Model name: model_name=EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.560000121593475
cohesive_energy=4.4003460121350955
mass=55.845
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: 0.01755220450930003
Energy: 1.1454362548158858
Energy: 0.01755220450930003
Energy: 1.1454362548155623
Energy: 0.01755220450930003
Energy: 1.1454362548155623
Energy: 1.1454362548158858
Energy: 0.017757464087081027
Energy: 1.1454362548158858
Energy: 0.017757464082984963
Energy: 1.1454362548155623
Energy: 0.01775746408233822
Energy: 0.01755220450930003
Energy: 1.1454362548155623
Energy: 0.01755220450930003
Energy: 1.1454362548158858
Energy: 0.01755220450930003
Energy: 1.1454362548155623
Energy: 1.1454362548158858
Energy: 0.017757464082984963
Energy: 1.1454362548158858
Energy: 0.017757464086757654
Energy: 1.1454362548155623
Energy: 0.017757464082984963
Energy: 0.01755220450930003
Energy: 1.1454362548158858
Energy: 0.01755220450930003
Energy: 1.1454362548158858
Energy: 0.017552204508976658
Energy: 1.1454362548155623
Energy: 1.1454362548155623
Energy: 0.017757464083631713
Energy: 1.1454362548155623
Energy: 0.017757464085823464
Energy: 1.1454362548158858
Energy: 0.017757464082661593

minimum gb energy = 0.017552204508976658 eV
minimum distance =  2.51573223916807 Angstroms
sigma value = 1


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

Energy: 1.432567257893686
Energy: 1.2449108405019023
Energy: 1.432567257893686
Energy: 1.2449108405003453
Energy: 1.432567257893686
Energy: 1.2449108405034588
Energy: 1.5859880191924383
Energy: 1.1585417440378536
Energy: 1.5859880191908815
Energy: 1.1585417440370749
Energy: 1.585988019188546
Energy: 1.1585417440370749
Energy: 1.3206841472933897
Energy: 1.3842996585692737
Energy: 1.3206841472941682
Energy: 1.384299658570052
Energy: 1.3206841472926114
Energy: 1.3842996585708303
Energy: 1.400517851409398
Energy: 1.23612967858928
Energy: 1.4005178514101766
Energy: 1.2361296785885016
Energy: 1.400517851409398
Energy: 1.23612967858928
Energy: 1.3363456194026548
Energy: 1.4059727052827133
Energy: 1.3363456194026548
Energy: 1.4059727052889404
Energy: 1.3363456194034333
Energy: 1.4059727052819349
Energy: 1.437335782667019
Energy: 1.2214607162512865
Energy: 1.437335782667797
Energy: 1.2214607162512865
Energy: 1.437335782667797
Energy: 1.2214607162512865
Energy: 1.331742562387723
Energy: 1.4262538181604878
Energy: 1.33174256238928
Energy: 1.4262538181612663
Energy: 1.3317425623885015
Energy: 1.4262538181604878
Energy: 1.2482794597472338
Energy: 1.5143786737930633
Energy: 1.2482794597480122
Energy: 1.514378673790728
Energy: 1.2482794597480122
Energy: 1.514378673792285
Energy: 1.386493379967339
Energy: 1.4192056056278677
Energy: 1.3864933799688957
Energy: 1.4192056056285751
Energy: 1.3864933799657821
Energy: 1.4192056056285751
Energy: 1.133595349491062
Energy: 1.4527118695898187
Energy: 1.133595349491062
Energy: 1.45271186958437
Energy: 1.1335953494902835
Energy: 1.452711869592154
Energy: 1.3868955578810536
Energy: 1.2594881079487061
Energy: 1.3868955578802749
Energy: 1.2594881079487061
Energy: 1.3868955578818318
Energy: 1.2594881079487061
Energy: 1.0631675213211214
Energy: 1.3886733594480263
Energy: 1.0631675213203429
Energy: 1.388673359445691
Energy: 1.0631675213218996
Energy: 1.3886733594503613
Energy: 1.4527919484852654
Energy: 1.066113666368389
Energy: 1.4527919484860439
Energy: 1.0661136663691673
Energy: 1.4527919484876006
Energy: 1.0661136663691673
Energy: 1.2230809855533231
Energy: 1.307492551978946
Energy: 1.2230809855541016
Energy: 1.307492551977389
Energy: 1.2230809855533231
Energy: 1.307492551977389
Energy: 1.5829320641127909
Energy: 1.1499612885343025
Energy: 1.5829320641104556
Energy: 1.1499612885335244
Energy: 1.5829320641120121
Energy: 1.1499612885335244
Energy: 1.5856140109842547
Energy: 1.3607499823106286
Energy: 1.5856140109834767
Energy: 1.3607499823121854
Energy: 1.5856140109858117
Energy: 1.3607499823121854
Energy: 1.426332628267395
Energy: 1.3480517344882346
Energy: 1.42633262826973
Energy: 1.3480517344874563
Energy: 1.426332628268952
Energy: 1.3480517344874563
Energy: 1.4188041485866931
Energy: 1.2491572486879086
Energy: 1.4188041485936986
Energy: 1.2491572486902438
Energy: 1.4188041485898069
Energy: 1.249157248692579
Energy: 1.2308449253636076
Energy: 1.2371221310631797
Energy: 1.2308449253628293
Energy: 1.2371221310631797
Energy: 1.2308449253628293
Energy: 1.2371221310631797
Energy: 1.3773368856231887
Energy: 1.2214921182965344
Energy: 1.377336885623967
Energy: 1.2214921182965344
Energy: 1.3773368856231887
Energy: 1.2214921182973129
Energy: 1.1573281680254583
Energy: 1.471279424523492
Energy: 1.15732816802468
Energy: 1.4712794245203784
Energy: 1.1573281680254583
Energy: 1.471279424527384
Energy: 1.4425692308945337
Energy: 1.4282922586932856
Energy: 1.4425692308929772
Energy: 1.4282922586932856
Energy: 1.4425692308945337
Energy: 1.4282922586932856
Energy: 1.0580756845087995
Energy: 1.4269774452149981
Energy: 1.0580756845072428
Energy: 1.4269774452173336
Energy: 1.0580756845087995
Energy: 1.4269774452196686

minimum gb energy = 1.0580756845072428 eV
minimum distance =  2.381049985381 Angstroms
sigma value = 33


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

Energy: 1.572071948635016
Energy: 1.523140021777616
Energy: 1.4908411475971308
Energy: 1.5231400217798297
Energy: 1.572071948635459
Energy: 1.523140021781158
Energy: 1.420517098061217
Energy: 1.290505953001833
Energy: 1.420517098064759
Energy: 1.2905059530009477
Energy: 1.420517098061217
Energy: 1.2905059530031615
Energy: 1.1586338055001661
Energy: 1.2965163450681807
Energy: 1.1586338055023797
Energy: 1.2965163450695087
Energy: 1.1586338055006087
Energy: 1.2965163450703945
Energy: 1.5570578155476462
Energy: 1.5067845268302562
Energy: 1.5570578155542878
Energy: 1.5067845268302562
Energy: 1.5570578155498602
Energy: 1.50678452683734
Energy: 1.3581887922200426
Energy: 1.2989079811807702
Energy: 1.3581887922147295
Energy: 1.2989079811807702
Energy: 1.3581887922187144
Energy: 1.2989079811856408
Energy: 1.313237154443814
Energy: 1.1631111722213996
Energy: 1.3132371544429282
Energy: 1.1631111722213996
Energy: 1.3132371544424857
Energy: 1.1631111722333538
Energy: 1.539080184042405
Energy: 1.495255928355356
Energy: 1.5390801840401915
Energy: 1.495255928355799
Energy: 1.5390801840406343
Energy: 1.49525592836244
Energy: 1.087756814279724
Energy: 1.5803875166495769
Energy: 1.0877568142783958
Energy: 1.5803875166482488
Energy: 1.0877568142792813
Energy: 1.5803875166464778
Energy: 1.1057417660583881
Energy: 1.1646319114582293
Energy: 1.1057417660579454
Energy: 1.1646319114577868
Energy: 1.1057417660583881
Energy: 1.1646319114520307
Energy: 1.1767158096587993
Energy: 1.3669675385308537
Energy: 1.176712974823388
Energy: 1.3669675385224413
Energy: 1.1767158096587993
Energy: 1.3669675385219986
Energy: 1.5153234595835143
Energy: 1.1758886080158633
Energy: 1.5153234595790868
Energy: 1.175888608016306
Energy: 1.5153234595808578
Energy: 1.175888608016306
Energy: 1.1739800095290187
Energy: 1.1801281055771269
Energy: 1.1739798885701862
Energy: 1.1801281055771269
Energy: 1.1739800095290187
Energy: 1.180128105574068
Energy: 1.4948769395129848
Energy: 1.1505584588479645
Energy: 1.4948769395138701
Energy: 1.1505584588488498
Energy: 1.4948769395129848
Energy: 1.150558458854163
Energy: 1.4948228952820684
Energy: 1.5287595289284437
Energy: 1.49482289528561
Energy: 1.5287595289275582
Energy: 1.4948228952825109
Energy: 1.5287595289288864
Energy: 1.368514916170302
Energy: 1.2963814578522979
Energy: 1.3685149161738037
Energy: 1.2963814578536261
Energy: 1.3685149161729586
Energy: 1.2963814578514126
Energy: 1.1586885468570791
Energy: 1.2944459180519814
Energy: 1.1586885468530943
Energy: 1.2944459180533097
Energy: 1.1586885468566364
Energy: 1.2944459180590655
Energy: 1.5986098096655965
Energy: 1.5086574140092224
Energy: 1.598609809668253
Energy: 1.5086574140087798
Energy: 1.5986098096651538
Energy: 1.5086574140176348
Energy: 1.365115595756073
Energy: 1.1635182259407577
Energy: 1.3651155957574013
Energy: 1.1635182259403147
Energy: 1.365115595763157
Energy: 1.1635182259314598
Energy: 1.3086584562852586
Energy: 1.308461598620124
Energy: 1.3086584562830448
Energy: 1.3084615986183532
Energy: 1.3086584562852586
Energy: 1.3084615986183532
Energy: 1.5263216525551504
Energy: 1.4902324491169585
Energy: 1.5263216525547076
Energy: 1.4902324491169585
Energy: 1.5263216525582497
Energy: 1.4902324491125714
Energy: 1.0858953444389405
Energy: 1.4219445085226705
Energy: 1.085895344438055
Energy: 1.4219445085226705
Energy: 1.0858953444389405
Energy: 1.4219445085253268
Energy: 1.2574397412911067
Energy: 1.1591089816808473
Energy: 1.257439741292435
Energy: 1.1591089816804045
Energy: 1.2574397412915495
Energy: 1.1591089816799618
Energy: 1.1828914381144737
Energy: 1.1626856422569634
Energy: 1.182891503995265
Energy: 1.1626305061565447
Energy: 1.182891438114031
Energy: 1.1627747740486527
Energy: 1.3771243895816898
Energy: 1.3520800183152897
Energy: 1.377124399230672
Energy: 1.3520800183157327
Energy: 1.3771243042510704
Energy: 1.3520800183139616
Energy: 1.1588862307779226
Energy: 1.2274537805832666
Energy: 1.1588853295252295
Energy: 1.2274537805558159
Energy: 1.1588862307779226
Energy: 1.2274537805602435
Energy: 1.5784111175510365
Energy: 1.5172928388677749
Energy: 1.5011291433224556
Energy: 1.5172928388562632
Energy: 1.5784111175514794
Energy: 1.5172928388536069
Energy: 1.5782904602097798
Energy: 1.4965330921768796
Energy: 1.5010712489953826
Energy: 1.4965330921821927
Energy: 1.578290460210665
Energy: 1.49653309218175
Energy: 1.1593166021708103
Energy: 1.1132628640748872
Energy: 1.1593166021721384
Energy: 1.1132628640744446
Energy: 1.1593166021708103
Energy: 1.113262864077101
Energy: 1.3670219031743496
Energy: 1.2898805006044822
Energy: 1.3670219031761206
Energy: 1.2898805006044822
Energy: 1.367021903173907
Energy: 1.2898805006071388
Energy: 1.1914517692949251
Energy: 1.4494955518504142
Energy: 1.1914517692966962
Energy: 1.4497903035272273
Energy: 1.1914517692949251
Energy: 1.4493504623458822
Energy: 1.368691122110744
Energy: 1.164684301635426
Energy: 1.3686911221080873
Energy: 1.164684301635426
Energy: 1.3686911221120723
Energy: 1.1646843016407389
Energy: 1.1476826648411445
Energy: 1.3411103471852421
Energy: 1.1476826648442437
Energy: 1.3411103471835113
Energy: 1.1476826648411445
Energy: 1.3411103471918833
Energy: 1.5247302549282846
Energy: 1.4899276070738716
Energy: 1.5247302549243
Energy: 1.4899276070738716
Energy: 1.524730254929613
Energy: 1.4899276070796275
Energy: 1.2949978095277364
Energy: 1.3696049037263012
Energy: 1.2949978095317212
Energy: 1.3696049037254154
Energy: 1.2949978095264083
Energy: 1.3696049037316138
Energy: 1.297267247512278
Energy: 1.1632663573060351
Energy: 1.2972672475131637
Energy: 1.1632663573055924
Energy: 1.2972672475136062
Energy: 1.1632663573104627
Energy: 1.5057869686224408
Energy: 1.6021085989625576
Energy: 1.5057869686224408
Energy: 1.6021085989625576
Energy: 1.5057869686224408
Energy: 1.6021085989647716
Energy: 1.1586393854546837
Energy: 1.3692750031011969
Energy: 1.15863971960722
Energy: 1.369275003098983
Energy: 1.1586393854551265
Energy: 1.3692750030985406
Energy: 1.3102432620053743
Energy: 1.311366653386876
Energy: 1.3102432620036033
Energy: 1.311366653385548
Energy: 1.310243262005817
Energy: 1.3113666533926316
Energy: 1.4950972100038022
Energy: 1.5325411278101055
Energy: 1.4950972100029167
Energy: 1.5325411278136476
Energy: 1.4950972100033597
Energy: 1.5325411278065635
Energy: 1.5204994613839553
Energy: 1.0869422570845049
Energy: 1.5204994613848408
Energy: 1.0869422570845049
Energy: 1.5204994613852836
Energy: 1.0869422570831766
Energy: 1.1741861808911633
Energy: 1.1041867263141576
Energy: 1.1741861808916063
Energy: 1.1041867263137148
Energy: 1.1741861808911633
Energy: 1.1041867263221272

minimum gb energy = 1.085895344438055 eV
minimum distance =  2.38926824720489 Angstroms
sigma value = 51


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

Energy: 1.3013624430068893
Energy: 1.3353132103954592
Energy: 1.3013624430068893
Energy: 1.3353132103964849
Energy: 1.3013624430058635
Energy: 1.3353132103975107
Energy: 1.3890672608094083
Energy: 1.2137500622876254
Energy: 1.389067260810434
Energy: 1.2137500622886512
Energy: 1.38906726081146
Energy: 1.213750062290703
Energy: 1.2084229895897434
Energy: 1.2607470188728376
Energy: 1.2084229895876917
Energy: 1.2607470188718115
Energy: 1.2084229895866658
Energy: 1.2607470188728376
Energy: 1.3376878803759318
Energy: 1.114601456173122
Energy: 1.3376878803759318
Energy: 1.1146014561721427
Energy: 1.3376878803759318
Energy: 1.114601456173122
Energy: 1.3513921107084803
Energy: 1.3009890436056686
Energy: 1.351392110710532
Energy: 1.3009890436015654
Energy: 1.3513921107095064
Energy: 1.3009890436015654
Energy: 1.150010438165733
Energy: 1.2991401948074162
Energy: 1.1500104381667589
Energy: 1.299140194802287
Energy: 1.150010438167785
Energy: 1.2991401947951524
Energy: 1.2332935788689747
Energy: 1.3043638897117849
Energy: 1.2332935788700008
Energy: 1.3043638897128107
Energy: 1.2332935788689747
Energy: 1.3043638897117849
Energy: 1.2177186806797007
Energy: 1.3015647849616165
Energy: 1.2177186806817522
Energy: 1.301564784966746
Energy: 1.2177186806797007
Energy: 1.301564784966746
Energy: 1.5439844283486017
Energy: 1.1104010332985363
Energy: 1.5439844283496278
Energy: 1.1104010332985363
Energy: 1.5439844283516793
Energy: 1.1104010332985363
Energy: 1.1139483050005938
Energy: 1.4556446318229492
Energy: 1.1139483050005938
Energy: 1.4556446318208973
Energy: 1.1139483050005938
Energy: 1.4556446318250007
Energy: 1.2897775296862213
Energy: 1.1275269799163121
Energy: 1.2897775296903247
Energy: 1.1275269799163121
Energy: 1.2897775296862213
Energy: 1.1275269799173382
Energy: 1.3043579955696396
Energy: 1.3376470004057524
Energy: 1.3043579955696396
Energy: 1.33764700040883
Energy: 1.3043579955696396
Energy: 1.3376470004057524
Energy: 1.3938725200677118
Energy: 1.214709111441841
Energy: 1.3938725200636086
Energy: 1.2147091114428668
Energy: 1.3938725200605309
Energy: 1.214709111441841
Energy: 1.313368413337479
Energy: 1.2070952734104232
Energy: 1.3133684133323495
Energy: 1.2070952734135008
Energy: 1.313368413330298
Energy: 1.2070952734114488
Energy: 1.3322194596837427
Energy: 1.3182199501675271
Energy: 1.3322194596837427
Energy: 1.318219950168553
Energy: 1.3322194596837427
Energy: 1.3182199501675271
Energy: 1.349264034946419
Energy: 1.299051627309818
Energy: 1.349264034947445
Energy: 1.299051627309818
Energy: 1.3492640349453933
Energy: 1.299051627309818
Energy: 1.4178132828252537
Energy: 1.288327869776447
Energy: 1.4178132828252537
Energy: 1.288327869783628
Energy: 1.4178132828252537
Energy: 1.2883278697754212
Energy: 1.281978219880485
Energy: 1.3022806903073114
Energy: 1.2819782198856142
Energy: 1.3022806903073114
Energy: 1.2819782198856142
Energy: 1.3022806903073114

minimum gb energy = 1.1104010332985363 eV
minimum distance =  2.30883486967332 Angstroms
sigma value = 19


