559961952
Energy: 1.067777455450738
Energy: 1.0699304122520545
Energy: 1.0677774554520232
Energy: 1.0699304122520545
Energy: 1.067777455450738
Energy: 1.069930412250341
Energy: 0.9635963557638587
Energy: 0.9595788866633667
Energy: 0.9635963557642869
Energy: 0.9595788866625099
Energy: 0.9635963557634303
Energy: 0.9595788866625099
Energy: 1.0209930936277447
Energy: 0.9345730155292205
Energy: 1.0209930936294582
Energy: 0.934573015527507
Energy: 1.02099309362903
Energy: 0.9345730155287921
Energy: 0.9587554156681809
Energy: 0.9118919352397635
Energy: 0.9587554156681809
Energy: 0.9118919352414769
Energy: 0.9587554156668957
Energy: 0.911891935242762
Energy: 0.9884042344335969
Energy: 1.0139338709347314
Energy: 0.9884042344335969
Energy: 1.0139338709347314
Energy: 0.9884042344344536
Energy: 1.013933870934303
Energy: 1.0200473738521993
Energy: 1.025198968115133
Energy: 1.0200473738547693
Energy: 1.025198968115133
Energy: 1.0200473738556262
Energy: 1.025198968115561
Energy: 0.9829574479096452
Energy: 0.9338960293578413
Energy: 0.9829574479027914
Energy: 0.9338960293582697
Energy: 0.9829574479049332
Energy: 0.9338960293578413
Energy: 1.0626680963425184
Energy: 0.9504663639062776
Energy: 1.062668096342947
Energy: 0.9504663639058492
Energy: 1.06266809634209
Energy: 0.9504663639058492
Energy: 0.982864912249989
Energy: 0.9268592239539949
Energy: 0.982864912251274
Energy: 0.9268592239535665
Energy: 0.982864912251274
Energy: 0.9268592239535665
Energy: 1.0195652894513936
Energy: 1.025441837434915
Energy: 1.019565289442008
Energy: 1.025441837434915
Energy: 1.0195652894453962
Energy: 1.025441837434915
Energy: 0.9881189874004456
Energy: 1.047261729369347
Energy: 0.9881189874025875
Energy: 1.0472617293689186
Energy: 0.9881189874021591
Energy: 1.047261729369347
Energy: 0.9588095429426974
Energy: 0.9120256444438029
Energy: 0.9588095429418405
Energy: 0.9120256444442314
Energy: 0.9588095429379851
Energy: 0.9120256444442314

minimum gb energy = 0.869201983871148 eV
minimum distance =  2.30020297949741 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.9806761660167047
Energy: 0.8820572601533445
Energy: 0.9806761660139147
Energy: 0.8820572601533445
Energy: 0.9806761660160073
Energy: 0.8820572601533445
Energy: 0.8929355886260736
Energy: 0.8671537723847602
Energy: 0.892935588622586
Energy: 0.8671537723847602
Energy: 0.892935588623981
Energy: 0.8671537723847602
Energy: 0.9615915818761684
Energy: 0.9511909903332137
Energy: 0.9615915818754709
Energy: 0.9511909903325162
Energy: 0.9615915818782608
Energy: 0.9511909903318188
Energy: 0.924730208275855
Energy: 0.9802318145807188
Energy: 0.9247302082779473
Energy: 0.9802318145800214
Energy: 0.9247302082751574
Energy: 0.9802318145807188
Energy: 0.8826406213410143
Energy: 0.8590420495198223
Energy: 0.8826406213417117
Energy: 0.8590420495177298
Energy: 0.8826406213438043
Energy: 0.8590420495191248
Energy: 0.9754369968037395
Energy: 0.8658746462647812
Energy: 0.975436996803042
Energy: 0.8658746462654787
Energy: 0.9754369968037395
Energy: 0.8658746462654787
Energy: 0.8292440568886805
Energy: 0.9363493174099167
Energy: 0.8292440568900756
Energy: 0.9363493174099167
Energy: 0.8292440568900756
Energy: 0.9363493174113117
Energy: 1.0018275252743187
Energy: 0.9020000866193162
Energy: 1.0018275252757138
Energy: 0.9020000866200136
Energy: 1.0018275252743187
Energy: 0.9020000866193162
Energy: 0.8796174932429052
Energy: 0.8682630489303826
Energy: 0.8796174932429052
Energy: 0.8682630489303826
Energy: 0.8796174932422076
Energy: 0.8682630489303826
Energy: 0.887654491271907
Energy: 0.8921384690724357
Energy: 0.8876544912726045
Energy: 0.8921384690724357
Energy: 0.8876544912726045
Energy: 0.8921384690731332
Energy: 0.8255945550172841
Energy: 1.0026089605029358
Energy: 0.8255945550179816
Energy: 1.0026089605029358
Energy: 0.8255945550158891
Energy: 1.0026089605029358
Energy: 0.925290130596063
Energy: 0.9172677248717548
Energy: 0.9252901305967605
Energy: 0.9172677248731498
Energy: 0.9252901305967605
Energy: 0.9172677248731498
Energy: 0.8857127400968318
Energy: 0.9802294839823423
Energy: 0.8857127400989243
Energy: 0.9802294839851323
Energy: 0.8857127400968318
Energy: 0.9802294839816449
Energy: 0.8855401373971418
Energy: 0.9094330331867835
Energy: 0.8855401373971418
Energy: 0.9094330331867835
Energy: 0.8855401373971418
Energy: 0.9094330331853887
Energy: 0.9979458501074319
Energy: 0.9296564315477708
Energy: 0.9979458501081294
Energy: 0.9296564315456783
Energy: 0.9979458501088269
Energy: 0.9296564315435858
Energy: 0.9793146337874766
Energy: 1.0050496142272503
Energy: 0.9793146337874766
Energy: 1.0050496142272503
Energy: 0.9793146337860816
Energy: 1.0050496142272503
Energy: 0.9097735379791116
Energy: 1.008247342896743
Energy: 0.9097735379791116
Energy: 1.0082473428960455
Energy: 0.9097735379791116
Energy: 1.0082473428960455
Energy: 0.9550965795861558
Energy: 0.9663183754105649
Energy: 0.9550965795868533
Energy: 0.9663183754098674
Energy: 0.9550965795938281
Energy: 0.9663183754105649
Energy: 0.8404682424683524
Energy: 0.944300632221877
Energy: 0.8404682424690498
Energy: 0.944300632221877
Energy: 0.8404682424690498
Energy: 0.9443006322246671
Energy: 0.8433257297898137
Energy: 0.9826353861551699
Energy: 0.8433257297870238
Energy: 0.9826353861551699
Energy: 0.8433257297877212
Energy: 0.9826353861551699
Energy: 0.973412623187892
Energy: 0.9384519348521997
Energy: 0.9734126231871945
Energy: 0.9384519348521997
Energy: 0.9734126231892869
Energy: 0.9384519348515022
Energy: 0.8280577793167215
Energy: 0.9452120758482316
Energy: 0.828057779316024
Energy: 0.9452120758454418
Energy: 0.828057779317419
Energy: 0.9452120758475341
Energy: 0.9075308782038705
Energy: 0.919649843671689
Energy: 0.9075308782045679
Energy: 0.9196498436709915
Energy: 0.9075308782038705
Energy: 0.919649843671689
Energy: 0.9069345049991201
Energy: 1.1710946977219852
Energy: 0.9069345050012125
Energy: 1.1710946977205903
Energy: 0.9069345049984225
Energy: 1.1710946977191954
Energy: 0.9080812597628776
Energy: 0.9605707942421794
Energy: 0.9080812597642726
Energy: 0.9605707942421794
Energy: 0.9080812597642726
Energy: 0.9605707942421794
Energy: 0.8829198778457176
Energy: 0.9203173118894731
Energy: 0.8829198778457176
Energy: 0.9203173118894731
Energy: 0.8829198778457176
Energy: 0.9203173118894731
Energy: 0.8276049411892885
Energy: 0.9439824084764334
Energy: 0.827604941189986
Energy: 0.943982408477131
Energy: 0.8276049411892885
Energy: 0.9439824084792234