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

Energy: 0.9505788199505991
Energy: 1.0258061020971225
Energy: 0.9505788199505991
Energy: 1.0258061020977312
Energy: 0.9505788199505991
Energy: 1.025806102095297
Energy: 1.0626205434491216
Energy: 1.338955131445252
Energy: 1.0626205434491216
Energy: 1.3389551314507286
Energy: 1.0626205434479048
Energy: 1.3389551314476862
Energy: 0.9724074035367717
Energy: 1.334334369940407
Energy: 0.9724074035361631
Energy: 1.3343343699446666
Energy: 0.9724074035361631
Energy: 1.3343343699422325
Energy: 0.975502773726894
Energy: 0.9722919506075305
Energy: 0.9755027737250683
Energy: 0.9722919506081391
Energy: 0.9755027737256771
Energy: 0.9722919506075305
Energy: 0.9652994485615968
Energy: 0.9436505896265882
Energy: 0.9652994485603797
Energy: 0.9436505896271968
Energy: 0.9652994485615968
Energy: 0.9436505896265882
Energy: 0.9653221611756576
Energy: 0.9439365481147223
Energy: 0.9653221611762659
Energy: 0.9439365481153306
Energy: 0.9653221611744405
Energy: 0.9439365481153306
Energy: 0.9753148721408034
Energy: 0.9722494606088605
Energy: 0.9753148721432373
Energy: 0.9722494606094692
Energy: 0.9753148721408034
Energy: 0.9722494606094692
Energy: 0.9724112274494263
Energy: 1.3341875749963377
Energy: 0.9724112274500348
Energy: 1.3341875749829506
Energy: 0.9724112274494263
Energy: 1.3341875749987715
Energy: 1.0626037351329458
Energy: 1.3393715732838565
Energy: 1.062603735132337
Energy: 1.3393715732777718
Energy: 1.0626037351335542
Energy: 1.339371573280814
Energy: 0.9505788199505991
Energy: 1.0258061020959055
Energy: 0.9505788199505991
Energy: 1.0258061020959055
Energy: 0.9505788199505991
Energy: 1.025806102096514
Energy: 1.062620543448513
Energy: 1.3389551314495114
Energy: 1.0626205434491216
Energy: 1.338955131451337
Energy: 1.0626205434479048
Energy: 1.3389551314476862
Energy: 0.9724074035361631
Energy: 1.3343343699446666
Energy: 0.9724074035355545
Energy: 1.3343343699458836
Energy: 0.9724074035355545
Energy: 1.3343343699428412
Energy: 0.9755027737250683
Energy: 0.9722919506069222
Energy: 0.9755027737262854
Energy: 0.9722919506075305
Energy: 0.9755027737256771
Energy: 0.9722919506075305
Energy: 0.9652994485615968
Energy: 0.9436505896284139
Energy: 0.9652994485603797
Energy: 0.9436505896308203
Energy: 0.9652994485609883
Energy: 0.9436505896271968
Energy: 0.965322161175049
Energy: 0.9439365481141135
Energy: 0.9653221611762659
Energy: 0.9439365481128966
Energy: 0.9653221611768746
Energy: 0.9439365481135052
Energy: 0.9753148721414117
Energy: 0.9722494606094692
Energy: 0.9753148721438458
Energy: 0.9722494606100774
Energy: 0.9753148721395861
Energy: 0.9722494606094692
Energy: 0.9724112274488177
Energy: 1.3341875749890357
Energy: 0.9724112274506432
Energy: 1.33418757498721
Energy: 0.9724112274512519
Energy: 1.3341875749853847
Energy: 1.0626037351341628
Energy: 1.339371573292984
Energy: 1.0626037351335542
Energy: 1.3393715732868992
Energy: 1.0626037351335542
Energy: 1.339371573288116
Energy: 0.9505788199505991
Energy: 1.0258061020977312
Energy: 0.9505788199512076
Energy: 1.0258061020959055
Energy: 0.9505788199512076
Energy: 1.025806102096514
Energy: 1.0626205434479048
Energy: 1.338955131452554
Energy: 1.0626205434491216
Energy: 1.3389551314562051
Energy: 1.0626205434479048
Energy: 1.3389551314537709
Energy: 0.9724074035355545
Energy: 1.334334369940407
Energy: 0.9724074035361631
Energy: 1.3343343699416241
Energy: 0.9724074035361631
Energy: 1.3343343699446666
Energy: 0.9755027737250683
Energy: 0.9722919506069222
Energy: 0.9755027737250683
Energy: 0.9722919506075305
Energy: 0.97550277372446
Energy: 0.9722919506075305
Energy: 0.9652994485603797
Energy: 0.9436505896320372
Energy: 0.9652994485603797
Energy: 0.9436505896296309
Energy: 0.9652994485597713
Energy: 0.9436505896296309
Energy: 0.9653221611756576
Energy: 0.9439365481159392
Energy: 0.9653221611762659
Energy: 0.9439365481147223
Energy: 0.965322161173832
Energy: 0.9439365481141135
Energy: 0.9753148721426287
Energy: 0.9722494606094692
Energy: 0.9753148721420203
Energy: 0.9722494606094692
Energy: 0.9753148721377608
Energy: 0.9722494606094692
Energy: 0.9724112274494263
Energy: 1.334187574988427
Energy: 0.9724112274500348
Energy: 1.3341875749951206
Energy: 0.9724112274494263
Energy: 1.3341875749811252
Energy: 1.0626037351329458
Energy: 1.3393715732923754
Energy: 1.0626037351335542
Energy: 1.3393715732868992
Energy: 1.0626037351335542
Energy: 1.3393715732887246
Energy: 0.9505788199505991
Energy: 1.0258061020959055
Energy: 0.9505788199512076
Energy: 1.0258061020977312
Energy: 0.9505788199512076
Energy: 1.0258061020959055
Energy: 1.0626205434491216
Energy: 1.3389551314549881
Energy: 1.0626205434491216
Energy: 1.338955131458639
Energy: 1.0626205434491216
Energy: 1.3389551314537709
Energy: 0.9724074035361631
Energy: 1.3343343699428412
Energy: 0.9724074035355545
Energy: 1.3343343699483177
Energy: 0.9724074035355545
Energy: 1.3343343699458836

minimum gb energy = 0.9436505896265882 eV
minimum distance =  2.30553634821347 Angstroms
sigma value = 27


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

Energy: 0.9223878121197472
Energy: 0.9322933989323245
Energy: 0.9223878121197472
Energy: 0.9322933989323245
Energy: 0.9223878121197472
Energy: 0.9322933989323245
Energy: 1.1334444399280965
Energy: 0.9603656670549432
Energy: 1.1334444398595664
Energy: 0.9603656670549432
Energy: 1.1334444399161725
Energy: 0.9603656670549432
Energy: 1.023358328583857
Energy: 1.0151880161933025
Energy: 1.023358328583857
Energy: 1.0151880161888307
Energy: 1.023358328583857
Energy: 1.0151880161903213
Energy: 1.1970296863501275
Energy: 0.9176510035600206
Energy: 1.1970296863516179
Energy: 0.9176510035600206
Energy: 1.1970296863501275
Energy: 0.9176510035585302
Energy: 1.1924033912769314
Energy: 0.9115633099940663
Energy: 1.192403391273984
Energy: 0.9115633099940663
Energy: 1.192403391273984
Energy: 0.9115633099940663
Energy: 1.2378167130418447
Energy: 1.2301877489937525
Energy: 1.2378167130418447
Energy: 1.2301877489937525
Energy: 1.2378167130388635
Energy: 1.230187748992262
Energy: 0.9142625113487408
Energy: 0.9629634093862909
Energy: 0.9142625113487408
Energy: 0.9629634093862909
Energy: 0.9142625113502314
Energy: 0.9629634093862909
Energy: 0.9074485164594293
Energy: 0.9350921775862577
Energy: 0.9074485164608858
Energy: 0.9350921775862577
Energy: 0.9074485164608858
Energy: 0.9350921775862577
Energy: 1.1298328512630478
Energy: 1.023885495020963
Energy: 1.1298328512615574
Energy: 1.0238854985921821
Energy: 1.1298328512615574
Energy: 1.0238854917373472
Energy: 1.1189952233406333
Energy: 1.1810017763569332
Energy: 1.1189952233406333
Energy: 1.1810017763614047
Energy: 1.1189952233406333
Energy: 1.1810017763554426
Energy: 0.9333856086513829
Energy: 0.9121623932553206
Energy: 0.9333856086528733
Energy: 0.9121623932553206
Energy: 0.9333856086513829
Energy: 0.9121623932553206
Energy: 1.276709704404113
Energy: 1.1320805511625338
Energy: 1.2767097044026223
Energy: 1.1320805511848577
Energy: 1.2767097044026223
Energy: 1.1320805511759147

minimum gb energy = 0.9074485164594293 eV
minimum distance =  2.35745065590456 Angstroms
sigma value = 9


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

Energy: 1.042242371928338
Energy: 0.9299243076074014
Energy: 1.0422423719295946
Energy: 0.9299243076078201
Energy: 1.042242371928757
Energy: 0.9299243076078201
Energy: 0.8983354591381763
Energy: 0.935136660390175
Energy: 0.898335459142783
Energy: 0.9351366603914314
Energy: 0.8983354591184927
Energy: 0.9351366603914314
Energy: 0.874396576062268
Energy: 0.9095459108047361
Energy: 0.8743965760631054
Energy: 0.9095459108038986
Energy: 0.8743965760631054
Energy: 0.9095459108059928
Energy: 0.8461713651766458
Energy: 0.8044080724816004
Energy: 0.8461713651774834
Energy: 0.8044080724820193
Energy: 0.8461713651766458
Energy: 0.8044080724816004
Energy: 0.9736143838133406
Energy: 0.9273154820689348
Energy: 0.9736143838129219
Energy: 0.9273154820693537
Energy: 0.9736143838137595
Energy: 0.9273154820647469
Energy: 0.9885373011441972
Energy: 0.9860678909389257
Energy: 0.9885373011433596
Energy: 0.9860678909493577
Energy: 0.9885373011458725
Energy: 0.9860678909489388
Energy: 0.9152504405165569
Energy: 0.9943835163519293
Energy: 0.9152504405132065
Energy: 0.994383516352348
Energy: 0.9152504405169756
Energy: 0.9943835163515105
Energy: 0.7968978491030655
Energy: 0.9420355100966425
Energy: 0.7968978491034844
Energy: 0.9420355100966425
Energy: 0.7968978491034844
Energy: 0.9420355100966425
Energy: 0.9288844678381626
Energy: 0.9291377619258038
Energy: 0.9288844678381626
Energy: 0.9291377619249663
Energy: 0.9288844678377437
Energy: 0.9291377619283165
Energy: 0.980323682280659
Energy: 0.9714518076543482
Energy: 0.9803236822798216
Energy: 0.9714518076551858
Energy: 0.980323682280659
Energy: 0.9714518076547671
Energy: 0.8502519166305403
Energy: 0.7978031465031791
Energy: 0.8502519166301215
Energy: 0.7978031465031791
Energy: 0.850251916631378
Energy: 0.7978031465031791
Energy: 0.9461417289005899
Energy: 0.9926842351768493
Energy: 0.9461417289010087
Energy: 0.9926842351755929
Energy: 0.9461417289022651
Energy: 0.9926842351768493
Energy: 0.9062572473299957
Energy: 0.9938745613661116
Energy: 0.9062572473354401
Energy: 0.9938745613711372
Energy: 0.9062572473283206
Energy: 0.9938745613711372
Energy: 1.051116944328697
Energy: 0.9793287886131002
Energy: 1.0511169443303723
Energy: 0.9793287886151942
Energy: 1.05111694433121
Energy: 0.979328788615613
Energy: 0.8278385927064887
Energy: 0.9574582362791042
Energy: 0.8278385927073262
Energy: 0.9574582362778478
Energy: 0.8278385927056509
Energy: 0.9574582362786854
Energy: 0.8669503342823257
Energy: 0.9820068151150163
Energy: 0.866950334281945
Energy: 0.9820068151192043
Energy: 0.8669503342823257
Energy: 0.982006815120042
Energy: 1.2648153680817502
Energy: 0.7887870912533997
Energy: 1.264815368082588
Energy: 0.7887870912538186
Energy: 1.2648153680821692
Energy: 0.7887870912538186
Energy: 0.8415758205507138
Energy: 0.9263188915093324
Energy: 0.8415758205490386
Energy: 0.9263188915105888
Energy: 0.8415758205494572
Energy: 0.9263188915097511
Energy: 0.8015697345224011
Energy: 1.243246317358228
Energy: 0.80156973452282
Energy: 1.2432463173573904
Energy: 0.8015697345236575
Energy: 1.2432463173594845
Energy: 1.0243113497359595
Energy: 0.9468300285304647
Energy: 1.0243113497439167
Energy: 0.9468300285308834
Energy: 1.0243113497418228
Energy: 0.9468300285308834
Energy: 0.8027895262119435
Energy: 1.2409817175365343
Energy: 0.8027895262111059
Energy: 1.240981717543654
Energy: 0.8027895262123623
Energy: 1.2409817175482607
Energy: 0.8416721087652221
Energy: 0.9262616024865737
Energy: 0.841672108765641
Energy: 0.9262616024857361
Energy: 0.8416721087643847
Energy: 0.926261602486155
Energy: 1.2648750047581785
Energy: 0.7892616057112027
Energy: 1.2648750047573407
Energy: 0.7892616057107839
Energy: 1.2648750047581785
Energy: 0.7892616057112027
Energy: 0.8667307058283213
Energy: 0.9347608318541609
Energy: 0.8667307058291589
Energy: 0.9347608318545796
Energy: 0.8667307058299966
Energy: 0.934760831853742
Energy: 0.8277829151320363
Energy: 0.9579869468837156
Energy: 0.8277829151316174
Energy: 0.9579869468832967
Energy: 0.8277829151311985
Energy: 0.9579869468837156
Energy: 1.052349384019465
Energy: 0.9783899310320212
Energy: 1.0523493840253282
Energy: 0.9783899310324401
Energy: 1.052349384019465
Energy: 0.9783899310324401
Energy: 0.9064219540872437
Energy: 0.9938666806423656
Energy: 0.9064219540834746
Energy: 0.9938666806411093
Energy: 0.9064219540847309
Energy: 0.9938666806398527
Energy: 0.9462160625318805
Energy: 0.8233608279990762
Energy: 0.946216062533137
Energy: 0.8233608279978196
Energy: 0.9462160625327181
Energy: 0.8233608279982385
Energy: 0.8523143059678014
Energy: 0.7977643333912947
Energy: 0.8523143059652887
Energy: 0.7977643333912947
Energy: 0.8523143059673828
Energy: 0.7977643333912947
Energy: 0.9804534961353708
Energy: 0.7720550612953104
Energy: 0.9804534961336956
Energy: 0.7720550612957291
Energy: 0.9804534961353708
Energy: 0.7720550612953104
Energy: 0.9286766990600882
Energy: 0.928751590124252
Energy: 0.9286766990613448
Energy: 0.9287515901246709
Energy: 0.9286766990600882
Energy: 0.928751590124252
Energy: 0.7972594224819438
Energy: 0.9420412816289899
Energy: 0.7972594224811062
Energy: 0.9420412816289899
Energy: 0.797259422481525
Energy: 0.9420412816281524
Energy: 0.9151105095227853
Energy: 0.9947249965600151
Energy: 0.9151105095479132
Energy: 0.9947249965600151
Energy: 0.9151105095370244
Energy: 0.9947249965604338
Energy: 0.9887612477124045
Energy: 0.8645561707245005
Energy: 0.9887612477115668
Energy: 0.8645561707232442
Energy: 0.9887612477086352
Energy: 0.8645561707219879
Energy: 0.9737361970042757
Energy: 0.9278114645049267
Energy: 0.9737361970055323
Energy: 0.9278114645049267
Energy: 0.9737361970051134
Energy: 0.9278114645053456
Energy: 0.8463520327676328
Energy: 0.8024709360074351
Energy: 0.8463520327676328
Energy: 0.8024709360074351
Energy: 0.846352032769308
Energy: 0.8024709360082728
Energy: 0.8745805338551084
Energy: 0.9105161593226537
Energy: 0.8745805338559458
Energy: 0.9105161593213973
Energy: 0.8745805338538519
Energy: 0.9105161593239103
Energy: 0.8977755770936754
Energy: 0.9029936808582782
Energy: 0.8977755770894874
Energy: 0.9029936808582782
Energy: 0.8977755770827867
Energy: 0.9029936808582782
Energy: 1.0422423719295946
Energy: 0.9299243076102949
Energy: 1.0422423719304321
Energy: 0.9299243076102949
Energy: 1.0422423719291758
Energy: 0.9299243076090384
Energy: 0.8983354591921634
Energy: 0.86840440246824
Energy: 0.8983354591574412
Energy: 0.86840440246824
Energy: 0.8983354591758302
Energy: 0.8684044024678211
Energy: 0.874396576063943
Energy: 0.9095459108135311
Energy: 0.8743965760647807
Energy: 0.9095459108076679
Energy: 0.874396576063943
Energy: 0.9095459108064113
Energy: 0.8461713651758082
Energy: 0.8044080724799254
Energy: 0.8461713651745518
Energy: 0.8044080724795065
Energy: 0.8461713651758082
Energy: 0.804408072480344
Energy: 0.9736143838099902
Energy: 0.9273154820718664
Energy: 0.9736143838091528
Energy: 0.9273154820714475
Energy: 0.9736143838104091
Energy: 0.9273154820710289

minimum gb energy = 0.7720550612953104 eV
minimum distance =  2.37178462994864 Angstroms
sigma value = 57


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

Energy: 0.4635830694658434
Energy: 0.47207118605546095
Energy: 0.4635830694667967
Energy: 0.47207118605546095
Energy: 0.4635830694658434
Energy: 0.4720711860564143
Energy: 0.41724476689308915
Energy: 0.46535416526101187
Energy: 0.4172447668988091
Energy: 0.46535416526101187
Energy: 0.4172447668911824
Energy: 0.46535416526959195
Energy: 0.45456041976876416
Energy: 0.47534202748124665
Energy: 0.45456041976876416
Energy: 0.47534202748124665
Energy: 0.4545604197697175
Energy: 0.47534202747838655
Energy: 0.4753075680812398
Energy: 0.47196396186226935
Energy: 0.47530756808028646
Energy: 0.47196396186226935
Energy: 0.47530756808028646
Energy: 0.47196396186322265
Energy: 0.4182209718424926
Energy: 0.4201359540742421
Energy: 0.4182209718424926
Energy: 0.4201359540742421
Energy: 0.4182209718424926
Energy: 0.4201359540742421
Energy: 0.4645602675498451
Energy: 0.45294122082156163
Energy: 0.4645602675498451
Energy: 0.45294122082156163
Energy: 0.46456026754793844
Energy: 0.45294122082156163
Energy: 0.4645398001841886
Energy: 0.45295343498596774
Energy: 0.4645398001841886
Energy: 0.45295343498596774
Energy: 0.4645398001851419
Energy: 0.45295343498501445
Energy: 0.41823448093877374
Energy: 0.42037220430222255
Energy: 0.418234480936867
Energy: 0.42037220430222255
Energy: 0.4182344809378203
Energy: 0.4203722043031759
Energy: 0.47529771108303515
Energy: 0.4718436324903783
Energy: 0.47529771108398844
Energy: 0.4718436324903783
Energy: 0.47529771108398844
Energy: 0.4718436324903783
Energy: 0.4545168146685167
Energy: 0.4750956545151829
Energy: 0.4545168146685167
Energy: 0.4750956545142296
Energy: 0.45451681466947
Energy: 0.4750956545151829
Energy: 0.417595765224512
Energy: 0.5880014928306504
Energy: 0.4175957652254654
Energy: 0.5880014928335103
Energy: 0.417595765224512
Energy: 0.5880014928401838
Energy: 0.4635830694658434
Energy: 0.47207118605546095
Energy: 0.4635830694667967
Energy: 0.4720711860564143
Energy: 0.4635830694667967
Energy: 0.47207118605546095
Energy: 0.41724476689308915
Energy: 0.46535416525910517
Energy: 0.41724476689404244
Energy: 0.46535416526482526
Energy: 0.41724476689308915
Energy: 0.4653541652581518
Energy: 0.45456041976876416
Energy: 0.47534202748124665
Energy: 0.4545604197697175
Energy: 0.47534202747743326
Energy: 0.45456041976876416
Energy: 0.4753420274745732
Energy: 0.4753075680812398
Energy: 0.471963961861316
Energy: 0.4753075680812398
Energy: 0.4719639618603626
Energy: 0.47530756808028646
Energy: 0.4719639618603626
Energy: 0.4182209718424926
Energy: 0.4201359540742421
Energy: 0.4182209718424926
Energy: 0.4201359540732888
Energy: 0.4182209718424926
Energy: 0.4201359540742421
Energy: 0.46456026754793844
Energy: 0.45294122082156163
Energy: 0.4645602675488918
Energy: 0.45294122082156163
Energy: 0.46456026754793844
Energy: 0.45294122082156163
Energy: 0.4645398001841886
Energy: 0.45295343498501445
Energy: 0.4645398001851419
Energy: 0.45295343498596774
Energy: 0.4645398001851419
Energy: 0.45295343498501445
Energy: 0.4182344809378203
Energy: 0.4203722043031759
Energy: 0.4182344809378203
Energy: 0.42037220430222255
Energy: 0.4182344809378203
Energy: 0.42037220430222255

minimum gb energy = 0.4172447668911824 eV
minimum distance =  2.40111379076051 Angstroms
sigma value = 11


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

Energy: 0.68829553843513
Energy: 0.982473048393086
Energy: 0.6882955384365268
Energy: 0.982473048393086
Energy: 0.6882955384344317
Energy: 0.982473048393086
Energy: 0.9621842153055129
Energy: 0.8483409138315059
Energy: 0.9621842153062113
Energy: 0.8483409138336009
Energy: 0.9621842153055129
Energy: 0.8483409138322043
Energy: 1.058369547348339
Energy: 1.0683692576533645
Energy: 1.0583695473469423
Energy: 1.068369257654063
Energy: 1.0583695473469423
Energy: 1.068369257651968
Energy: 0.910104557478045
Energy: 0.682611048567075
Energy: 0.9101045574773468
Energy: 0.6826110485663767
Energy: 0.91010455748014
Energy: 0.68261104856498
Energy: 0.9744702485711315
Energy: 0.6594215695897702
Energy: 0.9744702485711315
Energy: 0.6594215695897702
Energy: 0.97447024857183
Energy: 0.6594215695904685
Energy: 0.872104906709931
Energy: 0.7159332348802995
Energy: 0.8721049067092328
Energy: 0.715933234875411
Energy: 0.8721049067113277
Energy: 0.7159332348823945
Energy: 0.6586184402884371
Energy: 0.7084090263988733
Energy: 0.658618440290532
Energy: 0.7084090263967783
Energy: 0.6586184402891354
Energy: 0.7084090263925883
Energy: 1.0235713205839232
Energy: 0.6397552329422717
Energy: 1.0235713205839232
Energy: 0.6397552329415732
Energy: 1.0235713205825265
Energy: 0.6397552329415732
Energy: 1.0230774065999055
Energy: 0.6416137848528435
Energy: 1.0230774065992072
Energy: 0.6416137848528435
Energy: 1.0230774065999055
Energy: 0.6416137848542403
Energy: 0.632101518641166
Energy: 1.2085306200394157
Energy: 0.6321015186404676
Energy: 1.2085306200394157
Energy: 0.6321015186404676
Energy: 1.2085306200394157
Energy: 0.8922866237450784
Energy: 0.9450085977135916
Energy: 0.892286623753395
Energy: 0.94500859771429
Energy: 0.8922866237415865
Energy: 0.94500859771429
Energy: 0.9738836663136028
Energy: 0.6559360483976692
Energy: 0.9738836663149995
Energy: 0.6559360483997642
Energy: 0.9738836663129045
Energy: 0.6559360483990657
Energy: 1.0520110064975703
Energy: 0.6853101888702687
Energy: 1.0520110064982684
Energy: 0.685310188870967
Energy: 1.052011006496872
Energy: 0.6853101888688721
Energy: 1.0460047018069096
Energy: 1.0692222066111612
Energy: 1.0460047018062113
Energy: 1.0692222066104626
Energy: 1.046004701805513
Energy: 1.069222206609066
Energy: 0.9633004372682696
Energy: 0.7203683428262199
Energy: 0.9633004372738563
Energy: 0.7203683428248232
Energy: 0.9633004372752529
Energy: 0.7203683428290132
Energy: 0.6827074724390623
Energy: 0.8416843439263527
Energy: 0.6827074724397606
Energy: 0.8416843439319394
Energy: 0.6827074724397606
Energy: 0.8416843439270509
Energy: 0.8530507218455584
Energy: 0.8482982385221228
Energy: 0.8530507218434634
Energy: 0.8482982385214245
Energy: 0.8530507218441619
Energy: 0.8482982385284079
Energy: 1.2210913645751826
Energy: 0.7313935323052423
Energy: 1.221091364573786
Energy: 0.7313935316176943
Energy: 1.2210913645723893
Energy: 0.7313935299256787
Energy: 0.8902632464041909
Energy: 0.6796354471109491
Energy: 0.8902632464083811
Energy: 0.6796354471109491
Energy: 0.8902632464006992
Energy: 0.6796354471109491
Energy: 0.974485757844781
Energy: 0.857920465667772
Energy: 0.9744857578454793
Energy: 0.857920465667772
Energy: 0.9744857578454793
Energy: 0.857920465667772
Energy: 0.6324876296291941
Energy: 0.9629997424818129
Energy: 0.6324876296305908
Energy: 0.9629997424853046
Energy: 0.6324876296312891
Energy: 0.9629997424832095
Energy: 0.6860561212359566
Energy: 0.70629364409207
Energy: 0.6860561212380517
Energy: 0.7062936440976567
Energy: 0.6860561212359566
Energy: 0.7062936441130202
Energy: 0.8444877999478833
Energy: 0.8708221778084011
Energy: 0.8444877999520732
Energy: 0.8708221778090994
Energy: 0.8444877999499782
Energy: 0.8708221778090994
Energy: 1.0246942945070365
Energy: 0.8094695608255169
Energy: 1.024694294506338
Energy: 0.8094695608262154
Energy: 1.0246942945070365
Energy: 0.8094695608248187
Energy: 0.6332674310612387
Energy: 1.2159705683790827
Energy: 0.6332674310612387
Energy: 1.2159705683755913
Energy: 0.6332674310605404
Energy: 1.2159705683762896
Energy: 1.4042181040364956
Energy: 0.9467011010365933
Energy: 1.404218104037892
Energy: 0.9467011010393868
Energy: 1.4042181040385906
Energy: 0.9467011010379901

minimum gb energy = 0.6321015186404676 eV
minimum distance =  2.36681715439136 Angstroms
sigma value = 41


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

Energy: 0.8897686808024176
Energy: 0.7841870693414561
Energy: 0.7789179247023683
Energy: 0.7841870693436578
Energy: 0.8897686807985647
Energy: 0.7841870693442081
Energy: 0.8528397920557271
Energy: 1.0813921691356965
Energy: 0.8528397920546262
Energy: 1.0813921691345958
Energy: 0.8528397920540759
Energy: 1.0813921691345958
Energy: 1.0357819604363303
Energy: 0.8209603336975825
Energy: 1.0357819604346792
Energy: 0.8209603336959312
Energy: 1.0357819604363303
Energy: 0.8209603336959312
Energy: 0.7474962568868045
Energy: 0.7769516781603717
Energy: 0.7474962568851534
Energy: 0.7769516781537666
Energy: 0.7474962568818508
Energy: 0.7769516781526657
Energy: 0.7994733007369581
Energy: 0.812687474190576
Energy: 0.7999829535278715
Energy: 0.8126874741867232
Energy: 0.7994733007358574
Energy: 0.8126874741872736
Energy: 0.8915928920347538
Energy: 0.8997790200994691
Energy: 0.8915928920331027
Energy: 0.8997790201033219
Energy: 0.8915928920375059
Energy: 0.8997790201033219
Energy: 0.8031210097826403
Energy: 0.7409988960107701
Energy: 0.803121009784842
Energy: 0.7409988960129716
Energy: 0.8031210097886948
Energy: 0.7409988960118707
Energy: 0.8980388895539196
Energy: 0.7770248888380834
Energy: 0.8983887259222614
Energy: 0.77702488883368
Energy: 0.8980388895522685
Energy: 0.77702488883368
Energy: 0.7267830150702435
Energy: 0.8030069885950519
Energy: 0.7267830150713442
Energy: 0.8030069885945014
Energy: 0.7267830150691427
Energy: 0.8030069885956024
Energy: 0.7405109614556881
Energy: 0.9736144852410834
Energy: 0.7405109614540368
Energy: 0.9736144852432851
Energy: 0.7405109614540368
Energy: 0.9736144852454867
Energy: 0.7345722332362966
Energy: 0.9880785884079749
Energy: 0.7345722332401495
Energy: 0.9880785884068739
Energy: 0.7345722332401495
Energy: 0.9880785884068739
Energy: 0.7818569180879611
Energy: 1.0131788388831924
Energy: 0.7818569180896122
Energy: 1.0131788388760372
Energy: 0.7818569180874106
Energy: 1.0131788388749363
Energy: 0.7919914313897177
Energy: 0.7695575264905746
Energy: 0.7919914313913688
Energy: 0.7695575264905746
Energy: 0.7919914313908184
Energy: 0.7695575264900241
Energy: 0.7768833447816818
Energy: 0.8451753794289114
Energy: 0.7768415837410697
Energy: 0.8451753794283611
Energy: 0.7768833447838834
Energy: 0.8451753794278107
Energy: 0.7350757488244375
Energy: 1.3192941390453534
Energy: 0.7350757488260887
Energy: 1.3192941390442527
Energy: 0.7350757488310424
Energy: 1.3192941390442527
Energy: 0.7749447434758423
Energy: 0.7252436848405395
Energy: 0.774944743478044
Energy: 0.7252436848300817
Energy: 0.7749447434747414
Energy: 0.7252436848443924
Energy: 0.920196431335444
Energy: 0.7685920753665776
Energy: 0.9192834001327461
Energy: 0.7685920753654768
Energy: 0.9201964313332425
Energy: 0.7685920753654768
Energy: 1.2481423364399071
Energy: 0.82217328644744
Energy: 1.2477925599902677
Energy: 0.8221732864534945
Energy: 1.2481423364415585
Energy: 0.8221732864529441
Energy: 0.7543344121096487
Energy: 1.3169363633456288
Energy: 0.7543344121107495
Energy: 1.3169363633423263
Energy: 0.7543344121085478
Energy: 1.3169363633417759
Energy: 0.8449122175900037
Energy: 0.8183215406626828
Energy: 0.733427425298842
Energy: 0.8183215406643342
Energy: 0.8449122175883523
Energy: 0.8183215406637838
Energy: 0.7963081752092593
Energy: 0.980199771288335
Energy: 0.796308175211461
Energy: 0.980199771288335
Energy: 0.7963081752152638
Energy: 0.980199771288335
Energy: 1.0367308820084855
Energy: 0.9698339773154233
Energy: 1.0367308820051833
Energy: 0.9698339773121208
Energy: 1.0367308820062842
Energy: 0.9698339773115705
Energy: 0.7483379180006454
Energy: 0.7705739721473219
Energy: 0.7483379179978934
Energy: 0.7705739721473219
Energy: 0.7483379180006454
Energy: 0.7705739721478723
Energy: 0.7753677352741822
Energy: 0.857837673147879
Energy: 0.7755282264178915
Energy: 0.8578376731544839
Energy: 0.775367735275283
Energy: 0.8578376731522822
Energy: 0.7832975269926842
Energy: 1.0949978418907433
Energy: 0.7832975269888313
Energy: 1.094997841883588
Energy: 0.7832975269866296
Energy: 1.0949978418852393
Energy: 0.8025996300207513
Energy: 0.7852295794265822
Energy: 0.8025996300251547
Energy: 0.7852295794243807
Energy: 0.8025996300224026
Energy: 0.7852295794254814
Energy: 0.8931468751078677
Energy: 0.7705482200335054
Energy: 0.8932636783141988
Energy: 0.770548220032955
Energy: 0.8931468751078677
Energy: 0.770548220032955
Energy: 0.714739876876522
Energy: 0.8483404023593322
Energy: 0.714739876876522
Energy: 0.8483404023560298
Energy: 0.7147398768754211
Energy: 0.8483404023543786
Energy: 0.73516197632084
Energy: 1.2432984550567225
Energy: 0.7351619763241426
Energy: 1.243298455057823
Energy: 0.7351619763252434
Energy: 1.243298455057823
Energy: 0.8849411215802276
Energy: 0.7622525515676751
Energy: 0.8849411215829797
Energy: 0.7622525515649231
Energy: 0.8849411215802276
Energy: 0.7622525515649231
Energy: 0.7884681129039821
Energy: 1.010197768893699
Energy: 0.7884681128979275
Energy: 1.0101977688947996
Energy: 0.7884681128962763
Energy: 1.0101977688947996
Energy: 0.8148077100811018
Energy: 0.7954651578171372
Energy: 0.8148077100794505
Energy: 0.7954651578099818
Energy: 0.8148077100777994
Energy: 0.795465157808881
Energy: 0.7828680673931032
Energy: 0.9616623450559288
Energy: 0.7828740484684669
Energy: 0.9616623450493239
Energy: 0.7828680673931032
Energy: 0.9616623450493239

minimum gb energy = 0.7147398768754211 eV
minimum distance =  2.37257486476797 Angstroms
sigma value = 33