minimum gb energy = 0.8255945550158891 eV
minimum distance =  2.2730447250573 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.9738574330368227
Energy: 0.8050086305823212
Energy: 0.9738574330373307
Energy: 0.8050086305823212
Energy: 0.9738574330373307
Energy: 0.8050086305828296
Energy: 0.8864236403047796
Energy: 0.8127416651235959
Energy: 0.8864236403057959
Energy: 0.8127416651235959
Energy: 0.8864236403052876
Energy: 0.8127416651225795
Energy: 0.9538205368764578
Energy: 0.8795702084054177
Energy: 0.9538205368764578
Energy: 0.8795702084054177
Energy: 0.9538205368764578
Energy: 0.8795702084054177
Energy: 0.9131730663804783
Energy: 0.8512749674427323
Energy: 0.9131730663809864
Energy: 0.8512749674427323
Energy: 0.9131730663804783
Energy: 0.8512749674432407
Energy: 0.7863150069823538
Energy: 0.775119933142172
Energy: 0.7863150069798128
Energy: 0.7751199331426801
Energy: 0.786315006982862
Energy: 0.775119933142172
Energy: 0.8619299589655921
Energy: 0.7871801520738405
Energy: 0.8619299589661001
Energy: 0.7871801520738405
Energy: 0.8619299589666086
Energy: 0.7871801520743488
Energy: 0.7956759084534083
Energy: 0.8306421999810796
Energy: 0.7956759084513756
Energy: 0.8306421999815877
Energy: 0.7956759084518837
Energy: 0.8306421999810796
Energy: 1.0660658225252813
Energy: 0.7647661811186334
Energy: 1.0660658225257893
Energy: 0.7647661811196498
Energy: 1.0660658225262976
Energy: 0.7647661811191415
Energy: 0.8051170882800299
Energy: 0.7776993990238854
Energy: 0.8051170882810464
Energy: 0.7776993990233773
Energy: 0.8051170882800299
Energy: 0.7776993990238854
Energy: 0.7949507456636736
Energy: 0.7809930801305413
Energy: 0.7949507456646899
Energy: 0.780993080130033
Energy: 0.7949507456636736
Energy: 0.7809930801295247
Energy: 0.8859275272562142
Energy: 0.8574783082018763
Energy: 0.8859275272557059
Energy: 0.8574783082023845
Energy: 0.8859275272546897
Energy: 0.8574783082018763
Energy: 0.7508527952321236
Energy: 0.7764925673334014
Energy: 0.7508527952321236
Energy: 0.7764925673334014
Energy: 0.7508527952326318
Energy: 0.7764925673334014
Energy: 0.7947034472256053
Energy: 0.7417555986735282
Energy: 0.794703447225097
Energy: 0.7417555986740366
Energy: 0.794703447225097
Energy: 0.7417555986730201
Energy: 0.8848600228971236
Energy: 0.8585499650769647
Energy: 0.8848600228971236
Energy: 0.8585499650769647
Energy: 0.8848600228966154
Energy: 0.8585499650764564
Energy: 0.7807659539468663
Energy: 0.7761945633478436
Energy: 0.780765953946358
Energy: 0.7761945633468271
Energy: 0.780765953946358
Energy: 0.7761945633478436
Energy: 0.8193211222619985
Energy: 0.8316515940652583
Energy: 0.8193211222635229
Energy: 0.8316515940652583
Energy: 0.8193211222609821
Energy: 0.8316515940657667
Energy: 0.796856169381604
Energy: 0.8541385749767455
Energy: 0.7968561693810957
Energy: 0.8541385749762374
Energy: 0.7968561693800793
Energy: 0.8541385749762374
Energy: 0.8121697411249997
Energy: 0.7762631933822383
Energy: 0.8121697411244916
Energy: 0.7762631933827464
Energy: 0.812169741126016
Energy: 0.7762631933827464
Energy: 0.7899088661618427
Energy: 0.8800978097631681
Energy: 0.7899088661628592
Energy: 0.8800978097626599
Energy: 0.7899088661623509
Energy: 0.8800978097631681
Energy: 0.8197798790700922
Energy: 0.8590178367585609
Energy: 0.8197798790726333
Energy: 0.8590178367580527
Energy: 0.8197798790736496
Energy: 0.8590178367580527
Energy: 0.8729519904462661
Energy: 0.812327264092259
Energy: 0.8729519904457578
Energy: 0.8123272640907343
Energy: 0.8729519904457578
Energy: 0.8123272640917506
Energy: 0.8079115993650167
Energy: 0.8039857479155444
Energy: 0.8079115993650167
Energy: 0.8039857479155444
Energy: 0.8079115993640003
Energy: 0.8039857479155444
Energy: 0.9288611876960762
Energy: 0.8787246719446465
Energy: 0.9288611876950599
Energy: 0.8787246719451548
Energy: 0.9288611876960762
Energy: 0.8787246719451548
Energy: 0.832017455194366
Energy: 0.92014155542822
Energy: 0.8320174551953824
Energy: 0.9201415554287281
Energy: 0.832017455191825
Energy: 0.92014155542822
Energy: 0.8311634607114695
Energy: 0.7624463607820792
Energy: 0.8311634607109611
Energy: 0.7624463607825873
Energy: 0.8311634607119777
Energy: 0.7624463607820792
Energy: 0.7697461430647308
Energy: 0.8510462095841396
Energy: 0.7697461430647308
Energy: 0.8510462095841396
Energy: 0.7697461430647308
Energy: 0.8510462095841396
Energy: 0.8528369723286426
Energy: 0.8707947716022401
Energy: 0.8528369723281346
Energy: 0.8707947716022401
Energy: 0.8528369723286426
Energy: 0.8707947716022401
Energy: 0.78936280529742
Energy: 0.7598057059012334
Energy: 0.7893628052964035
Energy: 0.7598057059027579
Energy: 0.789362805297928
Energy: 0.7598057059017416
Energy: 0.7688567298247704
Energy: 0.8054296975844287
Energy: 0.7688567298247704
Energy: 0.8054296975844287
Energy: 0.7688567298242621
Energy: 0.8054296975844287
Energy: 0.7770240926312099
Energy: 0.8451486479088547
Energy: 0.7770240926307017
Energy: 0.845148647909363
Energy: 0.7770240926307017
Energy: 0.8451486479083464
Energy: 0.762690243977608
Energy: 1.0678694477288986
Energy: 0.7626902439781162
Energy: 1.0678694477283903
Energy: 0.7626902439786245
Energy: 1.067869447727882
Energy: 0.7694390634696413
Energy: 0.7696415449488934
Energy: 0.7694390634706577
Energy: 0.7696415449488934
Energy: 0.7694390634706577
Energy: 0.7696415449488934
Energy: 0.7490357711473735
Energy: 0.7629326551218792
Energy: 0.7490357711483898
Energy: 0.7629326551223874
Energy: 0.7490357711478817
Energy: 0.7629326551218792
Energy: 0.8884761088080889
Energy: 0.9647031663800913
Energy: 0.8884761088075809
Energy: 0.9647031663805995
Energy: 0.8884761088065645
Energy: 0.9647031663805995
Energy: 0.7706723714637711
Energy: 0.7448033809535748
Energy: 0.7706723714658038
Energy: 0.7448033809530666
Energy: 0.7706723714663121
Energy: 0.7448033809535748
Energy: 0.6942792524667203
Energy: 0.7629457337425336
Energy: 0.6942792524677367
Energy: 0.7629457337420255
Energy: 0.6942792524677367
Energy: 0.762945733741009

minimum gb energy = 0.6942792524667203 eV
minimum distance =  2.26870495855801 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.8855341469941679
Energy: 0.08798621444500271
Energy: 0.8855341469941679
Energy: 0.08798621444313548
Energy: 0.8855341469941679
Energy: 0.08798621444313548
Energy: 0.8855354756582708
Energy: 0.08760108053953737
Energy: 0.8855354756582708
Energy: 0.08760108053580291
Energy: 0.8855354756582708
Energy: 0.08760108053953737
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745451038
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.8855341469941679
Energy: 0.08798621444500271
Energy: 0.8855341469941679
Energy: 0.08798621444500271
Energy: 0.8855341469941679
Energy: 0.08798621444500271
Energy: 0.8855354756582708
Energy: 0.08760108053767014
Energy: 0.8855354756582708
Energy: 0.08760108053580291
Energy: 0.8855354756582708
Energy: 0.08760108053953737
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.8855341469941679
Energy: 0.08798621444126824
Energy: 0.8855341469941679
Energy: 0.08798621444686994
Energy: 0.8855341469941679
Energy: 0.08798621444686994
Energy: 0.8855354756582708
Energy: 0.0876010805302012
Energy: 0.8855354756582708
Energy: 0.08760108053393567
Energy: 0.8855354756582708
Energy: 0.08760108053393567
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995
Energy: 0.08680241745264315
Energy: 0.13715459872126995

minimum gb energy = 0.08680241745264315 eV
minimum distance =  2.46549073386419 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.9377215081663524
Energy: 0.7751758650069025
Energy: 0.9377215081629997
Energy: 0.7751758650069025
Energy: 0.9377215081669112
Energy: 0.7751758650063437
Energy: 0.7828907428398777
Energy: 0.8056818699919147
Energy: 0.7828907428398777
Energy: 0.8056818699913558
Energy: 0.7828907428393189
Energy: 0.8056818699913558
Energy: 0.814410299595118
Energy: 0.8059021991404797
Energy: 0.814410299595118
Energy: 0.8059021991404797
Energy: 0.8144102995945594
Energy: 0.805902199142156
Energy: 0.8816130888496276
Energy: 0.7953898760659606
Energy: 0.8816130888507452
Energy: 0.7953898760659606
Energy: 0.8816130888501864
Energy: 0.7953898760659606
Energy: 0.6674380598067524
Energy: 0.7865507695881664
Energy: 0.6674380598073113
Energy: 0.7865507695853726
Energy: 0.6674380598073113
Energy: 0.7865507695931955
Energy: 0.8214957147199569
Energy: 0.8633121582737887
Energy: 0.8214957147210744
Energy: 0.8633121582715536
Energy: 0.8214957147199569
Energy: 0.8633121582732299
Energy: 0.83494589085298
Energy: 0.8788223356459346
Energy: 0.83494589085298
Energy: 0.8788223356453758
Energy: 0.8349458908518625
Energy: 0.8788223356453758
Energy: 0.6631162863602652
Energy: 0.7859958352922037
Energy: 0.6631162863597064
Energy: 0.785995835288851
Energy: 0.6631162863597064
Energy: 0.7859958352899685
Energy: 0.8351110640816368
Energy: 0.8413999982652137
Energy: 0.8351110640805194
Energy: 0.8413999982646551
Energy: 0.8351110640805194
Energy: 0.8413999982663314
Energy: 0.760835033103184
Energy: 0.8188180686259943
Energy: 0.7608350331059778
Energy: 0.8188180686265532
Energy: 0.760835033103184
Energy: 0.8188180686282294
Energy: 0.7189791420021581
Energy: 0.7881925099219711
Energy: 0.7189791420015992
Energy: 0.7881925099219711
Energy: 0.7189791420027168
Energy: 0.7881925099202948
Energy: 0.864382909513715
Energy: 0.8715745621048757
Energy: 0.8643829095142737
Energy: 0.8715745621048757
Energy: 0.8643829095153912
Energy: 0.8715745621043168
Energy: 0.7950864800928386
Energy: 0.8004965557472539
Energy: 0.7950864801001026
Energy: 0.8004965557472539
Energy: 0.7950864801001026
Energy: 0.8004965557472539
Energy: 0.7367434332919913
Energy: 0.8476573376247265
Energy: 0.7367434332931089
Energy: 0.8476573376241676
Energy: 0.7367434332959029
Energy: 0.8476573376230502
Energy: 0.880855144188347
Energy: 0.8385898184616128
Energy: 0.8808551441894645
Energy: 0.8385898184649654
Energy: 0.880855144188347
Energy: 0.8385898184621717
Energy: 0.7663400470715916
Energy: 0.6626856883246383
Energy: 0.7663400470693563
Energy: 0.6626856883251969
Energy: 0.766340047070474
Energy: 0.6626856883246383
Energy: 0.7886765157326054
Energy: 0.8716999606343298
Energy: 0.7886765157331642
Energy: 0.8716999606343298
Energy: 0.7886765157326054
Energy: 0.8716999606343298
Energy: 0.8246251102066017
Energy: 0.8104265425775609
Energy: 0.8246251102066017
Energy: 0.8104265425775609
Energy: 0.8246251102066017
Energy: 0.8104265425786783
Energy: 0.8249890601215359
Energy: 0.9005998904794777
Energy: 0.8249890601204184
Energy: 0.9005998904800366
Energy: 0.8249890601209773
Energy: 0.9005998904800366
Energy: 0.7727843306468536
Energy: 0.9209110146404262
Energy: 0.7727843306451773
Energy: 0.9209110146415437
Energy: 0.7727843306451773
Energy: 0.9209110146409849
Energy: 0.8621470909599935
Energy: 0.7878710301387244
Energy: 0.8621470909599935
Energy: 0.7878710301387244
Energy: 0.8621470909611111
Energy: 0.7878710301381656
Energy: 0.8478129850536866
Energy: 0.7857104955504928
Energy: 0.8478129859763754
Energy: 0.7857104955510515
Energy: 0.8478129873833185
Energy: 0.7857104955510515
Energy: 0.7980546326457311
Energy: 0.8974936925191107
Energy: 0.7980546326485249
Energy: 0.8974936925196693
Energy: 0.7980546326502013
Energy: 0.8974936925196693
Energy: 0.8158584112156775
Energy: 0.7851771666550467
Energy: 0.8158584112156775
Energy: 0.785177166656723
Energy: 0.8158584112140012
Energy: 0.7851771666550467
Energy: 0.8775753037790505
Energy: 0.8188471952735323
Energy: 0.8775753037779329
Energy: 0.8188471952724148
Energy: 0.8775753037784918
Energy: 0.8188471952740909
Energy: 0.7604570930799285
Energy: 0.8574065816980608
Energy: 0.7604570930793697
Energy: 0.8574065816947083
Energy: 0.7604570930788109
Energy: 0.8574065816947083
Energy: 0.9180632566017993
Energy: 0.6729807287615485
Energy: 0.9180632566012407
Energy: 0.6729807287598722
Energy: 0.9180632566029169
Energy: 0.672980728760431
Energy: 0.8351565411030154
Energy: 0.8348771624308432
Energy: 0.8351565411052505
Energy: 0.8348771624302843
Energy: 0.8351565411041328
Energy: 0.8348771624302843
Energy: 0.7353100349010451
Energy: 0.7855401027988171
Energy: 0.7353100349010451
Energy: 0.7855401028010524
Energy: 0.7353100349016038
Energy: 0.7855401028016111
Energy: 0.9120319889354326
Energy: 0.7347759370904648
Energy: 0.9120319889354326
Energy: 0.7347759370899061
Energy: 0.9120319889348737
Energy: 0.7347759370915824
Energy: 0.8328129335173704
Energy: 0.8276067786931368
Energy: 0.8328129335173704
Energy: 0.8276067786909016
Energy: 0.8328129335173704
Energy: 0.8276067786942543
Energy: 0.8164883929390657
Energy: 0.7744575855253093
Energy: 0.8164883929401832
Energy: 0.7744575855258681
Energy: 0.8164883929396245
Energy: 0.7744575855269857
Energy: 0.8383389290663131
Energy: 0.8854364662582143
Energy: 0.8383389290657542
Energy: 0.8854364662582143
Energy: 0.8383389290663131
Energy: 0.8854364662576557

minimum gb energy = 0.6626856883246383 eV
minimum distance =  2.33257704426656 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.0871525589568134
Energy: 0.9503339774064429
Energy: 1.087152558956017
Energy: 0.9503339774064429
Energy: 1.0871525589568134
Energy: 0.9503339774064429
Energy: 0.9480822295936912
Energy: 0.9738086428514878
Energy: 0.9480822295936912
Energy: 0.9738086428506915
Energy: 0.948082229592895
Energy: 0.9738086428498953
Energy: 1.0161417504122527
Energy: 0.9847777471817009
Energy: 1.0161417504122527
Energy: 0.9847777471801085
Energy: 1.0161417504122527
Energy: 0.9847777471840895
Energy: 1.0398160285251508
Energy: 0.9346846376814025
Energy: 1.0398160285227622
Energy: 0.934684637691753
Energy: 1.0398160285235585
Energy: 0.934684637671052
Energy: 0.8279140258474121
Energy: 0.9280002479447772
Energy: 0.8279140258490045
Energy: 0.9280002479447772
Energy: 0.8279140258482085
Energy: 0.9280002479455732
Energy: 1.016945347913666
Energy: 1.0175385003594672
Energy: 1.0169453479128698
Energy: 1.0175385003594672
Energy: 1.0169453479112776
Energy: 1.0175385003610595
Energy: 0.9413093229251402
Energy: 1.0381776862648755
Energy: 0.9413093229243442
Energy: 1.0381776862648755
Energy: 0.9413093229251402
Energy: 1.0381776862648755
Energy: 0.9138861296341921
Energy: 0.9180005764340692
Energy: 0.9138861296079178
Energy: 0.9180005764348654
Energy: 0.9138861296389691
Energy: 0.9180005764348654
Energy: 1.0772148081747759
Energy: 1.0679687412174586
Energy: 1.0772148081771644
Energy: 1.067968741215866
Energy: 1.0772148081763682
Energy: 1.0679687412174586
Energy: 0.9410903960893572
Energy: 1.0165641628656663
Energy: 0.9410903960933382
Energy: 1.0165641628648703
Energy: 0.9410903960949304
Energy: 1.0165641628648703
Energy: 1.0439734330370292
Energy: 1.016914321415992
Energy: 1.0439734330370292
Energy: 1.016914321415992
Energy: 1.0439734330370292
Energy: 1.0169143214151957
Energy: 0.9467108665803513
Energy: 0.9996964086644506
Energy: 0.946710866578759
Energy: 0.9996964086644506
Energy: 0.9467108665803513
Energy: 0.9996964086637269
Energy: 0.9456337355510137
Energy: 0.9341317461849203
Energy: 0.9456337355510137
Energy: 0.9341317461849203
Energy: 0.9456337355494213
Energy: 0.9341317461849203
Energy: 0.932540484696648
Energy: 1.0445460435139733
Energy: 0.932540484696648
Energy: 1.0445460435147695
Energy: 0.9325404846974441
Energy: 1.0445460435139733
Energy: 0.9577527821317311
Energy: 0.9441243596160386
Energy: 0.9577527821341196
Energy: 0.9441243596152422
Energy: 0.9577527821349158
Energy: 0.9441243596152422
Energy: 0.9736069787464312
Energy: 0.9688087321306557
Energy: 0.9736069787535969
Energy: 0.9688087321290633
Energy: 0.9736069787464312
Energy: 0.9688087321306557
Energy: 0.9715865321410634
Energy: 1.0343303063764662
Energy: 0.971586532139471
Energy: 1.0343303063764662
Energy: 0.9715865321410634
Energy: 1.0343303063764662
Energy: 0.9822768142627865
Energy: 0.9269924901459485
Energy: 0.9822768142627865
Energy: 0.9269924901459485
Energy: 0.9822768142627865
Energy: 0.9269924901459485
Energy: 1.0227625959044533
Energy: 1.0211420367986828
Energy: 1.022762595903657
Energy: 1.0211420368002748
Energy: 1.0227625959044533
Energy: 1.021142036799479
Energy: 1.0800251450221163
Energy: 0.9281332913042726
Energy: 1.0800251450221163
Energy: 0.9281332913050689
Energy: 1.08002514502132
Energy: 0.9281332913050689
Energy: 1.1167772617597198
Energy: 0.940378703668001
Energy: 1.1167772617581275
Energy: 0.9403787036664087
Energy: 1.1167772617597198
Energy: 0.9403787036672049
Energy: 1.0455047068537282
Energy: 1.1087062707408697
Energy: 1.0455047068505432
Energy: 1.1087062707416657
Energy: 1.045504706852932
Energy: 1.1087062707408697
Energy: 1.01362424773552
Energy: 0.9289120787668339
Energy: 1.0136242477347237
Energy: 0.92891207876763
Energy: 1.0136242477347237
Energy: 0.92891207876763