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

Energy: 0.761199093669247
Energy: 0.7488213758702256
Energy: 0.7611990936696684
Energy: 0.7488213758759846
Energy: 0.7611990936681232
Energy: 0.7488213758663627
Energy: 0.8659737631844145
Energy: 0.768833843865039
Energy: 0.8659737631836417
Energy: 0.7688338438646175
Energy: 0.8659737631840633
Energy: 0.7688338438646175
Energy: 0.7941705323299605
Energy: 0.8380813753807409
Energy: 0.79417053232378
Energy: 0.8380813753784232
Energy: 0.794170532327994
Energy: 0.8380813753780018
Energy: 0.8537265944021869
Energy: 0.7413770504384153
Energy: 0.8537265943917924
Energy: 0.7413770504376427
Energy: 0.8537265943941101
Energy: 0.7413770504357464
Energy: 0.7551244376480545
Energy: 0.8596151706943284
Energy: 0.7551244376526898
Energy: 0.8596151706951007
Energy: 0.7551244376480545
Energy: 0.8596151706989638
Energy: 1.2740708471868836
Energy: 0.7679230217748887
Energy: 1.2740708471868836
Energy: 0.7679230217748887
Energy: 1.27407084718885
Energy: 0.7679230217745376
Energy: 0.788889972528799
Energy: 0.8277650615779553
Energy: 0.7888899725291502
Energy: 0.8277650615767612
Energy: 0.788889972528799
Energy: 0.8277650615795006
Energy: 0.7922814181427077
Energy: 0.844725246303482
Energy: 0.7922814181504334
Energy: 0.8447252463015156
Energy: 0.7922814181423565
Energy: 0.8447252463027096
Energy: 0.8960995063245031
Energy: 0.7797815512028474
Energy: 0.8960995063209913
Energy: 0.7797815512070615
Energy: 0.8960995063310347
Energy: 0.7797815512059378
Energy: 1.2800509194545915
Energy: 0.791375439363678
Energy: 1.2800509194549428
Energy: 0.791375439363327
Energy: 1.2800509194549428
Energy: 0.7913754393640994
Energy: 0.7852753361740559
Energy: 0.78349718533254
Energy: 0.7852753361756011
Energy: 0.7834971853305733
Energy: 0.78527533617827
Energy: 0.78349718533254
Energy: 1.7071558561115239
Energy: 0.7380491057780059
Energy: 1.7071558561115239
Energy: 0.7380491057775844
Energy: 1.7071558561107512
Energy: 0.7380491057787784
Energy: 0.7796762535635464
Energy: 0.898181792243268
Energy: 0.7796762535666367
Energy: 0.8981817922409502
Energy: 0.7796762535654427
Energy: 0.8981817922436893
Energy: 0.8377335145704095
Energy: 0.7892752432134548
Energy: 0.8377335145677406
Energy: 0.7892752432142274
Energy: 0.8377335145677406
Energy: 0.7892752432134548
Energy: 0.8307051373387483
Energy: 0.7880557742090483
Energy: 0.8307051373399422
Energy: 0.7880557742098209
Energy: 0.8307051373418385
Energy: 0.7880557742102423
Energy: 0.7698704548326587
Energy: 1.2750864618436528
Energy: 0.7698704548342039
Energy: 1.2750864618428803
Energy: 0.7698704548342039
Energy: 1.2750864618436528
Energy: 1.303477749919825
Energy: 0.7506462755229772
Energy: 1.303477749922915
Energy: 0.7506462755241011
Energy: 1.3034777499156107
Energy: 0.7506462755236796
Energy: 0.7374208101284084
Energy: 0.7832362818973252
Energy: 0.7374208101279869
Energy: 0.7832362818969739
Energy: 0.7374208101279869
Energy: 0.7832362818969739
Energy: 0.8410116154658428
Energy: 0.7927858466049508
Energy: 0.8410116154689332
Energy: 0.7927858466049508
Energy: 0.8410116154689332
Energy: 0.7927858466045293
Energy: 1.2962531480825152
Energy: 0.7778398364117053
Energy: 1.2962531481141906
Energy: 0.7778398364117053
Energy: 1.2962531481072375
Energy: 0.7778398364105114
Energy: 0.7499495769080565
Energy: 0.7616663448762107
Energy: 0.7499495769096016
Energy: 0.7616663448750869
Energy: 0.7499495769077053
Energy: 0.761666344875438
Energy: 0.7653899201426806
Energy: 0.7998208315330201
Energy: 0.7653899201407142
Energy: 0.7998208315330201
Energy: 0.7653899201422593
Energy: 0.7998208315318264
Energy: 0.8292323203379792
Energy: 0.7557157999842451
Energy: 0.8292323203379792
Energy: 0.7557157999845964
Energy: 0.8292323203368552
Energy: 0.7557157999842451
Energy: 0.7441344300585508
Energy: 0.8435184907603313
Energy: 0.7441344300574271
Energy: 0.8435184907726924
Energy: 0.7441344300577781
Energy: 0.8435184907646155
Energy: 0.8605387846235353
Energy: 0.7510264151642186
Energy: 0.8605387846255017
Energy: 0.7510264151626735
Energy: 0.8605387846273981
Energy: 0.751026415170048
Energy: 0.7629603040494192
Energy: 0.8333394329986977
Energy: 0.7629603040475229
Energy: 0.8333394330195573
Energy: 0.7629603040486468
Energy: 0.8333394329663202
Energy: 0.7968788071098654
Energy: 0.7919209661474321
Energy: 0.7968788071210324
Energy: 0.7919209661466594
Energy: 0.7968788071121831
Energy: 0.7919209661466594
Energy: 0.7544433961758646
Energy: 0.7494838018208742
Energy: 0.7544433961758646
Energy: 0.7494838018204528
Energy: 0.7544433961754433
Energy: 0.7494838018204528
Energy: 0.7813385236508524
Energy: 0.8970960610547114
Energy: 0.7813385236505013
Energy: 0.8970960610558352
Energy: 0.7813385236512738
Energy: 0.8970960610570291
Energy: 0.7875586145735172
Energy: 0.8413965479999225
Energy: 0.7875586145716209
Energy: 0.8413965479875614
Energy: 0.787558614571972
Energy: 0.8413965479794846
Energy: 0.7830756070983718
Energy: 0.7344781246295915
Energy: 0.7830756071003382
Energy: 0.7344781246295915
Energy: 0.783075607097248
Energy: 0.7344781246292403
Energy: 0.7438800052531918
Energy: 1.3057667990195454
Energy: 0.7438800052519977
Energy: 1.305766799020318
Energy: 0.7438800052535429
Energy: 1.3057667990214417
Energy: 1.2935805516691934
Energy: 0.7759901845029107
Energy: 1.2935805516688423
Energy: 0.7759901845024892
Energy: 1.2935805516688423
Energy: 0.7759901845017166
Energy: 0.7853257112116034
Energy: 0.8360566700608487
Energy: 0.7853257112139211
Energy: 0.8360566700597251
Energy: 0.7853257112127975
Energy: 0.8360566700600762
Energy: 0.7863702644444418
Energy: 0.8368620361726826
Energy: 0.7863702644455656
Energy: 0.8368620361719101
Energy: 0.7863702644452143
Energy: 0.8368620361719101
Energy: 1.2944019076678333
Energy: 0.7758036557788721
Energy: 1.2944019076720472
Energy: 0.7758036557776782
Energy: 1.2944019076709234
Energy: 0.7758036557796447
Energy: 0.7491488798334095
Energy: 1.3059773433760102
Energy: 0.7491488798337608
Energy: 1.305977343366037
Energy: 0.7491488798326371
Energy: 1.3059773433733415
Energy: 0.7830620180747215
Energy: 0.7344697132934324
Energy: 0.7830620180758452
Energy: 0.7344697132930109
Energy: 0.7830620180739489
Energy: 0.7344697132930109
Energy: 0.7865762296899379
Energy: 0.8414855787942878
Energy: 0.7865762296902892
Energy: 0.8414855789927675
Energy: 0.7865762296902892
Energy: 0.8414855782734364
Energy: 0.7807950766896721
Energy: 0.8970764966002691
Energy: 0.7807950766900233
Energy: 0.897076496598373
Energy: 0.7807950766900233
Energy: 0.8970764966002691
Energy: 0.7567832132076702
Energy: 0.7492854646913216
Energy: 0.7567832132053524
Energy: 0.7492854646913216
Energy: 0.7567832132084427
Energy: 0.7492854646916729
Energy: 0.7970870806513802
Energy: 0.7922043016013679
Energy: 0.7970870806529253
Energy: 0.7922043016009465
Energy: 0.797087080652504
Energy: 0.7922043016009465
Energy: 0.7629654064862542
Energy: 0.8336814969048769
Energy: 0.7629654064859029
Energy: 0.8336814969071946
Energy: 0.7629654064847091
Energy: 0.8336814969087398
Energy: 0.860736826935713
Energy: 0.7507122200198026
Energy: 0.8607368269388033
Energy: 0.7507122200205751
Energy: 0.8607368269369069
Energy: 0.7507122200201537
Energy: 0.7481989467158138
Energy: 0.843894334486659
Energy: 0.7481989467119509
Energy: 0.8438943344882042
Energy: 0.7481989467173589
Energy: 0.8438943344948061
Energy: 0.8293333823418478
Energy: 0.756224321794692
Energy: 0.8293333823429716
Energy: 0.7562243217939194
Energy: 0.8293333823418478
Energy: 0.7562243217939194
Energy: 0.7639510464502413
Energy: 0.7994125030075256
Energy: 0.7639510464521376
Energy: 0.7994125030064019
Energy: 0.7639510464510139
Energy: 0.7994125030113886

minimum gb energy = 0.7344697132930109 eV
minimum distance =  2.38168692538792 Angstroms
sigma value = 67


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

Energy: 0.859785572044459
Energy: 0.873612431792967
Energy: 0.8597855710380823
Energy: 0.8736124317955486
Energy: 0.8597855722018816
Energy: 0.873612431792967
Energy: 0.8140827098424754
Energy: 0.806382293272706
Energy: 0.8140827098424754
Energy: 0.8063822932752878
Energy: 0.8140827098424754
Energy: 0.806382293272706
Energy: 0.9087135982797975
Energy: 0.9726296929653719
Energy: 0.9087135982772159
Energy: 0.9726296929653719
Energy: 0.9087135982772159
Energy: 0.9726296929653719
Energy: 0.813376115527277
Energy: 0.804988072260285
Energy: 0.813376115527277
Energy: 0.804988072260285
Energy: 0.813376115527277
Energy: 0.804988072260285
Energy: 0.8597855720160609
Energy: 0.8736124317955486
Energy: 0.8597855704342093
Energy: 0.8736124317981303
Energy: 0.8597855722741091
Energy: 0.8736124317981303
Energy: 0.8140827098424754
Energy: 0.8063822932701245
Energy: 0.8140827098398938
Energy: 0.806382293272706
Energy: 0.8140827098424754
Energy: 0.8063822932675428
Energy: 0.9087135982772159
Energy: 0.9726296929653719
Energy: 0.9087135982772159
Energy: 0.9726296929653719
Energy: 0.9087135982772159
Energy: 0.9726296929653719

minimum gb energy = 0.804988072260285 eV
minimum distance =  2.38593321273263 Angstroms
sigma value = 3


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

Energy: 1.1163497728242118
Energy: 1.1239567463622793
Energy: 1.054725590920535
Energy: 1.1239567463868714
Energy: 1.1163497728312382
Energy: 1.1239567463693054
Energy: 1.0782927408140455
Energy: 1.0421409740615846
Energy: 1.078292740803506
Energy: 1.0421409740545582
Energy: 1.0782927407999927
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Energy: 1.1169676930420236
Energy: 1.190617024627929
Energy: 1.1169687857981203
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Energy: 1.1169676930349972
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Energy: 1.1480490980684535
Energy: 1.1086103864268433
Energy: 1.1480490980789932
Energy: 1.1086103864268433
Energy: 1.1480490980860194
Energy: 1.0307026889255917
Energy: 1.0642883338448033
Energy: 1.2019456710459508
Energy: 1.0642883338377769
Energy: 1.2019456707474576
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Energy: 1.2019456710740566
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Energy: 1.0482301328008035
Energy: 1.0911100310467823
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Energy: 1.1807767807910472
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Energy: 0.9966378893305127
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Energy: 0.996637889334026
Energy: 1.1550375743199757
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Energy: 1.1205016791804872
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Energy: 1.1205016791629214
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Energy: 1.0214147755535004
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Energy: 1.053468297493757
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Energy: 1.053453161823137
Energy: 1.1302838369449437
Energy: 1.0534682974972702
Energy: 1.1302838369800117
Energy: 1.20066259188878
Energy: 1.0313284768974127
Energy: 1.20066259181858
Energy: 1.0313284768974127
Energy: 1.2006625918571614
Energy: 1.0313284768938995
Energy: 1.0878567834000947
Energy: 1.120906106559559
Energy: 1.0878567833965813
Energy: 1.1209061065560455
Energy: 1.0878567833965813
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Energy: 1.2155798722762945
Energy: 1.0309468606962953
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Energy: 1.0309468607033214
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Energy: 1.1266130992958165
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Energy: 1.0466561650685893
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Energy: 1.170729287366863
Energy: 1.0303600533946793
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Energy: 1.030360053405219
Energy: 1.1707292873528103
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Energy: 1.0994367912594716
Energy: 1.2144874150216978
Energy: 1.0994367912594716
Energy: 1.214487415025211
Energy: 1.099436791252445
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Energy: 1.2030669193909262
Energy: 1.194200371731861
Energy: 1.203066919387413
Energy: 1.1942003717424006
Energy: 1.2030669193944392
Energy: 1.1942003717424006
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Energy: 1.076536050036687
Energy: 1.053442764114269
Energy: 1.0765360500331735
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Energy: 1.0765360500331735
Energy: 1.2268898901637566
Energy: 1.0744207226401603
Energy: 1.2268892661997495
Energy: 1.0744207226436735
Energy: 1.2268898901778094
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Energy: 1.0910402578679719
Energy: 1.0962905512406094
Energy: 1.0907542532100953
Energy: 1.0962905512511487
Energy: 1.0910402578785114
Energy: 1.0962905512511487
Energy: 1.0713643975361467
Energy: 1.1218244049571742
Energy: 1.071364397543173
Energy: 1.121824404950148
Energy: 1.0713643975396598
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Energy: 1.1221960013045065
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Energy: 1.1221960013009935
Energy: 1.017637752822199
Energy: 1.1221960012974803
Energy: 1.0176377528257121
Energy: 1.1531584696274249
Energy: 1.0741392525082978
Energy: 1.1531584696379644
Energy: 1.0741392525047846
Energy: 1.1531584696519535
Energy: 1.0741392525047846
Energy: 1.0502521957481743
Energy: 1.0871343641026185
Energy: 1.0501248301591553
Energy: 1.0871343641130942
Energy: 1.0502521957516873
Energy: 1.0871343641130942
Energy: 1.0714355855185385
Energy: 1.0695892103936055
Energy: 1.0714355855150253
Energy: 1.0695892104041453
Energy: 1.0714355855044855
Energy: 1.0695892103936055
Energy: 1.1709356178050996
Energy: 1.0410359426438247
Energy: 1.1709356178015862
Energy: 1.0410359426473381
Energy: 1.1709356178050996
Energy: 1.0410359426473381
Energy: 1.1273958389073893
Energy: 1.0296523681502265
Energy: 1.1273958389144159
Energy: 1.0296523681467131
Energy: 1.127395838917929
Energy: 1.0296523681467131
Energy: 1.1048771972378766
Energy: 1.0793815003878728
Energy: 1.0425588598321596
Energy: 1.0793815004019256
Energy: 1.1048771972518654
Energy: 1.0793815004019256
Energy: 1.24251525274806
Energy: 0.9887680001589031
Energy: 1.1795235855213597
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Energy: 1.2425152527445469
Energy: 0.9887680001589031
Energy: 1.1699191412081098
Energy: 1.0498501209542404
Energy: 1.169919141211623
Energy: 1.0498501209577535
Energy: 1.1699191412256758
Energy: 1.0498501209577535
Energy: 1.1395439215501448
Energy: 1.1288422329450503
Energy: 1.139543921553658
Energy: 1.1288422329450503
Energy: 1.139543921553658
Energy: 1.1288422329485635
Energy: 1.134298889061495
Energy: 1.1211204281684444
Energy: 1.1342988890720342
Energy: 1.1211204281684444
Energy: 1.134298889068521
Energy: 1.1211204281684444
Energy: 1.080392579847294
Energy: 1.0742578180503117
Energy: 1.080392579843781
Energy: 1.0742578180503117
Energy: 1.080392579843781
Energy: 1.074257818053825
Energy: 1.211774969338294
Energy: 1.1021354721493357
Energy: 1.225455883906225
Energy: 1.1021354721633885
Energy: 1.211774969338294
Energy: 1.1021354721633885
Energy: 1.1293249505533483
Energy: 1.1792590096580207
Energy: 1.1293230351486803
Energy: 1.1792590096615339
Energy: 1.1293249505568612
Energy: 1.1792590096545075
Energy: 1.2289629818780832
Energy: 1.0506811344951053
Energy: 1.22896298187457
Energy: 1.0506811344915923
Energy: 1.2289629818640304
Energy: 1.0506811344915923
Energy: 1.0359391415830568
Energy: 1.1085034222988892
Energy: 1.0359391415865697
Energy: 1.1085034222883496
Energy: 1.0359391415935961
Energy: 1.1085034222883496
Energy: 1.1609371252969785
Energy: 1.102136810501878
Energy: 1.1609371253040046
Energy: 1.1021368105053915
Energy: 1.1609371253040046
Energy: 1.1021368105053915
Energy: 1.0587830261834559
Energy: 1.1683132490771955
Energy: 1.0589915134825436
Energy: 1.168313227730031
Energy: 1.05878302616589
Energy: 1.1683133196434492
Energy: 1.1454696677569474
Energy: 1.085351964165418
Energy: 1.145469667749921
Energy: 1.085351964165418
Energy: 1.145469667749921
Energy: 1.085351964165418
Energy: 1.0902893901374435
Energy: 1.2142235095655876
Energy: 1.090289390140957
Energy: 1.2142235095726142
Energy: 1.0902893901304171
Energy: 1.2142235095726142
Energy: 1.097671675736229
Energy: 1.02873736048819
Energy: 1.0976716757292027
Energy: 1.0287373604811638
Energy: 1.097671675732716
Energy: 1.0287373604811638
Energy: 1.0505982487933645
Energy: 1.124379611298798
Energy: 1.0505982487757985
Energy: 1.1243796113023115
Energy: 1.050598248782825
Energy: 1.1243796113023115
Energy: 1.1693990821276596
Energy: 1.0025196769956806
Energy: 1.1693990821417124
Energy: 1.002519676988718
Energy: 1.169399082138199
Energy: 1.002519676988718
Energy: 1.185176606287822
Energy: 1.214371411997023
Energy: 1.1855826877422841
Energy: 1.2143714120005364
Energy: 1.185176606287822
Energy: 1.2143714120005364
Energy: 1.0996456072647525
Energy: 1.1034451938513077
Energy: 1.0996456072682654
Energy: 1.1034451938548209
Energy: 1.0996456072647525
Energy: 1.103445193858334
Energy: 1.0585448535218225
Energy: 1.1434572265157747
Energy: 1.0585448535112827
Energy: 1.143457226501722
Energy: 1.0585448535183093
Energy: 1.1434572265122613
Energy: 1.0846623618690863
Energy: 1.0873415962432278
Energy: 1.0846623618725992
Energy: 1.0873415962502542
Energy: 1.0846623618796256
Energy: 1.0873415962502542
Energy: 1.1065278619585164
Energy: 1.0901564729046564
Energy: 1.1065006958289565
Energy: 1.0901564729187092
Energy: 1.1065278618777128
Energy: 1.0901564729187092