minimum gb energy = 0.8279140258474121 eV
minimum distance =  2.3300119964103 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.1936158441296782
Energy: 1.0164369978726353
Energy: 1.1936158441286677
Energy: 1.0164369978721304
Energy: 1.193615844129173
Energy: 1.0164369978726353
Energy: 1.0490993064384158
Energy: 1.0743249043361145
Energy: 1.0490993064363954
Energy: 1.0743249043356096
Energy: 1.0490993064374055
Energy: 1.0743249043356096
Energy: 1.1290260700680532
Energy: 1.0710382451336955
Energy: 1.1290260700680532
Energy: 1.0710382451342007
Energy: 1.1290260700685584
Energy: 1.0710382451371852
Energy: 1.1463749540596018
Energy: 1.0545893117949843
Energy: 1.1463749540596018
Energy: 1.0545893117949843
Energy: 1.1463749540590964
Energy: 1.0545893117954894
Energy: 1.0607201557408306
Energy: 1.0732809666354506
Energy: 1.060720155738305
Energy: 1.0732809666349454
Energy: 1.0607201557408306
Energy: 1.0732809666354506
Energy: 1.2280021041092943
Energy: 1.20135743981057
Energy: 1.2280021041082843
Energy: 1.201357439811075
Energy: 1.2280021041047486
Energy: 1.20135743981057
Energy: 1.04808421025258
Energy: 1.0130082819406
Energy: 1.0480842102546002
Energy: 1.0130082819411053
Energy: 1.0480842102530852
Energy: 1.01300828193959
Energy: 1.1423740507355005
Energy: 1.1375071756295565
Energy: 1.1423740507365108
Energy: 1.1375071756295565
Energy: 1.1423740507385312
Energy: 1.1375071756295565
Energy: 1.0608102554456238
Energy: 1.1371990690516829
Energy: 1.0608102554466339
Energy: 1.137199069052693
Energy: 1.0608102554461287
Energy: 1.137199069052693
Energy: 1.1119700648588249
Energy: 1.0477456910995904
Energy: 1.1119700648573096
Energy: 1.0477456910990852
Energy: 1.111970064859835
Energy: 1.0477456910990852
Energy: 1.083866698058442
Energy: 1.1351692119273435
Energy: 1.083866698058442
Energy: 1.1351692119273435
Energy: 1.0838666980594522
Energy: 1.1351692119273435
Energy: 1.048382681045896
Energy: 1.0592228323479478
Energy: 1.0483826810448857
Energy: 1.0592228323479478
Energy: 1.048382681045391
Energy: 1.0592228323479478
Energy: 1.195496980861394
Energy: 1.0214057223851611
Energy: 1.1954969808618994
Energy: 1.0214057223856663
Energy: 1.195496980861394
Energy: 1.0214057223856663
Energy: 1.065915490899058
Energy: 1.139201799116474
Energy: 1.0659154909000683
Energy: 1.139201799115969
Energy: 1.065915490899058
Energy: 1.139201799116474
Energy: 1.0918757502725032
Energy: 1.0767339412827628
Energy: 1.0918757502719982
Energy: 1.0767339412827628
Energy: 1.0918757502719982
Energy: 1.0767339412832682
Energy: 1.1462959242310324
Energy: 1.1770335906000329
Energy: 1.146295924229517
Energy: 1.1770335906000329
Energy: 1.1462959242305273
Energy: 1.1770335906000329
Energy: 1.1704398958258408
Energy: 1.054577313367734
Energy: 1.1704398958243256
Energy: 1.054577313367229
Energy: 1.1704398958243256
Energy: 1.054577313367734
Energy: 1.1628313138663446
Energy: 1.1576115904084197
Energy: 1.1628313138653346
Energy: 1.1576115904089248
Energy: 1.1628313138658395
Energy: 1.1576115904069046
Energy: 1.0459334142049392
Energy: 1.158319965659149
Energy: 1.0459334142059498
Energy: 1.1583199656621794
Energy: 1.0459334142059498
Energy: 1.1583199656566234
Energy: 1.1994748314712822
Energy: 1.0753410844318472
Energy: 1.1994748314707773
Energy: 1.075341084430837
Energy: 1.1994748314712822
Energy: 1.0753410844328573
Energy: 1.1419936421124166
Energy: 1.144362678037602
Energy: 1.1419936421109012
Energy: 1.144362678038107
Energy: 1.1419936421114063
Energy: 1.1443626780386122
Energy: 1.088430760439925
Energy: 1.037745661047048
Energy: 1.0884307604384098
Energy: 1.037745661047553
Energy: 1.088430760439925
Energy: 1.037745661047048
Energy: 1.0769058377361853
Energy: 1.1351430508914269
Energy: 1.076905837740731
Energy: 1.1351430508914269
Energy: 1.0769058377402259
Energy: 1.1351430508909217
Energy: 1.1414154857241343
Energy: 1.058348918909521
Energy: 1.141415485726155
Energy: 1.058348918909521
Energy: 1.1414154857281753
Energy: 1.058348918909521
Energy: 1.0484538136561534
Energy: 1.0594595199345638
Energy: 1.048453813655648
Energy: 1.0594595199340586
Energy: 1.0484538136546377
Energy: 1.0594595199340586
Energy: 1.0957773489085747
Energy: 1.1416449827887227
Energy: 1.0957773489080698
Energy: 1.1416449827882176
Energy: 1.0957773489085747
Energy: 1.1416449827887227
Energy: 1.0477907104113908
Energy: 1.0366910251239947
Energy: 1.0477907104108857
Energy: 1.0366910251239947
Energy: 1.047790710411896
Energy: 1.0366910251234895
Energy: 1.1615143405847328
Energy: 1.2026474679609152
Energy: 1.1615143405827126
Energy: 1.2026474679614203
Energy: 1.1615143405827126
Energy: 1.2026474679618793
Energy: 1.2010524923004386
Energy: 1.0753628106989006
Energy: 1.201052492302964
Energy: 1.0753628106994055
Energy: 1.2010524923019539
Energy: 1.0753628106994055
Energy: 1.0462970842923909
Energy: 1.0096310357480922
Energy: 1.0462970842908754
Energy: 1.0096310357460718
Energy: 1.0462970842908754
Energy: 1.0096310357501126
Energy: 1.2165088605541654
Energy: 1.2204560928920476
Energy: 1.2165088605526502
Energy: 1.2204560928920476
Energy: 1.2165088605516399
Energy: 1.2204560928925527
Energy: 1.1768627158287197
Energy: 1.0749871785559424
Energy: 1.1768627158282148
Energy: 1.0749871785559424
Energy: 1.1768627158277096
Energy: 1.0749871785569525
Energy: 1.1443329775882354
Energy: 1.1750273672019667
Energy: 1.1443329775902558
Energy: 1.1750273672014615
Energy: 1.1443329775887405
Energy: 1.1750273672024718
Energy: 1.0903275943686606
Energy: 1.0742129198401502
Energy: 1.0903275943691657
Energy: 1.0742129198396453
Energy: 1.0903275943696709
Energy: 1.0742129198401502
Energy: 1.059047578809938
Energy: 1.0717489937063276
Energy: 1.059047578809433
Energy: 1.071748993703802
Energy: 1.059047578808928
Energy: 1.0717489937098632
Energy: 1.1967337060030043
Energy: 1.0186490611599
Energy: 1.1967337060040144
Energy: 1.0186490611604049
Energy: 1.1967337060035095
Energy: 1.0186490611604049
Energy: 1.0527102077139303
Energy: 1.075952561385332
Energy: 1.0527102077144352
Energy: 1.075952561385332
Energy: 1.05271020771191
Energy: 1.075952561385332

minimum gb energy = 1.0096310357460718 eV
minimum distance =  2.274120257197 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.3176168067390563
Energy: 1.2072469437072402
Energy: 1.3176168067390563
Energy: 1.2072469437072402
Energy: 1.317616806737677
Energy: 1.2072469437072402
Energy: 1.1994031497711408
Energy: 1.2498843073160604
Energy: 1.1994031497711408
Energy: 1.2498843073160604
Energy: 1.1994031497711408
Energy: 1.2498843073160604
Energy: 1.3937044973344148
Energy: 1.3034165537770677
Energy: 1.3937044973330357
Energy: 1.3034165537770677
Energy: 1.3937044973330357
Energy: 1.3034165537756885
Energy: 1.2756588081921207
Energy: 1.330488953331295
Energy: 1.275658808190742
Energy: 1.330488953331295
Energy: 1.275658808190742
Energy: 1.330488953331295
Energy: 1.3205882986469786
Energy: 1.238005548244337
Energy: 1.3205882986455995
Energy: 1.2380055482457162
Energy: 1.3205882986469786
Energy: 1.238005548244337
Energy: 1.3752871154148734
Energy: 1.3435217371189576
Energy: 1.3752871154134942
Energy: 1.3435217371189576
Energy: 1.3752871154121153
Energy: 1.3435217371203365
Energy: 1.2842905401133917
Energy: 1.1906590402125246
Energy: 1.2842905401133917
Energy: 1.1906590402111457
Energy: 1.2842905401120124
Energy: 1.1906590402111457
Energy: 1.2776652449437438
Energy: 1.2786159275972613
Energy: 1.2776652449423649
Energy: 1.2786159275972613
Energy: 1.2776652449423649
Energy: 1.2786159275958824
Energy: 1.2039710276956384
Energy: 1.206565892456049
Energy: 1.2039710276970172
Energy: 1.206565892456049
Energy: 1.2039710276956384
Energy: 1.206565892456049
Energy: 1.33922348817989
Energy: 1.2120508459273736
Energy: 1.33922348817989
Energy: 1.2120508459273736
Energy: 1.339223488178511
Energy: 1.2120508459273736
Energy: 1.2012142697604022
Energy: 1.287035464145422
Energy: 1.2012142697604022
Energy: 1.287035464145422
Energy: 1.2012142697590233
Energy: 1.287035464145422
Energy: 1.2648113644229082
Energy: 1.248933511112096
Energy: 1.2648113644215295
Energy: 1.248933511113475
Energy: 1.2648113644229082
Energy: 1.248933511112096
Energy: 1.3030199454512126
Energy: 1.3310394415203666
Energy: 1.3030199454512126
Energy: 1.3310394415203666
Energy: 1.3030199454498337
Energy: 1.3310394415203666
Energy: 1.3180776608793268
Energy: 1.2507340948169754
Energy: 1.3180776608779479
Energy: 1.2507340948183543
Energy: 1.3180776608779479
Energy: 1.2507340948183543

minimum gb energy = 1.1906590402111457 eV
minimum distance =  2.23263011063073 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.4622898518905976
Energy: 1.435551409747233
Energy: 1.4622898518912035
Energy: 1.435551409747233
Energy: 1.4622898518887804
Energy: 1.435551409747839
Energy: 1.322258314159754
Energy: 1.4177444437695639
Energy: 1.3222583141603599
Energy: 1.4177444437695639
Energy: 1.322258314159754
Energy: 1.4177444437695639
Energy: 1.4103083111023935
Energy: 1.4092535805420996
Energy: 1.4103083111029993
Energy: 1.4092535805420996
Energy: 1.4103083111017878
Energy: 1.4092535805420996
Energy: 1.406248734056905
Energy: 1.351748724442511
Energy: 1.406248734056905
Energy: 1.351748724442511
Energy: 1.406248734056905
Energy: 1.351748724442511
Energy: 1.4432698463526443
Energy: 1.3845935195178578
Energy: 1.4432698463520384
Energy: 1.3845935195178578
Energy: 1.4432698463532503
Energy: 1.3845935195178578
Energy: 1.3664415795641012
Energy: 1.421748036437813
Energy: 1.3664415795641012
Energy: 1.421748036437813
Energy: 1.3664415795641012
Energy: 1.421748036437813
Energy: 1.404219436542417
Energy: 1.4001817907247613
Energy: 1.404219436542417
Energy: 1.4001817907247613
Energy: 1.404219436542417
Energy: 1.4001817907247613
Energy: 1.3824001162269053
Energy: 1.4051762336668099
Energy: 1.3824001162275112
Energy: 1.4051762336662041
Energy: 1.3824001162275112
Energy: 1.4051762336662041
Energy: 1.405348888220365
Energy: 1.3818168006331815
Energy: 1.4053488882197591
Energy: 1.3818168006331815
Energy: 1.4053488882197591
Energy: 1.3818168006331815
Energy: 1.3817566972853987
Energy: 1.4191594527045894
Energy: 1.3817566972847932
Energy: 1.4191594527051952
Energy: 1.3817566972853987
Energy: 1.4191594527051952
Energy: 1.3820653766342212
Energy: 1.403915020710701
Energy: 1.3820653766336153
Energy: 1.403915020710701
Energy: 1.3820653766336153
Energy: 1.4039150207113067
Energy: 1.4102906233934391
Energy: 1.4318324379975935
Energy: 1.4102906233946506
Energy: 1.4318324379975935
Energy: 1.4102906233934391
Energy: 1.4318324379975935
Energy: 1.414391828139078
Energy: 1.3753391455748682
Energy: 1.4143918281396837
Energy: 1.3753391455748682
Energy: 1.414391828138472
Energy: 1.3753391455748682
Energy: 1.378722289759091
Energy: 1.438161288612082
Energy: 1.378722289759091
Energy: 1.438161288612082
Energy: 1.3787222897596967
Energy: 1.438161288612082
Energy: 1.3591964863045232
Energy: 1.3742643962999244
Energy: 1.3591964863045232
Energy: 1.3742643962999244
Energy: 1.3591964863039172
Energy: 1.3742643962999244
Energy: 1.3978432056023775
Energy: 1.400074179299349
Energy: 1.3978432056023775
Energy: 1.4000741793005607
Energy: 1.3978432056023775
Energy: 1.4000741793005607
Energy: 1.3416936953068905
Energy: 1.4136955582939836
Energy: 1.3416936953068905
Energy: 1.4136955582939836
Energy: 1.3416936953068905
Energy: 1.4136955582939836
Energy: 1.458576181774591
Energy: 1.448231580155675
Energy: 1.458576181774591
Energy: 1.4482315775276162
Energy: 1.458576181774591
Energy: 1.448231570431296
Energy: 1.3631901837448697
Energy: 1.3309912855727881
Energy: 1.3631901837454756
Energy: 1.3309912855721824
Energy: 1.3631901837448697
Energy: 1.3309912855727881
Energy: 1.412054137118696
Energy: 1.3863878930050064
Energy: 1.4120541371205135
Energy: 1.3863878930050064
Energy: 1.4120541371168787
Energy: 1.3863878930050064
Energy: 1.3332051730134664
Energy: 1.3594796715615696
Energy: 1.3332051730140444
Energy: 1.3594796715615696
Energy: 1.3332051730134664
Energy: 1.3594796715615696
Energy: 1.483127627790651
Energy: 1.4342725645435497
Energy: 1.4831276277918628
Energy: 1.4342725645435497
Energy: 1.4831276277912568
Energy: 1.434272564542944
Energy: 1.3858589437508395
Energy: 1.4093296333068828
Energy: 1.3858589437502338
Energy: 1.4093296333062768
Energy: 1.3858589437514455
Energy: 1.4093296333068828
Energy: 1.4467093668606048
Energy: 1.4170595430536246
Energy: 1.4467093668606048
Energy: 1.4170595430530186
Energy: 1.4467093668606048
Energy: 1.4170595430536246
Energy: 1.3771575936444458
Energy: 1.393408317026752
Energy: 1.3771575936450517
Energy: 1.393408317026752
Energy: 1.3771575936444458
Energy: 1.393408317026752
Energy: 1.3789341788319414
Energy: 1.3894067892174191
Energy: 1.3789341788319414
Energy: 1.3894067892168132
Energy: 1.3789341788313356
Energy: 1.3894067892168132
Energy: 1.3645836832374003
Energy: 1.4414813990352426
Energy: 1.3645836832374003
Energy: 1.4414813990376658
Energy: 1.364583683238006
Energy: 1.4414813990382715
Energy: 1.4249957369173296
Energy: 1.3577591709367531
Energy: 1.424995736916118
Energy: 1.3577591709373587
Energy: 1.424995736916118
Energy: 1.3577591709367531
Energy: 1.379957539010958
Energy: 1.4504797873414446
Energy: 1.379957539011564
Energy: 1.4504797873414446
Energy: 1.379957539010958
Energy: 1.4504797873414446
Energy: 1.3615713363389723
Energy: 1.3152899738919483
Energy: 1.3615713363389723
Energy: 1.3152899738925543
Energy: 1.3615713363389723
Energy: 1.3152899738919483
Energy: 1.389083010125257
Energy: 1.447605482582808
Energy: 1.389083010125257
Energy: 1.4476054825822022
Energy: 1.3890830101246512
Energy: 1.4476054825822022