minimum gb energy = 0.9887680001589031 eV
minimum distance =  2.36794597330433 Angstroms
sigma value = 81


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

Energy: 1.0574542782558738
Energy: 1.0336305170682998
Energy: 1.2414538697762292
Energy: 1.0336305170341087
Energy: 1.0574542782582843
Energy: 1.033630517061067
Energy: 1.010492683994588
Energy: 1.0667262987087536
Energy: 1.0104926839974813
Energy: 1.0667262987015207
Energy: 1.0104926840047137
Energy: 1.0667262987005564
Energy: 1.2022677521356406
Energy: 1.155385520280604
Energy: 1.2026548847236906
Energy: 1.1553855202738532
Energy: 1.2022677521255587
Energy: 1.1553855202748176
Energy: 1.037577612892586
Energy: 1.149869363722417
Energy: 1.037577612895479
Energy: 1.1498693637175952
Energy: 1.03757761289789
Energy: 1.1498693637180775
Energy: 0.996299486229685
Energy: 0.973377407019607
Energy: 0.996299486229685
Energy: 0.9733774070143029
Energy: 0.9962994862330602
Energy: 0.9733774070152672
Energy: 1.0034455721112177
Energy: 0.9223529688614556
Energy: 1.0034455721136286
Energy: 0.9223529688677237
Energy: 1.003445572112182
Energy: 0.9223529688672416
Energy: 0.922047643380008
Energy: 0.9315297112578377
Energy: 0.9220476433742216
Energy: 0.9315297112583198
Energy: 0.9220476433727751
Energy: 0.9315297112578377
Energy: 1.0455210236559689
Energy: 1.1108123249358324
Energy: 1.0455093583356014
Energy: 1.1108123249300463
Energy: 1.0455210236487362
Energy: 1.1108123249300463
Energy: 1.2274514874154288
Energy: 1.137472168269934
Energy: 1.227449608551009
Energy: 1.1374721682718627
Energy: 1.2274445342640323
Energy: 1.137472168269452
Energy: 1.155353186186946
Energy: 1.2198524663727732
Energy: 1.155353186189357
Energy: 1.2198524663674695
Energy: 1.155353186187428
Energy: 1.2198524663679517
Energy: 1.0136636183097765
Energy: 1.0057347549567441
Energy: 1.0136636183073655
Energy: 1.005734754956262
Energy: 1.0136636183068832
Energy: 1.005734754956262
Energy: 0.9237557134829162
Energy: 1.0038798489339549
Energy: 0.9237557134829162
Energy: 1.0038798488197218
Energy: 0.9237557134858092
Energy: 1.0038798485700835
Energy: 1.0149789818914725
Energy: 1.068994878366697
Energy: 1.0149789818948476
Energy: 1.0689948783724832
Energy: 1.0149789818972585
Energy: 1.0689948783724832
Energy: 1.0754166910175713
Energy: 1.1550378421827225
Energy: 1.0754166910195002
Energy: 1.1550378421899552
Energy: 1.0754166910170893
Energy: 1.1550378421899552
Energy: 1.1548104707272133
Energy: 1.0444859170307659
Energy: 1.1548104707315527
Energy: 1.0444859170428202
Energy: 1.1548104707310707
Energy: 1.0444859170428202
Energy: 1.0456196559979942
Energy: 0.9305034187438062
Energy: 1.045619655999923
Energy: 0.9305034187452526
Energy: 1.0456196559994408
Energy: 0.9305034187462169
Energy: 1.036806811649754
Energy: 0.9256297384868462
Energy: 1.0368068116483073
Energy: 0.9256297384873282
Energy: 1.0368068116444498
Energy: 0.9256297384868462
Energy: 1.0100722977321857
Energy: 1.0402800855303858
Energy: 1.010025681351787
Energy: 1.0402800855236352
Energy: 1.0100722977321857
Energy: 1.0402800855241174
Energy: 0.9289761018362925
Energy: 1.1328733435193932
Energy: 0.9289761018377389
Energy: 1.1328733435251794
Energy: 0.9289761018377389
Energy: 1.1328733435232505
Energy: 1.1527817982459847
Energy: 1.156345653899064
Energy: 1.1527817982455026
Energy: 1.1563456538961707
Energy: 1.1527817982512887
Energy: 1.1563456538961707
Energy: 0.9712635474051131
Energy: 1.0691016382804714
Energy: 0.9712635474017379
Energy: 1.0691016382780605
Energy: 0.9712635473988448
Energy: 1.0691016382775782
Energy: 1.0238759821393721
Energy: 1.0084789997593546
Energy: 0.9372743037531717
Energy: 1.0084789997622479
Energy: 1.0238759821282821
Energy: 1.0084789997622479
Energy: 1.0234214266025445
Energy: 0.9232735261297691
Energy: 0.9374258299337005
Energy: 0.9232735261259116
Energy: 1.0234214266001338
Energy: 0.9232735261263938
Energy: 1.049980447147155
Energy: 1.0474638238386376
Energy: 1.0499804471466727
Energy: 1.04746382383478
Energy: 1.0499804471408865
Energy: 1.04746382383478
Energy: 1.0742318601957734
Energy: 1.229434548839835
Energy: 1.0742318601895489
Energy: 1.229434548845621
Energy: 1.0742318601890668
Energy: 1.229434548844657
Energy: 1.158171561514826
Energy: 1.259447375215278
Energy: 1.1581715615196475
Energy: 1.25944737521576
Energy: 1.1581715615157904
Energy: 1.2594473752172066
Energy: 1.010070234255244
Energy: 1.03955263942263
Energy: 1.0100702342513863
Energy: 1.0395526394399885
Energy: 1.0100702342542793
Energy: 1.039552639435649
Energy: 1.0375746051168273
Energy: 0.92591615949997
Energy: 1.037574605115381
Energy: 0.925916159508167
Energy: 1.0375746051144163
Energy: 0.9259161595076849
Energy: 1.0667150190350618
Energy: 1.0162310564388612
Energy: 1.0667384658012853
Energy: 1.0162310564518802
Energy: 1.0667150190350618
Energy: 1.0162310564509158
Energy: 1.1540956312283435
Energy: 0.9994402055295221
Energy: 1.1540956312307544
Energy: 0.9994402055328974
Energy: 1.1540956312240038
Energy: 0.9994402055324153
Energy: 1.1494876689331586
Energy: 1.1554243123383738
Energy: 1.1494876689418376
Energy: 1.1554243123398205
Energy: 1.1494876689572675
Energy: 1.1554243123403027
Energy: 0.9287036180344527
Energy: 1.047282420687404
Energy: 0.9287036180267817
Energy: 1.0472824206912617
Energy: 0.9287036180253352
Energy: 1.0472824206922258
Energy: 0.9236280074231827
Energy: 1.0042478580609664
Energy: 0.9236280074203335
Energy: 1.0042478580609664
Energy: 0.9236280074212979
Energy: 1.004247858060002
Energy: 0.9301031566407209
Energy: 0.9206728855279722
Energy: 0.9301031566426496
Energy: 0.9206728855217038
Energy: 0.9301031566479537
Energy: 0.920672885522186
Energy: 1.233007058052386
Energy: 1.2195439164133863
Energy: 1.232935430130898
Energy: 1.2195439164095292
Energy: 1.233007058051904
Energy: 1.2195439164133863
Energy: 1.1599114992112796
Energy: 1.2318101733141762
Energy: 1.1599114992030826
Energy: 1.2318101733146585
Energy: 1.1599114992059754
Energy: 1.2318101733151405
Energy: 1.066751454373336
Energy: 1.0603574037059884
Energy: 1.066751454376229
Energy: 1.060357403703578
Energy: 1.066751454381051
Energy: 1.0603574037040597
Energy: 1.0072671649421276
Energy: 0.9316821628969328
Energy: 1.00726716494261
Energy: 0.9316821628935575
Energy: 1.0072671649401987
Energy: 0.9316821628940395

minimum gb energy = 0.9206728855217038 eV
minimum distance =  2.40407348170454 Angstroms
sigma value = 43


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

Energy: 1.1623329365053836
Energy: 0.9359941121967644
Energy: 1.162332936506568
Energy: 0.9359941121961721
Energy: 1.1623329365059756
Energy: 0.9359941121961721
Energy: 1.0876678897035066
Energy: 0.9351382739998833
Energy: 1.0876678897011374
Energy: 0.9351382739998833
Energy: 1.0876678897017298
Energy: 0.9351382739998833
Energy: 1.110368889566594
Energy: 1.1951349187667841
Energy: 1.1103688895689632
Energy: 1.195134918766192
Energy: 1.1103688895660015
Energy: 1.195134918766192
Energy: 1.0206626062408677
Energy: 1.0693374303635639
Energy: 1.0206626062402755
Energy: 1.0693374303671177
Energy: 1.0206626062408677
Energy: 1.0693374303665253
Energy: 1.0745600256953614
Energy: 1.083448348344654
Energy: 1.0745600256953614
Energy: 1.083448348347023
Energy: 1.0745600256959538
Energy: 1.0834483483434694
Energy: 1.0871380412894054
Energy: 1.0139941060430882
Energy: 1.0871380412905898
Energy: 1.0139941060436803
Energy: 1.0871380412894054
Energy: 1.0139941060436803
Energy: 1.0828223723325685
Energy: 1.0999086630463033
Energy: 1.0828223723284225
Energy: 1.0999086630457113
Energy: 1.0828223723301995
Energy: 1.099908663045119
Energy: 0.9558238588423706
Energy: 1.0933766872263904
Energy: 0.9558238588417782
Energy: 1.093376687225206
Energy: 0.9558238588417782
Energy: 1.0933766872263904
Energy: 1.1633891322803291
Energy: 1.0070457936021953
Energy: 1.1633891165991557
Energy: 1.0070457936033796
Energy: 1.16338908277115
Energy: 1.0070457936033796
Energy: 1.074044241073207
Energy: 1.2111991505205464
Energy: 1.0740442410737991
Energy: 1.2111991505205464
Energy: 1.0740442410761684
Energy: 1.2111991505205464
Energy: 1.141813281527884
Energy: 1.0906632553069664
Energy: 1.141813281527884
Energy: 1.0906632553063744
Energy: 1.141813281527884
Energy: 1.0906632553063744
Energy: 0.9560725440452706
Energy: 1.2591670592914344
Energy: 0.9560725440464554
Energy: 1.2591670592890654
Energy: 0.956072544045863
Energy: 1.2591670592920268
Energy: 1.1491080671397444
Energy: 1.101928770318406
Energy: 1.1491080671432978
Energy: 1.1019287703189984
Energy: 1.1491080671468517
Energy: 1.1019287703189984
Energy: 0.9297922302357996
Energy: 1.1588784859797727
Energy: 0.9297922302357996
Energy: 1.1588784859797727
Energy: 0.9297922302363917
Energy: 1.1588784859797727
Energy: 0.9728754990372256
Energy: 1.080535295948475
Energy: 0.9728754990378179
Energy: 1.0805352959466983
Energy: 0.9728754990366335
Energy: 1.0805352959478827
Energy: 1.0947652444967513
Energy: 1.1479700420687076
Energy: 1.0947652444967513
Energy: 1.1479700420698922
Energy: 1.094765244490236
Energy: 1.1479700420704844
Energy: 1.0899896150602175
Energy: 0.9351502532692304
Energy: 1.0899895581935306
Energy: 0.9351502532692304
Energy: 1.0899893598909915
Energy: 0.9351502532698227
Energy: 1.1777964140505044
Energy: 0.9908503877184671
Energy: 1.1777964140510966
Energy: 0.9908503877143212
Energy: 1.1777964140510966
Energy: 0.9908503877172825
Energy: 1.1778404523480615
Energy: 1.0439656693940818
Energy: 1.1778404523480615
Energy: 1.0439656693940818
Energy: 1.1778404523468766
Energy: 1.0439656693946742
Energy: 1.1149271249372927
Energy: 0.9349667613361784
Energy: 1.1149268573021263
Energy: 0.9349667613355863
Energy: 1.1149262029969598
Energy: 0.9349667613344017
Energy: 1.0831568559716644
Energy: 1.0540649075440862
Energy: 1.083156855971072
Energy: 1.0540649075446786
Energy: 1.083156855972849
Energy: 1.0540649075440862
Energy: 1.1732802783241802
Energy: 1.1848460302905985
Energy: 1.1732802783342489
Energy: 1.1848460302905985
Energy: 1.1732802783354332
Energy: 1.1848460302905985
Energy: 0.9294089562641484
Energy: 1.0659756859622176
Energy: 0.9294089562647407
Energy: 1.0659756859616254
Energy: 0.9294089562647407
Energy: 1.06597568596281
Energy: 1.148267209860316
Energy: 1.102986312081961
Energy: 1.1482672098579465
Energy: 1.1029863120825532
Energy: 1.14826720985617
Energy: 1.102986312081961
Energy: 0.9551530248100222
Energy: 1.0831425774560408
Energy: 0.9551530248106144
Energy: 1.0831425774560408
Energy: 0.9551530248082454
Energy: 1.0831425774560408
Energy: 1.0876200313037863
Energy: 1.103403338525759
Energy: 1.087620031303194
Energy: 1.1034033385263513
Energy: 1.087620031303194
Energy: 1.1034033385263513
Energy: 1.084462808493082
Energy: 0.9982940745274025
Energy: 1.0844628084978203
Energy: 0.9982940745279946
Energy: 1.0844628084960435
Energy: 0.9982940745285869
Energy: 1.2382094187832393
Energy: 1.0128681033420792
Energy: 1.23820941878087
Energy: 1.0128681033414868
Energy: 1.2382094187820547
Energy: 1.0128681033432636
Energy: 0.9550000005894907
Energy: 1.0936825266170225
Energy: 0.9550000005888984
Energy: 1.0936825266158376
Energy: 0.9550000005888984
Energy: 1.0936825266182069
Energy: 1.026850786309049
Energy: 1.082943325586422
Energy: 1.0268507863096414
Energy: 1.0829433255870144
Energy: 1.0268507863096414
Energy: 1.0829433255870144
Energy: 1.086874549304012
Energy: 1.0144930517181603
Energy: 1.0868745493022351
Energy: 1.014493051719345
Energy: 1.0868745493046041
Energy: 1.0144930517187527

minimum gb energy = 0.9294089562641484 eV
minimum distance =  2.36760908032548 Angstroms
sigma value = 57