minimum gb energy = 1.3152899738919483 eV
minimum distance =  2.20725990803725 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.343626348149034
Energy: 1.3251770915156893
Energy: 1.343626348149034
Energy: 1.3251770915156893
Energy: 1.343626348149034
Energy: 1.3251770915156893
Energy: 1.4268945311460661
Energy: 1.3403993164842793
Energy: 1.4268945311449883
Energy: 1.3403993164842793
Energy: 1.4268945311460661
Energy: 1.3403993164842793
Energy: 1.430897525825493
Energy: 1.3852388614866702
Energy: 1.430897525826571
Energy: 1.3852388614866702
Energy: 1.430897525825493
Energy: 1.3852388614866702
Energy: 1.361088962722861
Energy: 1.396213051701256
Energy: 1.361088962723939
Energy: 1.396213051702334
Energy: 1.361088962723939
Energy: 1.3920096449847275
Energy: 1.4307588615042024
Energy: 1.3852523200001328
Energy: 1.4307588615052806
Energy: 1.3852523200012106
Energy: 1.4307588615052806
Energy: 1.3852523200012106
Energy: 1.4270108130680887
Energy: 1.3389556469779489
Energy: 1.4270108130680887
Energy: 1.3389556469779489
Energy: 1.427010813069167
Energy: 1.3389556469779489
Energy: 1.34362634815119
Energy: 1.3251770915135332
Energy: 1.34362634815119
Energy: 1.3251770915135332
Energy: 1.34362634815119
Energy: 1.3251770915135332
Energy: 1.4268945311482224
Energy: 1.3403993164842793
Energy: 1.4268945311471444
Energy: 1.3403993164832013
Energy: 1.4268945311482224
Energy: 1.3403993164832013
Energy: 1.430897525825493
Energy: 1.385238861485592
Energy: 1.4308975258244148
Energy: 1.385238861485592
Energy: 1.4308975258244148
Energy: 1.385238861485592
Energy: 1.3610889627260951
Energy: 1.4179628887014606
Energy: 1.3610889627282512
Energy: 1.4642760699025483
Energy: 1.3610889627271732
Energy: 1.3920096449847275
Energy: 1.4307588615063584
Energy: 1.3852523200001328
Energy: 1.4307588615052806
Energy: 1.3852523200001328
Energy: 1.4307588615063584
Energy: 1.3852523200001328
Energy: 1.4270108130648547
Energy: 1.3389556469790271
Energy: 1.4270108130637766
Energy: 1.3389556469779489
Energy: 1.4270108130648547
Energy: 1.3389556469790271
Energy: 1.343626348149034
Energy: 1.3251770915156893
Energy: 1.343626348149034
Energy: 1.3251770915156893
Energy: 1.3436263481501118
Energy: 1.3251770915156893
Energy: 1.4268945311460661
Energy: 1.3403993164842793
Energy: 1.4268945311449883
Energy: 1.3403993164832013
Energy: 1.4268945311449883
Energy: 1.3403993164832013
Energy: 1.430897525826571
Energy: 1.3852388614866702
Energy: 1.430897525826571
Energy: 1.3852388614866702
Energy: 1.430897525825493
Energy: 1.3852388614866702
Energy: 1.361088962723939
Energy: 1.3796349138660977
Energy: 1.3610889627250171
Energy: 1.3796349138660977
Energy: 1.361088962723939
Energy: 1.3796349138660977
Energy: 1.4307588615042024
Energy: 1.3852523200012106
Energy: 1.4307588615052806
Energy: 1.3852523200012106
Energy: 1.4307588615052806
Energy: 1.3852523200012106

minimum gb energy = 1.3251770915135332 eV
minimum distance =  2.26634222134401 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.440639075976349
Energy: 1.5356415065943338
Energy: 1.4406390759754686
Energy: 1.5356415065943338
Energy: 1.440639075976349
Energy: 1.5356415065943338
Energy: 1.4711279012891652
Energy: 1.4492725014521732
Energy: 1.471127901288285
Energy: 1.4492725014521732
Energy: 1.471127901288285
Energy: 1.4492725014530534
Energy: 1.5083479317542932
Energy: 1.4304777473037922
Energy: 1.5083479317542932
Energy: 1.4304777473037922
Energy: 1.5083479317542932
Energy: 1.4304777473037922
Energy: 1.4111929731234845
Energy: 1.5596754113344442
Energy: 1.411192973125245
Energy: 1.5596754113344442
Energy: 1.4111929731243646
Energy: 1.5596754113362046
Energy: 1.4353684646807197
Energy: 1.4455922425829029
Energy: 1.4353684646807197
Energy: 1.4455922425829029
Energy: 1.4353684646807197
Energy: 1.4455922425829029
Energy: 1.446184974201226
Energy: 1.4177090622119526
Energy: 1.4461849742021062
Energy: 1.4177090622119526
Energy: 1.4461849742021062
Energy: 1.4177090622119526
Energy: 1.4143247930927165
Energy: 1.4875215973781981
Energy: 1.4143247930927165
Energy: 1.4875215973773177
Energy: 1.4143247930935965
Energy: 1.4875215973781981
Energy: 1.4407491806282136
Energy: 1.4664326348330843
Energy: 1.4407491806282136
Energy: 1.4664326348330843
Energy: 1.4407491806282136
Energy: 1.4664326348339642
Energy: 1.6140701484379747
Energy: 1.454028809168955
Energy: 1.6140701484406152
Energy: 1.454028809168955
Energy: 1.6140701484388547
Energy: 1.454028809168955
Energy: 1.4107952789664895
Energy: 1.4577141484648473
Energy: 1.410795278965609
Energy: 1.4577141484648473
Energy: 1.410795278965609
Energy: 1.4577141484648473
Energy: 1.4768289937886359
Energy: 1.4625054299468367
Energy: 1.4768289937868755
Energy: 1.4625054299459566
Energy: 1.4768289937886359
Energy: 1.4625054299468367
Energy: 1.5310165545601886
Energy: 1.4315509196500933
Energy: 1.5310165545593084
Energy: 1.4315509196500933
Energy: 1.5310165545610688
Energy: 1.431550919649213
Energy: 1.4143998690959232
Energy: 1.4815369987521327
Energy: 1.4143998690941628
Energy: 1.4815369987512523
Energy: 1.4143998690959232
Energy: 1.4815369987512523
Energy: 1.4562800318109128
Energy: 1.5097900054562903
Energy: 1.4562800318100326
Energy: 1.5097900054562903
Energy: 1.4562800318100326
Energy: 1.5097900054562903
Energy: 1.547933459027213
Energy: 1.4286558248181302
Energy: 1.5479334590263325
Energy: 1.42865582481725
Energy: 1.5479334590254523
Energy: 1.4286558248181302
Energy: 1.441640584948119
Energy: 1.4662434732620997
Energy: 1.4416405849445981
Energy: 1.4662434732620997
Energy: 1.4416405849463585
Energy: 1.4662434732620997
Energy: 1.4648971194196188
Energy: 1.460322389455394
Energy: 1.4648971194213791
Energy: 1.460322389455394
Energy: 1.4648971194213791
Energy: 1.460322389455394
Energy: 1.6141776472847436
Energy: 1.4307734500559297
Energy: 1.6141776472803426
Energy: 1.4307734500550493
Energy: 1.6141776472829832
Energy: 1.4307734500541691
Energy: 1.418505780896462
Energy: 1.463127701877354
Energy: 1.418505780896462
Energy: 1.4631277018791145
Energy: 1.4185057808973425
Energy: 1.4631277018799949
Energy: 1.4199234323087475
Energy: 1.47464147613441
Energy: 1.4199234323096277
Energy: 1.47464147613529
Energy: 1.4199234323096277
Energy: 1.47464147613529
Energy: 1.5333445648191644
Energy: 1.4272424745951084
Energy: 1.5333445648191644
Energy: 1.4272424745951084
Energy: 1.5333445648200446
Energy: 1.4272424745951084

minimum gb energy = 1.410795278965609 eV
minimum distance =  2.24394552638642 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.39332084536007
Energy: 1.465334954655187
Energy: 1.3308561630817641
Energy: 1.465334954655187
Energy: 1.3933208453608121
Energy: 1.4653349546581547
Energy: 1.423575545126256
Energy: 1.387024477877474
Energy: 1.42357554512403
Energy: 1.387024477876732
Energy: 1.423575545126256
Energy: 1.387024477877474
Energy: 1.4901209202560375
Energy: 1.3550010699749584
Energy: 1.4901209202552956
Energy: 1.3550010699749584
Energy: 1.4901209202560375
Energy: 1.355001069978668
Energy: 1.330220393671394
Energy: 1.5280514869657422
Energy: 1.330220393674362
Energy: 1.5280514869657422
Energy: 1.3302203936721362
Energy: 1.5280514869627746
Energy: 1.3876219929059332
Energy: 1.3648772890886218
Energy: 1.3876219929051914
Energy: 1.364877289089364
Energy: 1.3876219929059332
Energy: 1.364877289085654
Energy: 1.470374075335586
Energy: 1.3302726926587998
Energy: 1.4703740753318764
Energy: 1.3302726926595418
Energy: 1.470374075335586
Energy: 1.3302726926580581
Energy: 1.330597897487375
Energy: 1.4821551929311596
Energy: 1.3305978974888588
Energy: 1.4821551929311596
Energy: 1.330597897487375
Energy: 1.4821551929333854
Energy: 1.5157779386783075
Energy: 1.4463429896056166
Energy: 1.5157779386775654
Energy: 1.4463429896056166
Energy: 1.5157779386775654
Energy: 1.4463429896033906
Energy: 1.4166361188988208
Energy: 1.3302778714689427
Energy: 1.4166361189010468
Energy: 1.3302778714689427
Energy: 1.4166361188988208
Energy: 1.3302778714659749
Energy: 1.3302724927241114
Energy: 1.4184912930335078
Energy: 1.3302724927255953
Energy: 1.4184912930335078
Energy: 1.3302724927241114
Energy: 1.418491293031282
Energy: 1.3302291875157268
Energy: 1.4635568394465661
Energy: 1.3302291875164687
Energy: 1.4635568394473082
Energy: 1.3302291875149848
Energy: 1.4635568394473082
Energy: 1.4786435123857804
Energy: 1.3651251357010648
Energy: 1.4786435123820705
Energy: 1.3651251357010648
Energy: 1.4786435123857804
Energy: 1.3651251357047747
Energy: 1.4464350053637116
Energy: 1.5164591327714139
Energy: 1.4464350053644537
Energy: 1.5164591327714139
Energy: 1.4464350053644537
Energy: 1.5164591327758656
Energy: 1.3307291991487284
Energy: 1.417870071524705
Energy: 1.3307291991465027
Energy: 1.417870071524705
Energy: 1.3307291991487284
Energy: 1.417870071523221
Energy: 1.4707134263333501
Energy: 1.3302957273306701
Energy: 1.470713426332608
Energy: 1.3302957273306701
Energy: 1.4707134263333501
Energy: 1.330295727335122
Energy: 1.3878933756615623
Energy: 1.3670043901582656
Energy: 1.3878933756622704
Energy: 1.3670043901582656
Energy: 1.3878933756622704
Energy: 1.3670043901597497
Energy: 1.363262141938176
Energy: 1.4784249038693629
Energy: 1.3632621419366924
Energy: 1.4784249038693629
Energy: 1.363262141938176
Energy: 1.4784249038678792
Energy: 1.4814390529667378
Energy: 1.3562011828249687
Energy: 1.4814390529697057
Energy: 1.3562011828249687
Energy: 1.4814390529697057
Energy: 1.3562011828301626
Energy: 1.4067906926224247
Energy: 1.3803835649758747
Energy: 1.3525389824687795
Energy: 1.3803835649758747
Energy: 1.4067906926224247
Energy: 1.3803835649729066
Energy: 1.3933208453585864
Energy: 1.4653349546537031
Energy: 1.3308561630817641
Energy: 1.4653349546537031
Energy: 1.3933208453585864
Energy: 1.4653349546566707
Energy: 1.423575545126256
Energy: 1.387024477878958
Energy: 1.423575545122546
Energy: 1.387024477878958
Energy: 1.423575545125514
Energy: 1.387024477880442
Energy: 1.4901209202560375
Energy: 1.3550010699742165
Energy: 1.4901209202560375
Energy: 1.3550010699749584
Energy: 1.4901209202560375
Energy: 1.3550010699771842
Energy: 1.3302203936706523
Energy: 1.5280514869650001
Energy: 1.330220393674362
Energy: 1.5280514869650001
Energy: 1.3302203936699102
Energy: 1.5280514869620325
Energy: 1.3876219929029654
Energy: 1.3648772890886218
Energy: 1.3876219929022235
Energy: 1.364877289089364
Energy: 1.3876219929029654
Energy: 1.364877289085654
Energy: 1.47037407533707
Energy: 1.3302726926565742
Energy: 1.4703740753326182
Energy: 1.3302726926565742
Energy: 1.47037407533707
Energy: 1.3302726926558321

minimum gb energy = 1.3302203936699102 eV
minimum distance =  2.29069298914526 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.3263964775696084
Energy: 1.5384789536665129
Energy: 1.3263964775696084
Energy: 1.5384789536665129
Energy: 1.3263964775696084
Energy: 1.5384789536671535
Energy: 1.4453760860258669
Energy: 1.329387819016995
Energy: 1.4453760860252265
Energy: 1.3293878190163544
Energy: 1.4453760860252265
Energy: 1.3293878190163544
Energy: 1.4906912196137807
Energy: 1.26753552847945
Energy: 1.4906912196137807
Energy: 1.26753552847945
Energy: 1.49069121961314
Energy: 1.26753552847945
Energy: 1.2876689142015387
Energy: 1.4629495956103924
Energy: 1.2876689142015387
Energy: 1.4629495956103924
Energy: 1.2876689142008984
Energy: 1.4629495956103924
Energy: 1.370403771742402
Energy: 1.4326198617716384
Energy: 1.3704037717430426
Energy: 1.4326198617716384
Energy: 1.3704037717436832
Energy: 1.4326198617716384
Energy: 1.4282476050692443
Energy: 1.2903469979879894
Energy: 1.4282476050705255
Energy: 1.2903469979879894
Energy: 1.4282476050705255
Energy: 1.2903469979879894
Energy: 1.2739960916575714
Energy: 1.42570429199584
Energy: 1.273996091658212
Energy: 1.425704291997121
Energy: 1.2739960916575714
Energy: 1.4257042919964806
Energy: 1.3349687130195682
Energy: 1.4316358260114925
Energy: 1.3349687130195682
Energy: 1.4316358260114925
Energy: 1.3349687130189278
Energy: 1.4316358260102116
Energy: 1.5385585095222893
Energy: 1.2668372687608358
Energy: 1.5385585095222893
Energy: 1.2668372687601954
Energy: 1.5385585095222893
Energy: 1.2668372687601954
Energy: 1.4007139806785014
Energy: 1.3979390611360458
Energy: 1.4007139806797826
Energy: 1.3979390611360458
Energy: 1.4007139806785014
Energy: 1.3979390611360458
Energy: 1.2748795620802442
Energy: 1.5833379010305713
Energy: 1.2748795620796036
Energy: 1.5833379010305713
Energy: 1.2748795620796036
Energy: 1.5833379010312116
Energy: 1.5004507384504784
Energy: 1.2908974404682745
Energy: 1.500450738451119
Energy: 1.2908974404689149
Energy: 1.5004507384504784
Energy: 1.2908974404689149
Energy: 1.350796214630503
Energy: 1.3158215904091932
Energy: 1.3507962146298624
Energy: 1.3158215904085526
Energy: 1.3507962146298624
Energy: 1.315821590405991
Energy: 1.2882492308845337
Energy: 1.4436255220378018
Energy: 1.2882492308838933
Energy: 1.4436255220378018
Energy: 1.2882492308845337
Energy: 1.4436255220378018
Energy: 1.46351205110038
Energy: 1.2677742331707074
Energy: 1.4635120511010205
Energy: 1.2677742331707074
Energy: 1.46351205110038
Energy: 1.2677742331707074
Energy: 1.4338405997596926
Energy: 1.2670160178922232
Energy: 1.4338405997603332
Energy: 1.2670160178922232
Energy: 1.4338405997584116
Energy: 1.2670160178922232
Energy: 1.3026009822300169
Energy: 1.4712496901061656
Energy: 1.3026009822300169
Energy: 1.4712496901061656
Energy: 1.3026009822306572
Energy: 1.4712496901061656
Energy: 1.4145074883799538
Energy: 1.4012160327917995
Energy: 1.4145074883799538
Energy: 1.4012160327917995
Energy: 1.4145074883805944
Energy: 1.4012160327917995
Energy: 1.474736621406155
Energy: 1.2883715276649865
Energy: 1.474736621406155
Energy: 1.2883715276649865
Energy: 1.4747366214055146
Energy: 1.2883715276649865
Energy: 1.2888409316464038
Energy: 1.4612155384726846
Energy: 1.2888409316470444
Energy: 1.4612155384726846
Energy: 1.2888409316457632
Energy: 1.4612155384726846
Energy: 1.272098346279124
Energy: 1.5016876675517217
Energy: 1.2720983462778432
Energy: 1.5016876675504407
Energy: 1.272098346279124
Energy: 1.501687667552362
Energy: 1.546836199195325
Energy: 1.2903751772526015
Energy: 1.546836199196606
Energy: 1.2903751772526015
Energy: 1.546836199196606
Energy: 1.2903751772526015
Energy: 1.3771780731929915
Energy: 1.3315948562622204
Energy: 1.3771780731936316
Energy: 1.3315948562622204
Energy: 1.3771780731936316
Energy: 1.3315948562622204
Energy: 1.3205725380233944
Energy: 1.486590447988438
Energy: 1.3205725380240347
Energy: 1.486590447988438
Energy: 1.3205725380233944
Energy: 1.486590447988438
Energy: 1.4195311762389307
Energy: 1.2937290379028268
Energy: 1.4195311762382905
Energy: 1.2937290379034672
Energy: 1.4195311762389307
Energy: 1.2937290379028268
Energy: 1.3335725768908804
Energy: 1.300890804705167
Energy: 1.3335725768895994
Energy: 1.3008908047058074
Energy: 1.3335725768902398
Energy: 1.3008908047058074
Energy: 1.2672080929233145
Energy: 1.4551008395818068
Energy: 1.2672080929226741
Energy: 1.4551008395818068
Energy: 1.2672080929233145
Energy: 1.4551008395818068
Energy: 1.4605989398972026
Energy: 1.2883986325517243
Energy: 1.460598939896562
Energy: 1.2883986325523646
Energy: 1.4605989398972026
Energy: 1.2883986325517243
Energy: 1.430939546095525
Energy: 1.2882940019270075
Energy: 1.4309395460961656
Energy: 1.2882940019270075
Energy: 1.4309395460961656
Energy: 1.288294001927648