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

Energy: 1.0482095198471955
Energy: 0.9837617581672247
Energy: 1.0482095198448949
Energy: 0.9837617581656909
Energy: 1.0482095198479624
Energy: 0.9837617581649588
Energy: 1.078101927345971
Energy: 0.9474213042793594
Energy: 1.0781019273482717
Energy: 0.9474213042793594
Energy: 1.0781019273436703
Energy: 0.9474213042778257
Energy: 1.0991253075978917
Energy: 1.107032892021672
Energy: 1.0991253075971248
Energy: 1.107032892021672
Energy: 1.0991253075978917
Energy: 1.1070328920193713
Energy: 1.2450377624944033
Energy: 1.0416347609786545
Energy: 1.245037762495937
Energy: 1.0416347610154642
Energy: 1.245037762495937
Energy: 1.0416347610430365
Energy: 0.9646380823995512
Energy: 1.0367475517243023
Energy: 0.9646380824171893
Energy: 1.0367475516989957
Energy: 0.964638082424091
Energy: 1.036747551732738
Energy: 1.0898515238854884
Energy: 1.0219946072711068
Energy: 1.0898515238862552
Energy: 1.02199460727034
Energy: 1.0898515238854884
Energy: 1.0219946072695731
Energy: 1.1090339174427295
Energy: 1.2016605514438292
Energy: 1.1090339174442632
Energy: 1.2016605514438292
Energy: 1.1090339174442632
Energy: 1.2016605514438292
Energy: 0.9985136810590234
Energy: 0.9965588322163154
Energy: 0.9985136810597902
Energy: 0.9965588322178491
Energy: 0.9985136810582566
Energy: 0.9965588322163154
Energy: 1.040557940823481
Energy: 0.9479184170471529
Energy: 1.0405579408296162
Energy: 0.9479184170471529
Energy: 1.0405579408204138
Energy: 0.9479184170471529
Energy: 0.9840790847732684
Energy: 1.0744235871629995
Energy: 0.9840790847725015
Energy: 1.0744235871622325
Energy: 0.9840790847732684
Energy: 1.0744235871629995
Energy: 1.1035574875178906
Energy: 1.066146824268513
Energy: 1.1035574875171237
Energy: 1.0661468242738812
Energy: 1.1035574875148229
Energy: 1.0661468242738812
Energy: 1.0510238769461593
Energy: 1.2275321367285426
Energy: 1.0510238769109184
Energy: 1.2275321367331438
Energy: 1.05102387694846
Energy: 1.227532136721641
Energy: 1.0492426271465893
Energy: 0.94754258119419
Energy: 1.0492426271458226
Energy: 0.9475425811995583
Energy: 1.0492426271404545
Energy: 0.9475425811980245
Energy: 1.0399085308284133
Energy: 0.9850207917781952
Energy: 1.0399085243558523
Energy: 0.9850207917781952
Energy: 1.0399085173566978
Energy: 0.9850207917789621
Energy: 1.0933306206878346
Energy: 0.9515434711365456
Energy: 1.0933306206755649
Energy: 0.9515434711373124
Energy: 1.0933306208127642
Energy: 0.9515434711373124
Energy: 1.0411611050237828
Energy: 1.0097373128169376
Energy: 1.0411611050184149
Energy: 1.0097373128054346
Energy: 1.0411611050092122
Energy: 1.0097373128177043
Energy: 0.9574484219313806
Energy: 1.078882947925532
Energy: 0.9574484219321474
Energy: 1.0788829479239983
Energy: 0.9574484219298468
Energy: 1.0788829479247652
Energy: 1.0531123716422228
Energy: 1.1076975777112403
Energy: 1.0531123716422228
Energy: 1.1076975777104736
Energy: 1.0531123716422228
Energy: 1.1076975777112403
Energy: 0.9576410897593746
Energy: 1.0785916106596936
Energy: 0.9576410897547734
Energy: 1.0785916106604605
Energy: 0.9576410897601414
Energy: 1.0785916106596936
Energy: 1.042860884731054
Energy: 1.0099681778756606
Energy: 1.042860884441318
Energy: 1.0099681778756606
Energy: 1.042860884626795
Energy: 1.0099681778779612
Energy: 1.092848749779945
Energy: 0.9515539606378797
Energy: 1.0928487568610845
Energy: 0.9515539606340452
Energy: 1.0928486465978673
Energy: 0.9515539606363459
Energy: 1.0406942656242153
Energy: 1.0070117894184087
Energy: 1.040694270296941
Energy: 1.0070117894184087
Energy: 1.040694270546068
Energy: 1.0070117894184087
Energy: 1.0498132775691131
Energy: 0.9484295098797383
Energy: 1.0498132775721805
Energy: 0.9484295098805053
Energy: 1.0498132775721805
Energy: 0.9484295098782046
Energy: 1.0504624593455887
Energy: 1.2274794809399936
Energy: 1.0504624637531181
Energy: 1.2274794809438279
Energy: 1.050462461747902
Energy: 1.2274794809284906

minimum gb energy = 0.9474213042778257 eV
minimum distance =  2.33557313597105 Angstroms
sigma value = 17


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

Energy: 1.3825823666393167
Energy: 0.9687885472383735
Energy: 1.3825823666393167
Energy: 0.9687885472394581
Energy: 1.3825823666393167
Energy: 0.9687885472394581
Energy: 0.9385342534965819
Energy: 0.962487971150018
Energy: 0.9385342534738073
Energy: 0.9624879711489336
Energy: 0.9385342534987512
Energy: 0.9624879711478491
Energy: 1.054682236726746
Energy: 1.0043717138779216
Energy: 1.0546822367278306
Energy: 1.0043717138779216
Energy: 1.0546822367278306
Energy: 1.0043717138779216
Energy: 0.873400123066599
Energy: 1.104702811965805
Energy: 0.8734001230611763
Energy: 1.104702811967974
Energy: 0.873400123066599
Energy: 1.104702811967974
Energy: 1.0850811962269484
Energy: 1.0676335631083975
Energy: 1.0850812826469922
Energy: 1.0676335631073133
Energy: 1.0850811900046053
Energy: 1.06763356310194
Energy: 1.0253058888689635
Energy: 1.0491397459338048
Energy: 1.0253058888689635
Energy: 1.0491397459338048
Energy: 1.0253058888689635
Energy: 1.0491397459338048
Energy: 1.033090785107129
Energy: 0.9272138412427032
Energy: 1.033090785107129
Energy: 0.9272138412437878
Energy: 1.033090785107129
Energy: 0.9272138412437878
Energy: 0.8747645657678793
Energy: 1.022346112975216
Energy: 0.8747645657689638
Energy: 1.022346112975216
Energy: 0.8747645657689638
Energy: 1.0223461129763005
Energy: 1.0816297335708212
Energy: 0.9541709142795044
Energy: 1.0816297335708212
Energy: 0.9541709142784198
Energy: 1.0816297335740748
Energy: 0.9541709142784198
Energy: 0.9406985633109795
Energy: 0.9362006858236539
Energy: 0.940698563309895
Energy: 0.9362006858247384
Energy: 0.940698563309895
Energy: 0.9362006858247384
Energy: 0.9372830327013764
Energy: 1.0876298258060682
Energy: 0.9372830327002918
Energy: 1.0876298258060682
Energy: 0.9372830327002918
Energy: 1.0876298258060682
Energy: 0.9827149583314154
Energy: 0.9540066166013463
Energy: 0.9827149583238239
Energy: 0.9540066165991771
Energy: 0.9827149583259929
Energy: 0.9540066166013463
Energy: 0.9312487276510257
Energy: 1.0528263629546286
Energy: 0.9312487276510257
Energy: 1.0528263629546286
Energy: 0.9312487276521101
Energy: 1.0528263629546286
Energy: 0.9473926373633578
Energy: 1.1255528944105593
Energy: 0.9473926373633578
Energy: 1.1255528944105593
Energy: 0.9473926373644422
Energy: 1.1255528944105593
Energy: 1.021758643281078
Energy: 1.2474169160501667
Energy: 1.021758643281078
Energy: 1.2474169160501667
Energy: 1.021758643281078
Energy: 1.2474169160501667
Energy: 1.0436629084933915
Energy: 1.0536471719624276
Energy: 1.0436629084955604
Energy: 1.0536471719613432
Energy: 1.0436629084933915
Energy: 1.0536471719624276
Energy: 0.9453374056683962
Energy: 1.125783828772557
Energy: 0.9453374056694807
Energy: 1.125783828772557
Energy: 0.9453374056694807
Energy: 1.1257838287736412

minimum gb energy = 0.8734001230611763 eV
minimum distance =  2.36155341374701 Angstroms
sigma value = 17


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

Energy: 1.3638088809334274
Energy: 0.9102110954675258
Energy: 1.3111597960289094
Energy: 0.9102110954608249
Energy: 1.3638088809367777
Energy: 0.9102110954616626
Energy: 1.0482077699332013
Energy: 0.9351360873741708
Energy: 0.9862385666833766
Energy: 0.9351360873754271
Energy: 1.0482077699269192
Energy: 0.9351360873766835
Energy: 1.0732223891405654
Energy: 1.0188170744053817
Energy: 0.9943734301275086
Energy: 1.0188170743995184
Energy: 1.0732223891430783
Energy: 1.0188170743995184
Energy: 1.1374652326023311
Energy: 1.0220997727559311
Energy: 1.1374884431149537
Energy: 1.0220997727563497
Energy: 1.1374652326048438
Energy: 1.0220997727563497
Energy: 0.9887102460722862
Energy: 1.021841661535977
Energy: 0.9887102460752178
Energy: 1.0218416615309514
Energy: 0.9887102460814999
Energy: 1.021841661531789
Energy: 0.9999532959204598
Energy: 0.8355121984012535
Energy: 0.9995818215945674
Energy: 0.835512198399997
Energy: 0.9999532959229728
Energy: 0.8355121984008347
Energy: 0.9822098809607733
Energy: 0.9900724212592877
Energy: 0.9822098809620297
Energy: 0.9900724212664074
Energy: 0.9822098809586793
Energy: 0.990072421266826
Energy: 1.1879275115189458
Energy: 1.1087779043481154
Energy: 1.1879275115181085
Energy: 1.1087779043397394
Energy: 1.1879275115181085
Energy: 1.1087779043393207
Energy: 0.9369956432478829
Energy: 1.0023224363038847
Energy: 0.9369956432558401
Energy: 1.0023224362996968
Energy: 0.9369956432646349
Energy: 1.0023224362996968
Energy: 0.9824863393811363
Energy: 0.8762146833405388
Energy: 0.982486339383649
Energy: 0.8762146833417952
Energy: 0.9824863393849055
Energy: 0.8762146833417952
Energy: 1.1339580201085824
Energy: 1.119171082625885
Energy: 1.1339580201136081
Energy: 1.1191710826267227
Energy: 1.13395802011989
Energy: 1.1191710826267227
Energy: 1.0701685627783313
Energy: 1.1524023077817902
Energy: 1.0701685627733057
Energy: 1.1524023077788585
Energy: 1.0701685627670237
Energy: 1.1524023077784395
Energy: 1.0181103165892025
Energy: 1.0298820452723487
Energy: 1.01811031659004
Energy: 1.0298820452773745
Energy: 1.0181103165871086
Energy: 1.0298820452769555
Energy: 0.8424412903008588
Energy: 1.001710077670306
Energy: 0.842441290304628
Energy: 1.00171007766193
Energy: 0.8424412903071408
Energy: 1.00171007766193
Energy: 1.1000199092980127
Energy: 1.1563655970130722
Energy: 1.0996878056034554
Energy: 1.1563655970147473
Energy: 1.1000199093168206
Energy: 1.1563655970147473
Energy: 0.936320764234997
Energy: 0.9935712573878507
Energy: 0.9367071774245188
Energy: 0.9935712573773807
Energy: 0.9363207642354159
Energy: 0.9935712573769621
Energy: 0.8412932854228268
Energy: 1.071805076977175
Energy: 0.8412932854291089
Energy: 1.0718050769855512
Energy: 0.8412932854270148
Energy: 1.0718050769855512
Energy: 1.0493146752001565
Energy: 1.1444201443510584
Energy: 1.049314675196806
Energy: 1.1444201443439388
Energy: 1.0493146751905242
Energy: 1.1444201443439388
Energy: 0.9407774520601099
Energy: 0.9944444938576305
Energy: 0.9407774520609475
Energy: 0.9944444938534426
Energy: 0.9407774520626226
Energy: 0.9944444938542802
Energy: 0.8406473522467154
Energy: 0.9928526195815406
Energy: 0.8406473522534162
Energy: 0.9928526195752587
Energy: 0.8406473522504846
Energy: 0.9928526195756774
Energy: 1.001969641106106
Energy: 0.9947615365637623
Energy: 1.0019696411052683
Energy: 0.9947615365587366
Energy: 1.001969641097349
Energy: 0.9947615365595741
Energy: 0.9810115621347225
Energy: 1.1443475634921876
Energy: 0.9810115621334662
Energy: 1.1443475634854865
Energy: 0.9810115621326285
Energy: 1.1443475634854865
Energy: 0.8409982352502027
Energy: 1.0015106703784036
Energy: 0.840998235255647
Energy: 1.0015106703784036
Energy: 0.8409982352610913
Energy: 1.0015106703779846
Energy: 0.8925252932045149
Energy: 1.0736325361567813
Energy: 0.8925252932070277
Energy: 1.073632536165157
Energy: 0.8925252932032586
Energy: 1.073632536165576
Energy: 1.118330673075529
Energy: 1.1561224707787778
Energy: 1.1183306730730163
Energy: 1.1561224707766837
Energy: 1.1183306730767855
Energy: 1.15612247077794
Energy: 0.9309514873545207
Energy: 1.0278967553032978
Energy: 0.8423025734831171
Energy: 1.0278967553062295
Energy: 0.9309514873574523
Energy: 1.0278967553058105
Energy: 1.054570024671901
Energy: 0.9999219803420446
Energy: 1.0084092764662576
Energy: 0.9999219803412069
Energy: 1.0545700246714824
Energy: 0.9999219803428822
Energy: 1.0890940291494697
Energy: 1.1526610407366056
Energy: 1.010108092281045
Energy: 1.1526610407345115
Energy: 1.089094029146957
Energy: 1.1526610407345115
Energy: 1.1342559419701974
Energy: 1.1282751554284054
Energy: 1.1342112908362423
Energy: 1.1282751554288242
Energy: 1.134255941974804
Energy: 1.1282751554279866
Energy: 0.9821644458094523
Energy: 0.9869217692759664
Energy: 0.982164445808196
Energy: 0.9869217692654965
Energy: 0.9821644458065207
Energy: 0.9869217692659152
Energy: 0.9968977370984078
Energy: 1.0029518024034567
Energy: 0.9968977370992456
Energy: 1.0029518024005253
Energy: 0.9968977371030147
Energy: 1.0029518024005253
Energy: 1.1147205910052365
Energy: 1.1822027043595158
Energy: 1.1147205910136124
Energy: 1.1822027043637038
Energy: 1.1147205910157065
Energy: 1.1822027043637038
Energy: 1.040597609183225
Energy: 0.9298792882759447
Energy: 1.0405976091802933
Energy: 0.9298792882738506
Energy: 1.040597609180712
Energy: 0.929879288275107
Energy: 1.0196622549164496
Energy: 0.8466264762529919
Energy: 1.0196622549168683
Energy: 0.8466264762592738
Energy: 1.019662254911462
Energy: 0.8466264762592738
Energy: 0.9877062217390469
Energy: 1.0870242268966415
Energy: 0.987706221743235
Energy: 1.0870242268987356
Energy: 0.9877062217411411
Energy: 1.0870242268974792
Energy: 1.137897612079935
Energy: 1.008776012964461
Energy: 1.137897612085798
Energy: 1.008776012956085
Energy: 1.1378976120853792
Energy: 1.008776012956085
Energy: 1.0252459365320001
Energy: 0.9378177008292965
Energy: 1.025245936529906
Energy: 0.9378177008246897
Energy: 1.0252459365336752
Energy: 0.9378177008246897
Energy: 1.0000477873171196
Energy: 1.0366631555704446
Energy: 1.000047787307525
Energy: 1.0366631555729573
Energy: 1.0000477873100382
Energy: 1.0366631555729573
Energy: 1.3111597960255588
Energy: 0.9102110954675258
Energy: 1.31115979602514
Energy: 0.9102110954629189
Energy: 1.3111597960259778
Energy: 0.9102110954633377
Energy: 0.9862385666842143
Energy: 0.9388278067301201
Energy: 0.9862385666825391
Energy: 0.9388278067267697
Energy: 0.9862385666863082
Energy: 0.9388278067267697
Energy: 1.0341254616008921
Energy: 1.0189447848095678
Energy: 1.0337084427887693
Energy: 1.0189447848020674
Energy: 1.0341254608377626
Energy: 1.0189447848020674
Energy: 1.1373414191769209
Energy: 1.0220997727546746
Energy: 1.1373341153494756
Energy: 1.0220997727567684
Energy: 1.1373414191698015
Energy: 1.0220997727563497
Energy: 0.9887102460718675
Energy: 1.0223895882834362
Energy: 0.9887102460735427
Energy: 1.022389588288043
Energy: 0.9887102460798246
Energy: 1.022389588288043

minimum gb energy = 0.835512198399997 eV
minimum distance =  2.27884966659439 Angstroms
sigma value = 57