minimum gb energy = 1.2668372687601954 eV
minimum distance =  2.25134892350182 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.2458578486847867
Energy: 1.4539166682359543
Energy: 1.2458578486853495
Energy: 1.4539166682359543
Energy: 1.2458578486842236
Energy: 1.453916668236517
Energy: 1.3817986100798785
Energy: 1.2552547489231118
Energy: 1.3817986100804416
Energy: 1.2552547489231118
Energy: 1.3817986100798785
Energy: 1.2552547489231118
Energy: 1.4404575092185732
Energy: 1.227777274785532
Energy: 1.4404575092196992
Energy: 1.227777274785532
Energy: 1.4404575092185732
Energy: 1.227777274785532
Energy: 1.198302447515305
Energy: 1.4500697904923945
Energy: 1.198302447513616
Energy: 1.4500697904923945
Energy: 1.198302447515305
Energy: 1.4500697904923945
Energy: 1.3116463802163658
Energy: 1.2602803885219425
Energy: 1.3116463802152398
Energy: 1.2602803885230685
Energy: 1.3116463802163658
Energy: 1.2602803885213796
Energy: 1.431520646212074
Energy: 1.2093497693031041
Energy: 1.4315206462115109
Energy: 1.2093497693031041
Energy: 1.4315206462115109
Energy: 1.2093497693031041
Energy: 1.255992739120933
Energy: 1.379591375449711
Energy: 1.2559927391254366
Energy: 1.3795913754542153
Energy: 1.2559927391254366
Energy: 1.3795913754502742
Energy: 1.1978568126437974
Energy: 1.4307865080106175
Energy: 1.1978568126426716
Energy: 1.4307865080123066
Energy: 1.1978568126432345
Energy: 1.4307865080106175
Energy: 1.4305739772183976
Energy: 1.2113217373371374
Energy: 1.430573977218961
Energy: 1.2113217373365741
Energy: 1.430573977218961
Energy: 1.2113217373360112
Energy: 1.3114210099137495
Energy: 1.3831690582542293
Energy: 1.3114210099148753
Energy: 1.3831690582542293
Energy: 1.3114210099143124
Energy: 1.3831690582542293
Energy: 1.197319578407273
Energy: 1.5826817303829943
Energy: 1.197319578408962
Energy: 1.5826817303835574
Energy: 1.1973195784083992
Energy: 1.5826817303829943
Energy: 1.305647700651589
Energy: 1.2572598724458701
Energy: 1.3056477006499
Energy: 1.257259872446433
Energy: 1.3056477006499
Energy: 1.257259872446433
Energy: 1.406053086650328
Energy: 1.2278776491216035
Energy: 1.406053086650891
Energy: 1.2278776491221663
Energy: 1.406053086650328
Energy: 1.2278776491221663
Energy: 1.2458247559536002
Energy: 1.4572411339571272
Energy: 1.2458247559519113
Energy: 1.4572411339554379
Energy: 1.2458247559524742
Energy: 1.4572411339520601
Energy: 1.2460777421402383
Energy: 1.3191071342068377
Energy: 1.2460777421402383
Energy: 1.3191071342062748
Energy: 1.2460777421413642
Energy: 1.3191071342051488
Energy: 1.4395338138047635
Energy: 1.2307800380671383
Energy: 1.4395338138042006
Energy: 1.2307800380665752
Energy: 1.4395338138047635
Energy: 1.2307800380671383
Energy: 1.1921787820690555
Energy: 1.3980768502619272
Energy: 1.1921787820696184
Energy: 1.3980768502619272
Energy: 1.1921787820696184
Energy: 1.398076850266994
Energy: 1.1920558111129171
Energy: 1.3939718094263007
Energy: 1.192055811114606
Energy: 1.3939718094263007
Energy: 1.1920558111140431
Energy: 1.3939718094263007
Energy: 1.431890296919002
Energy: 1.209557182248272
Energy: 1.4318902969195648
Energy: 1.2095571822488353
Energy: 1.431890296919002
Energy: 1.209557182248272
Energy: 1.2550677319699117
Energy: 1.3304780200575002
Energy: 1.2550677319687857
Energy: 1.3304780200591895
Energy: 1.2550677319682226
Energy: 1.3304780200569373
Energy: 1.2165044419004993
Energy: 1.5926785626355857
Energy: 1.2165044419021884
Energy: 1.5926785626355857
Energy: 1.2165044419004993
Energy: 1.5926785626338966
Energy: 1.4162598271381361
Energy: 1.2091435432036084
Energy: 1.4162598271381361
Energy: 1.2091435432036084
Energy: 1.4162598271375733
Energy: 1.2091435432036084
Energy: 1.4067866601249348
Energy: 1.2091708937521664
Energy: 1.406786660123809
Energy: 1.2091708937521664
Energy: 1.406786660124372
Energy: 1.2091708937527295
Energy: 1.1984319981486413
Energy: 1.4668482520773047
Energy: 1.1984319981486413
Energy: 1.466848252076179
Energy: 1.198431998149767
Energy: 1.4668482520773047
Energy: 1.3495717598997559
Energy: 1.262560862297866
Energy: 1.3495717599020076
Energy: 1.262560862298429
Energy: 1.3495717599020076
Energy: 1.2625608622973028
Energy: 1.4056472187424554
Energy: 1.2308261507560623
Energy: 1.4056472187418925
Energy: 1.2308261507566252
Energy: 1.4056472187413294
Energy: 1.2308261507560623
Energy: 1.2458299739098144
Energy: 1.487993298380561
Energy: 1.2458299739103775
Energy: 1.487993298380561
Energy: 1.2458299739092515
Energy: 1.487993298380561
Energy: 1.2457866655744179
Energy: 1.3686576204184597
Energy: 1.2457866655749807
Energy: 1.3686576204190228
Energy: 1.2457866655738548
Energy: 1.3686576204184597
Energy: 1.4668607558727145
Energy: 1.2278093836902024
Energy: 1.4668607558732776
Energy: 1.2278093836896395
Energy: 1.4668607558727145
Energy: 1.2278093836896395
Energy: 1.192151335923661
Energy: 1.3679686322342794
Energy: 1.1921513359230982
Energy: 1.3679686322337166
Energy: 1.192151335924224
Energy: 1.3679686322342794
Energy: 1.1916797604717786
Energy: 1.4238518027060916
Energy: 1.1916797604745935
Energy: 1.4238518027060916
Energy: 1.1916797604717786
Energy: 1.4238518027060916
Energy: 1.4682580507026728
Energy: 1.209113790272325
Energy: 1.468258050703236
Energy: 1.209113790271762
Energy: 1.468258050703236
Energy: 1.209113790272325
Energy: 1.4174985820686623
Energy: 1.2091570110023457
Energy: 1.4174985820686623
Energy: 1.2091570110017824
Energy: 1.4174985820686623
Energy: 1.2091570110023457

minimum gb energy = 1.1916797604717786 eV
minimum distance =  2.27195765571468 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020539009801693656
Energy: 1.1771048923016092
Energy: 0.020539009801693656
Energy: 1.1771048923011413
Energy: 0.020539009801693656
Energy: 1.1771048923002578
Energy: 0.02169636443352225
Energy: 0.4279933264828931
Energy: 0.02169636443352225
Energy: 0.4279933264824254
Energy: 0.02169636443352225
Energy: 0.42799332648336097
Energy: 1.1772921844424342
Energy: 0.4286531924128061
Energy: 1.1772921844456048
Energy: 0.42865319241005134
Energy: 1.1772921844200332
Energy: 0.42865319241140276
Energy: 0.02169636443393804
Energy: 0.42799332648148986
Energy: 0.021696364434405816
Energy: 0.42799332648148986
Energy: 0.02169636443393804
Energy: 0.4279933264819577

minimum gb energy = 0.020539009801693656 eV
minimum distance =  2.47852803427123 Angstroms
sigma value = 1