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

Energy: 1.2349920995412649
Energy: 0.7925212681290988
Energy: 1.2349920995412649
Energy: 0.7925212681290988
Energy: 1.2349920995426287
Energy: 0.7925212681304626
Energy: 0.880275637148564
Energy: 0.8985993129240919
Energy: 0.8802756371478823
Energy: 0.8985993129240919
Energy: 0.8802756371478823
Energy: 0.8985993129240919
Energy: 0.8843148097608501
Energy: 0.8974013622404571
Energy: 0.8843148097588045
Energy: 0.8974013622404571
Energy: 0.8843148097594863
Energy: 0.897401362241139
Energy: 0.9997191229755743
Energy: 0.891470567275812
Energy: 0.9997191229748923
Energy: 0.8914705672764939
Energy: 0.9997191229742105
Energy: 0.891470567275812
Energy: 0.8831618889518242
Energy: 0.8830383535430926
Energy: 0.8831618889525064
Energy: 0.8830383535430926
Energy: 0.8831618889538702
Energy: 0.8830383535430926
Energy: 0.8821740194417782
Energy: 0.7855702212261894
Energy: 0.8821740194404143
Energy: 0.7855702212261894
Energy: 0.8821740194397324
Energy: 0.7855702212261894
Energy: 0.9930489467292357
Energy: 0.8633327635576382
Energy: 0.9930489467326452
Energy: 0.8633327635590021
Energy: 0.9930489467312814
Energy: 0.8633327635583201
Energy: 1.0358200828215554
Energy: 1.0010037860871932
Energy: 1.0358200828215554
Energy: 1.0010037860871932
Energy: 1.0358200828229196
Energy: 1.0010037860865113
Energy: 0.827763939824338
Energy: 0.8871517163789209
Energy: 0.82776393982502
Energy: 0.8871517163789209
Energy: 0.82776393982502
Energy: 0.8871517163796028
Energy: 0.8918009495856128
Energy: 0.8338289868647639
Energy: 0.8918009495869766
Energy: 0.8338289868647639
Energy: 0.8918009495856128
Energy: 0.8338289868647639
Energy: 0.990730518668967
Energy: 1.0049514739434906
Energy: 0.990730518668967
Energy: 1.0049514739434906
Energy: 0.9907305186669214
Energy: 1.0049514739441725
Energy: 0.8570150122635137
Energy: 0.9911705334628372
Energy: 0.8570150122641956
Energy: 0.9911705334607914
Energy: 0.8570150122628318
Energy: 0.9911705334642011
Energy: 0.8929827347052736
Energy: 0.8915571046133566
Energy: 0.8929827347066374
Energy: 0.8915571046133566
Energy: 0.8929827347066374
Energy: 0.8915571046133566
Energy: 0.9938772689775619
Energy: 0.9501554535283865
Energy: 0.9938772689789257
Energy: 0.9501554535283865
Energy: 0.9938772689789257
Energy: 0.9501554535283865
Energy: 0.9178889273443349
Energy: 1.0150075777961889
Energy: 0.9178889273429711
Energy: 1.0150075777948253
Energy: 0.917888927343653
Energy: 1.0150075777955072
Energy: 0.895180116320625
Energy: 0.8871158120823228
Energy: 0.8951801163185793
Energy: 0.8871158120823228
Energy: 0.8951801163199431
Energy: 0.8871158120823228
Energy: 0.91588744346303
Energy: 0.894905379176956
Energy: 0.91588744346303
Energy: 0.894905379176956
Energy: 0.9158874434609844
Energy: 0.8949053791776378
Energy: 0.9897660857535188
Energy: 1.0173079105682374
Energy: 0.9897660857542007
Energy: 1.0173079105675555
Energy: 0.9897660857542007
Energy: 1.0173079105675555
Energy: 0.8886097063386091
Energy: 0.9058637709225148
Energy: 0.8886097063379272
Energy: 0.9058637709218329
Energy: 0.8886097063399729
Energy: 0.9058637709218329
Energy: 0.8898632530201173
Energy: 0.8931729669247711
Energy: 0.8898632530194353
Energy: 0.8931729669247711
Energy: 0.8898632530167078
Energy: 0.8931729669254529
Energy: 0.8779902947210794
Energy: 1.003998154157532
Energy: 0.8779902947203975
Energy: 1.0039981541582137
Energy: 0.8779902947203975
Energy: 1.0039981541568501
Energy: 0.7757699601010014
Energy: 0.9083076388860838
Energy: 0.7757699601010014
Energy: 0.9083076388860838
Energy: 0.7757699601016833
Energy: 0.9083076388860838
Energy: 0.8088708393523811
Energy: 0.8612847880770705
Energy: 0.808870839353063
Energy: 0.8612847880763885
Energy: 0.8088708393516992
Energy: 0.8612847880770705
Energy: 0.8452371258148261
Energy: 0.9073182658335214
Energy: 0.8452371258134623
Energy: 0.9073182658335214
Energy: 0.8452371258148261
Energy: 0.9073182658342033
Energy: 0.9563173438213014
Energy: 1.007047029394916
Energy: 0.9563173438206195
Energy: 1.007047029394234
Energy: 0.9563173438199375
Energy: 1.007047029394916
Energy: 0.8937793662824707
Energy: 0.8605580014645496
Energy: 0.8937793662838345
Energy: 0.8605580014645496
Energy: 0.8937793662831525
Energy: 0.8605580014645496
Energy: 0.7717573725588975
Energy: 0.9055390863489017
Energy: 0.7717573725588975
Energy: 0.9055390863522491
Energy: 0.7717573725623071
Energy: 0.9055390863482198

minimum gb energy = 0.7717573725588975 eV
minimum distance =  2.31542953531901 Angstroms
sigma value = 43


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

Energy: 0.8771375518694835
Energy: 0.661027400987369
Energy: 0.8771375518655088
Energy: 0.6610274009814069
Energy: 0.8771375518650119
Energy: 0.661027400987369
Energy: 0.779781668462859
Energy: 0.7569097401012527
Energy: 0.7797816684653434
Energy: 0.7569097401012527
Energy: 0.779781668462859
Energy: 0.7569097401007558
Energy: 0.7327366172535946
Energy: 0.7614603908528809
Energy: 0.7327366172521041
Energy: 0.761460390852384
Energy: 0.7327366172535946
Energy: 0.7614603908533777
Energy: 0.8366608408696117
Energy: 0.7323743348496965
Energy: 0.8366608408696117
Energy: 0.7323743348501933
Energy: 0.8366608408815357
Energy: 0.7323743348496965
Energy: 0.7331204310617226
Energy: 0.7354664971811751
Energy: 0.7331204310627164
Energy: 0.7354664971821687
Energy: 0.7331204310622195
Energy: 0.7354664971811751
Energy: 0.7139092585893356
Energy: 0.7429425140830584
Energy: 0.713909258597285
Energy: 0.7429425140830584
Energy: 0.7139092585903294
Energy: 0.7429425140835553
Energy: 0.8226106717775111
Energy: 0.7141777749591242
Energy: 0.8226106717775111
Energy: 0.7141777749591242
Energy: 0.8226106717775111
Energy: 0.7141777749586273
Energy: 0.7816698995677106
Energy: 0.8098001535088074
Energy: 0.7816698995677106
Energy: 0.8098001535083107
Energy: 0.7816698995677106
Energy: 0.8098001535083107
Energy: 0.7009331747644465
Energy: 0.7357263677221959
Energy: 0.7009331747639497
Energy: 0.7357263677212021
Energy: 0.7009331747639497
Energy: 0.7357263677226927
Energy: 0.7383360071316255
Energy: 0.6916443619949882
Energy: 0.738336007130135
Energy: 0.6916443619949882
Energy: 0.7383360071311287
Energy: 0.6916443619934977
Energy: 0.8182333647053103
Energy: 0.8179510499913178
Energy: 0.8182333647058072
Energy: 0.8179510499923115
Energy: 0.818233364706304
Energy: 0.8179510499913178
Energy: 0.6682695320165933
Energy: 0.7346646267300285
Energy: 0.6682695320160965
Energy: 0.7346646267290349
Energy: 0.6682695320165933
Energy: 0.7346646267300285
Energy: 0.7384116128161751
Energy: 0.6681424422289146
Energy: 0.7384116128141878
Energy: 0.6681424422284178
Energy: 0.7384116128156782
Energy: 0.6681424422289146
Energy: 0.811858427334198
Energy: 0.8218516036980672
Energy: 0.8118584273351916
Energy: 0.8218516036975702
Energy: 0.8118584273337013
Energy: 0.8218516036980672
Energy: 0.6881981693476177
Energy: 0.73461683044685
Energy: 0.6881981693481145
Energy: 0.73461683044685
Energy: 0.6881981693466239
Energy: 0.73461683044685
Energy: 0.755527690857053
Energy: 0.712405420098631
Energy: 0.7555276908575499
Energy: 0.7124054200981341
Energy: 0.755527690857053
Energy: 0.7124054200981341
Energy: 0.8196099828752997
Energy: 0.8203950012843637
Energy: 0.8196099828748028
Energy: 0.8203950012853574
Energy: 0.8196099828752997
Energy: 0.8203950012848604
Energy: 0.7061562659644108
Energy: 0.8235802696872714
Energy: 0.706156265963914
Energy: 0.8235802696872714
Energy: 0.706156265963914
Energy: 0.8235802696877684
Energy: 0.7417145510369882
Energy: 0.7303836869645153
Energy: 0.7417145510364914
Energy: 0.7303836869645153
Energy: 0.7417145510369882
Energy: 0.7303836869645153
Energy: 0.8347432136367494
Energy: 0.7304075044419021
Energy: 0.8347432136382401
Energy: 0.7304075044414051
Energy: 0.8347432136362527
Energy: 0.7304075044419021
Energy: 0.7542012797028823
Energy: 0.8434554181530071
Energy: 0.7542012797023855
Energy: 0.8434554181569819
Energy: 0.7542012797018887
Energy: 0.8434554181564852
Energy: 0.7573621095276973
Energy: 0.7302876075461749
Energy: 0.7573621095267037
Energy: 0.7302876075466719
Energy: 0.7573621095272005
Energy: 0.730287607545678
Energy: 0.8529801092261192
Energy: 0.7301321460635872
Energy: 0.8529801092246286
Energy: 0.7301321460630904
Energy: 0.8529801092246286
Energy: 0.7301321460635872
Energy: 0.8050712787898565
Energy: 0.8394257151456801
Energy: 0.8050712787903535
Energy: 0.8394257151412086
Energy: 0.8050712787898565
Energy: 0.8394257151426991
Energy: 0.7402794568816319
Energy: 0.7270663047563366
Energy: 0.7402794568801413
Energy: 0.7270663047568334
Energy: 0.7402794568811351
Energy: 0.7270663047568334
Energy: 0.8202038114075036
Energy: 0.7236660307949881
Energy: 0.8202038114084973
Energy: 0.7236660307949881
Energy: 0.8202038114080006
Energy: 0.7236660307944913
Energy: 0.7338831772194833
Energy: 1.0186540492758482
Energy: 0.7338831772189864
Energy: 1.018654049276345
Energy: 0.7338831772209737
Energy: 1.018654049276345
Energy: 0.7219228378229515
Energy: 0.7231881337475856
Energy: 0.7219228378229515
Energy: 0.7231881337470888
Energy: 0.7219228378234483
Energy: 0.7231881337475856
Energy: 0.7351020664038043
Energy: 0.6990130207319943
Energy: 0.7351020664043011
Energy: 0.6990130207324912
Energy: 0.7351020664038043
Energy: 0.6990130207319943
Energy: 0.6827973401011901
Energy: 0.8862562947155946
Energy: 0.6827973400992028
Energy: 0.8862562947160914
Energy: 0.6827973400977123
Energy: 0.8862562947155946
Energy: 0.717469472609103
Energy: 0.7229634193993588
Energy: 0.7174694726086062
Energy: 0.7229634193998556
Energy: 0.7174694726095998
Energy: 0.7229634194003525
Energy: 0.7340988406135414
Energy: 0.6884788416575338
Energy: 0.734098840615032
Energy: 0.6884788416580307
Energy: 0.7340988406130445
Energy: 0.6884788416575338
Energy: 0.6646163830123286
Energy: 0.7259777867438509
Energy: 0.6646163830043792
Energy: 0.7259777867438509
Energy: 0.6646163830053728
Energy: 0.7259777867438509
Energy: 0.8174886417048802
Energy: 0.8917317230206707
Energy: 0.8174886417043833
Energy: 0.891731723020174
Energy: 0.817488641705377
Energy: 0.891731723020174
Energy: 0.732428160436887
Energy: 0.6671822063781044
Energy: 0.7324281604348997
Energy: 0.6671822063781044
Energy: 0.7324281604358933
Energy: 0.6671822063781044
Energy: 0.6223088644067886
Energy: 0.7252526341496512
Energy: 0.6223088644077822
Energy: 0.7252526341496512
Energy: 0.6223088644077822
Energy: 0.7252526341496512

minimum gb energy = 0.6223088644067886 eV
minimum distance =  2.30746872407912 Angstroms
sigma value = 81


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

Energy: 0.0390247406059306
Energy: 0.06475392340179438
Energy: 0.0390247406059306
Energy: 0.06475392339996888
Energy: 0.0390247406059306
Energy: 0.06475392340361989
Energy: 0.5288788834378478
Energy: 0.04213717522489704
Energy: 0.5288788834378478
Energy: 0.04213717524497762
Energy: 0.5288788834378478
Energy: 0.042137175246803125
Energy: 0.528923968453739
Energy: 0.04233103930276048
Energy: 0.5289239684555646
Energy: 0.04233103931006251
Energy: 0.5289239684555646
Energy: 0.042331039313713514
Energy: 0.0390247406059306
Energy: 0.06475392340179438
Energy: 0.039024740604105095
Energy: 0.06475392339996888
Energy: 0.0390247406059306
Energy: 0.06475392339996888
Energy: 0.5288788834378478
Energy: 0.04213717524862863
Energy: 0.5288788834378478
Energy: 0.04213717522124602
Energy: 0.5288788834378478
Energy: 0.04213717523585008
Energy: 0.528923968453739
Energy: 0.04233103914398285
Energy: 0.528923968453739
Energy: 0.04233103915858691
Energy: 0.5289239684555646
Energy: 0.04233103914215734
Energy: 0.0390247406059306
Energy: 0.06475392339996888
Energy: 0.039024740604105095
Energy: 0.06475392339814337
Energy: 0.039024740604105095
Energy: 0.06475392339814337
Energy: 0.5288788834378478
Energy: 0.04213717522489704
Energy: 0.5288788834378478
Energy: 0.042137175219420515
Energy: 0.5288788834378478
Energy: 0.042137175234024576
Energy: 0.5289239684555646
Energy: 0.04233103895238758
Energy: 0.5289239684555646
Energy: 0.04233103895238758
Energy: 0.5289239684555646
Energy: 0.04233103896151512
Energy: 0.0390247406059306
Energy: 0.06475392339814337
Energy: 0.039024740604105095
Energy: 0.06475392339631786
Energy: 0.039024740604105095
Energy: 0.06475392339996888

minimum gb energy = 0.039024740604105095 eV
minimum distance =  2.49149147076719 Angstroms
sigma value = 3


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

Energy: 0.606759478733872
Energy: 0.5913434549474749
Energy: 0.6067594787344184
Energy: 0.5913434549474749
Energy: 0.606759478733872
Energy: 0.5913434549480212
Energy: 0.5580548657767843
Energy: 0.5634660263175838
Energy: 0.5580548657767843
Energy: 0.5634660263175838
Energy: 0.5580548657773307
Energy: 0.56346602631813
Energy: 0.5838212853653943
Energy: 0.5643745132531796
Energy: 0.5838212853659407
Energy: 0.5643745132531796
Energy: 0.5838212853659407
Energy: 0.5643745132531796
Energy: 0.6305702180774857
Energy: 0.6490832075767836
Energy: 0.6305702180780319
Energy: 0.6490832075767836
Energy: 0.6305702180780319
Energy: 0.6490832075773298
Energy: 0.5483911400379972
Energy: 0.5637115210017267
Energy: 0.5483911400385435
Energy: 0.5637115210011804
Energy: 0.5483911400379972
Energy: 0.5637115210011804
Energy: 0.5803276451025917
Energy: 0.5627798108039029
Energy: 0.5803276451031381
Energy: 0.5627798108044492
Energy: 0.5803276451042305
Energy: 0.5627798108044492
Energy: 0.5687588224605461
Energy: 0.6399735745320222
Energy: 0.5687588224605461
Energy: 0.6399735745320222
Energy: 0.5687588224599999
Energy: 0.6399735745325684
Energy: 0.5508916888121773
Energy: 0.5644087521471672
Energy: 0.5508916888132699
Energy: 0.5644087521471672
Energy: 0.5508916888132699
Energy: 0.5644087521471672
Energy: 0.5901447798627671
Energy: 0.5733151639659132
Energy: 0.590144779862221
Energy: 0.5733151639653669
Energy: 0.5901447798644062
Energy: 0.5733151639659132
Energy: 0.5668257099998408
Energy: 0.6003784037697252
Energy: 0.5668257099998408
Energy: 0.6003784037697252
Energy: 0.5668257100003872
Energy: 0.6003784037697252
Energy: 0.6205106797037938
Energy: 0.5644442157869053
Energy: 0.6205106797032476
Energy: 0.5644442157863591
Energy: 0.6205106797037938
Energy: 0.5644442157874515
Energy: 0.6060092398579755
Energy: 0.6149657174321823
Energy: 0.6060092398568829
Energy: 0.6149657174321823
Energy: 0.6060092398574293
Energy: 0.614965717433275
Energy: 0.5631613252918907
Energy: 0.5654797526932813
Energy: 0.5631613252918907
Energy: 0.5654797526932813
Energy: 0.5631613252918907
Energy: 0.5654797526938276
Energy: 0.6413310596288987
Energy: 0.5849101410974102
Energy: 0.6413310596283524
Energy: 0.5849101410979565
Energy: 0.6413310596288987
Energy: 0.5849101410974102
Energy: 0.566687510812378
Energy: 0.5951928832391518
Energy: 0.5666875108134707
Energy: 0.595192883239698
Energy: 0.5666875108118318
Energy: 0.5951928832391518
Energy: 0.5614483668417954
Energy: 0.5516223305986333
Energy: 0.5614483668401565
Energy: 0.5516223305986333
Energy: 0.5614483668407029
Energy: 0.551622330598087
Energy: 0.5832021730255083
Energy: 0.5874412723526652
Energy: 0.5832021730255083
Energy: 0.5874412723526652
Energy: 0.5832021730260546
Energy: 0.5874412723526652
Energy: 0.5614330092703604
Energy: 0.5680002094429072
Energy: 0.5614330092709068
Energy: 0.5680002094434535
Energy: 0.5614330092703604
Energy: 0.5680002094434535
Energy: 0.5608227966656868
Energy: 0.5563242544445822
Energy: 0.5608227966656868
Energy: 0.5563242544440359
Energy: 0.5608227966656868
Energy: 0.5563242544413045
Energy: 0.5711290883247819
Energy: 0.6425606516578849
Energy: 0.5711290883247819
Energy: 0.6425606516589774
Energy: 0.5711290883247819
Energy: 0.6425606516589774
Energy: 0.5929091632961675
Energy: 0.551039706923241
Energy: 0.5929091632956213
Energy: 0.5510397069205095
Energy: 0.5929091632967138
Energy: 0.5510397069319817
Energy: 0.5725081980748463
Energy: 0.5519889056146517
Energy: 0.5725081980753924
Energy: 0.551988905615198
Energy: 0.5725081980753924
Energy: 0.5519889056146517
Energy: 0.6230846231063142
Energy: 0.5664500000880687
Energy: 0.6230846231068605
Energy: 0.5664500000880687
Energy: 0.6230846231063142
Energy: 0.5664500000880687
Energy: 0.5767224344638247
Energy: 0.5462042052269169
Energy: 0.5767224344632783
Energy: 0.5462042052274632
Energy: 0.5767224344632783
Energy: 0.5462042052258244
Energy: 0.5628258081786223
Energy: 0.5801315144813403
Energy: 0.5628258081775297
Energy: 0.5801315144868031
Energy: 0.5628258081780759
Energy: 0.5801315144802478
Energy: 0.5749531375472651
Energy: 0.5644430693483764
Energy: 0.5749531375467188
Energy: 0.5644430693483764
Energy: 0.5749531375472651
Energy: 0.5644430693489227
Energy: 0.6796962427444362
Energy: 0.5792811205133997
Energy: 0.6796962427444362
Energy: 0.5792811205139461
Energy: 0.67969624274389
Energy: 0.5792811205139461
Energy: 0.5668320625738447
Energy: 0.6003733446864165
Energy: 0.5668320625732983
Energy: 0.6003733446864165
Energy: 0.5668320625732983
Energy: 0.6003733446869628
Energy: 0.5811930851710863
Energy: 0.5634665774413815
Energy: 0.5811930851705399
Energy: 0.5634665774408353
Energy: 0.5811930851705399
Energy: 0.5634665774386501
Energy: 0.6660963577656348
Energy: 0.61592653344616
Energy: 0.6660963577541626
Energy: 0.61592653344616
Energy: 0.6660963577618108
Energy: 0.61592653344616
Energy: 0.5873873340409823
Energy: 0.5892201496316408
Energy: 0.5873873340415287
Energy: 0.5892201496316408
Energy: 0.5873873340415287
Energy: 0.5892201496316408
Energy: 0.6024744946293742
Energy: 0.5626845362677183
Energy: 0.6024744946299205
Energy: 0.5626845362682645
Energy: 0.6024744946304668
Energy: 0.5626845362688108
Energy: 0.5931124526262327
Energy: 0.5913959129395198
Energy: 0.5931124526262327
Energy: 0.5913959129395198
Energy: 0.5931124526273251
Energy: 0.5913959129400661

minimum gb energy = 0.5462042052258244 eV
minimum distance =  2.39137890745206 Angstroms
sigma value = 67


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

Energy: 0.7618677451301321
Energy: 0.8603536163752362
Energy: 0.761867745127797
Energy: 0.8603536163775715
Energy: 0.7618677451293537
Energy: 0.8603536163729011
Energy: 0.7298175847636739
Energy: 0.7370685591719289
Energy: 0.7298175847644522
Energy: 0.7370685591719289
Energy: 0.7298175847644522
Energy: 0.7370685591727073
Energy: 0.7795457160685543
Energy: 0.7358487737625078
Energy: 0.7795457160669974
Energy: 0.7358487737625078
Energy: 0.7795457160662191
Energy: 0.7358487737625078
Energy: 0.7527452588171829
Energy: 0.8607382525417443
Energy: 0.7527452588179613
Energy: 0.8607382525425228
Energy: 0.7527452588171829
Energy: 0.8607382525425228
Energy: 0.7481543314197219
Energy: 0.7509944908485378
Energy: 0.7481543314181651
Energy: 0.7509944908485378
Energy: 0.7481543314189435
Energy: 0.7509944908477593
Energy: 0.7767680990071428
Energy: 0.752270210258176
Energy: 0.7767680990079213
Energy: 0.7522702102566191
Energy: 0.7767680990063645
Energy: 0.7522702102573975
Energy: 0.744916812177944
Energy: 0.8404703164624511
Energy: 0.7449168121756089
Energy: 0.8404703164624511
Energy: 0.7449168121787224
Energy: 0.8404703164624511
Energy: 0.8066287023172953
Energy: 0.7586874490287729
Energy: 0.8066287023172953
Energy: 0.7586874490287729
Energy: 0.8066287023172953
Energy: 0.7586874490295513
Energy: 0.7990138629428697
Energy: 0.8105339456233612
Energy: 0.7990138629428697
Energy: 0.8105339456225826
Energy: 0.7990138629420912
Energy: 0.8105339456233612
Energy: 0.7393612132469034
Energy: 0.7152961776953469
Energy: 0.7393612132469034
Energy: 0.7152961776953469
Energy: 0.7393612132469034
Energy: 0.7152961776945685
Energy: 0.8273275759536949
Energy: 0.7573016550159267
Energy: 0.8273275759544734
Energy: 0.7573016550159267
Energy: 0.8273275759536949
Energy: 0.7573016550159267
Energy: 0.7393422183109506
Energy: 0.7647285874277887
Energy: 0.7393422183101722
Energy: 0.7647285874277887
Energy: 0.7393422183086155
Energy: 0.7647285874277887
Energy: 0.7379652875826862
Energy: 0.7409576111464751
Energy: 0.7379652875826862
Energy: 0.7409576111418047
Energy: 0.7379652875826862
Energy: 0.7409576111464751
Energy: 0.7616725333688564
Energy: 0.7536558631111538
Energy: 0.7616725333680779
Energy: 0.7536558631127106
Energy: 0.7616725333688564
Energy: 0.7536558631119322
Energy: 0.7732705826554704
Energy: 0.7241576861194112
Energy: 0.773270582654692
Energy: 0.7241576861194112
Energy: 0.7732705826554704
Energy: 0.7241576861194112
Energy: 0.7486866678381985
Energy: 0.7394293458272604
Energy: 0.7486866678381985
Energy: 0.7394293458272604
Energy: 0.7486866678381985
Energy: 0.7394293458272604
Energy: 0.7775212808683943
Energy: 0.7404077339353212
Energy: 0.777521280867616
Energy: 0.7404077339345428
Energy: 0.7775212808699513
Energy: 0.7404077339353212
Energy: 0.7337936855449628
Energy: 0.7209698257945774
Energy: 0.7337936855410707
Energy: 0.7209698257945774
Energy: 0.733793685543406
Energy: 0.7209698257945774
Energy: 0.746127913847975
Energy: 0.7789543434706
Energy: 0.7461279138487533
Energy: 0.7789543434713785
Energy: 0.746127913847975
Energy: 0.7789543434713785
Energy: 0.7389705592921859
Energy: 0.7368544758855895
Energy: 0.7389705592937428
Energy: 0.7368544758855895
Energy: 0.7389705592937428
Energy: 0.7368544758855895
Energy: 0.7818432133833083
Energy: 0.7871071507219694
Energy: 0.7818432133833083
Energy: 0.7871071507227478
Energy: 0.7818432133840867
Energy: 0.7871071507235261
Energy: 0.7629368144403971
Energy: 0.8126482547603967
Energy: 0.7629368144403971
Energy: 0.8126482547619536
Energy: 0.7629368144411756
Energy: 0.8126482547611753
Energy: 0.7706222482077996
Energy: 0.7361416607484705
Energy: 0.7706222482062428
Energy: 0.7361416607500274
Energy: 0.770622248208578
Energy: 0.7361416607515842

minimum gb energy = 0.7152961776945685 eV
minimum distance =  2.39396549372014 Angstroms
sigma value = 33


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

Energy: 0.8799117958222038
Energy: 0.9756199284406459
Energy: 0.8799117958207224
Energy: 0.9756199284416336
Energy: 0.8799117958212164
Energy: 0.9756199284406459
Energy: 0.8541192362911267
Energy: 0.8652502135689989
Energy: 0.8541192362901392
Energy: 0.8652502135685052
Energy: 0.8541192362906329
Energy: 0.8652502135685052
Energy: 0.8787865847582318
Energy: 0.8637552389569138
Energy: 0.8787865847597132
Energy: 0.8637552389559261
Energy: 0.8787865847577379
Energy: 0.8637552389569138
Energy: 0.8735750510228399
Energy: 0.9548484263564478
Energy: 0.8735750510223462
Energy: 0.9548484263564478
Energy: 0.8735750510233339
Energy: 0.9548484263564478
Energy: 0.8979259646087504
Energy: 0.8748791787556828
Energy: 0.8979259646087504
Energy: 0.8748791787556828
Energy: 0.8979259646092441
Energy: 0.8748791787556828
Energy: 0.9480224973325642
Energy: 0.9286138603857622
Energy: 0.9480224973315766
Energy: 0.9286138603867499
Energy: 0.9480224973315766
Energy: 0.9286138603862562
Energy: 0.8699975464971768
Energy: 0.8892182314960275
Energy: 0.8699975464981644
Energy: 0.8892182314970151
Energy: 0.8699975464966829
Energy: 0.8892182314965213
Energy: 0.9612912059828246
Energy: 0.8939668644788312
Energy: 0.9612912059838121
Energy: 0.8939668644788312
Energy: 0.9612912059823306
Energy: 0.8939668644788312
Energy: 0.8959954981482686
Energy: 0.9253675632834679
Energy: 0.8959954981482686
Energy: 0.9253675632824803
Energy: 0.8959954981492563
Energy: 0.9253675632819865
Energy: 0.8647768861511483
Energy: 1.0122667893402486
Energy: 0.8647768861516422
Energy: 1.0122667893407424
Energy: 0.8647768861516422
Energy: 1.0122667893412363
Energy: 0.9480306453624169
Energy: 0.8774706410698166
Energy: 0.9480306453629106
Energy: 0.8774706410698166
Energy: 0.9480306453619229
Energy: 0.8774706410698166
Energy: 0.9103278207886474
Energy: 0.8692709684182368
Energy: 0.9103278207886474
Energy: 0.8692709684182368
Energy: 0.9103278207886474
Energy: 0.8692709684187306
Energy: 0.866782589158762
Energy: 0.8575127555243172
Energy: 0.8667825891597496
Energy: 0.857512755524811
Energy: 0.8667825891592558
Energy: 0.857512755524811
Energy: 0.8729763090315269
Energy: 0.8657885902318009
Energy: 0.8729763090330084
Energy: 0.8657885902278505
Energy: 0.872976309033996
Energy: 0.8657885902308133
Energy: 0.8600968369751838
Energy: 0.9288275497922769
Energy: 0.8600968369682706
Energy: 0.928827549791783
Energy: 0.8600968369717271
Energy: 0.9288275497922769
Energy: 0.8735901999203357
Energy: 0.9129017909575482
Energy: 0.8735901999183605
Energy: 0.9129017909590296
Energy: 0.873590199919348
Energy: 0.9129017909575482
Energy: 0.9044508664152657
Energy: 0.8643720406447346
Energy: 0.9044508664157597
Energy: 0.864372040646216
Energy: 0.9044508664162534
Energy: 0.8643720406432532
Energy: 0.9109176303835256
Energy: 0.9435990794436233
Energy: 0.9109176303815504
Energy: 0.9435990794441171
Energy: 0.9109176303840193
Energy: 0.9435990794455985
Energy: 0.8505196986549538
Energy: 0.9430436474927454
Energy: 0.8505196986628547
Energy: 0.9430436474927454
Energy: 0.8505196986559415
Energy: 0.943043647491264
Energy: 0.9056028233704894
Energy: 0.8656865823226984
Energy: 0.9056028233704894
Energy: 0.865686582320723
Energy: 0.9056028233704894
Energy: 0.865686582320723
Energy: 0.8698424145431174
Energy: 0.9097823348893347
Energy: 0.8698424145426236
Energy: 0.9097823348878532
Energy: 0.8698424145450925
Energy: 0.9097823348878532
Energy: 0.8596079570307489
Energy: 0.8742891805601358
Energy: 0.8596079570322303
Energy: 0.8742891805601358
Energy: 0.8596079570307489
Energy: 0.8742891805601358
Energy: 0.9338695111653241
Energy: 0.8774988199688629
Energy: 0.9338695111677934
Energy: 0.8774988199693566
Energy: 0.9338695111682871
Energy: 0.8774988199688629
Energy: 0.8644028443252306
Energy: 0.8673823004268796
Energy: 0.8644028443257243
Energy: 0.8673823004268796
Energy: 0.8644028443247367
Energy: 0.867382300425892
Energy: 0.8699319602669359
Energy: 0.8660902955771425
Energy: 0.8699319602664422
Energy: 0.8660902955771425
Energy: 0.8699319602669359
Energy: 0.866090295576155
Energy: 1.0399954118732055
Energy: 0.889066566670576
Energy: 1.0399954118732055
Energy: 0.889066566670576
Energy: 1.0399954118727117
Energy: 0.8890665666700823
Energy: 0.8701659117883513
Energy: 0.87587458687135
Energy: 0.8701659117883513
Energy: 0.8758745868708562
Energy: 0.8701659117888451
Energy: 0.8758745868708562
Energy: 0.8769638887146396
Energy: 0.9560742107412944
Energy: 0.8769638887146396
Energy: 0.9560742107408007
Energy: 0.8769638887151333
Energy: 0.9560742107393192
Energy: 0.9969721423842955
Energy: 0.8757574679101314
Energy: 0.9969721423847893
Energy: 0.8757574679091438
Energy: 0.9969721423847893
Energy: 0.8757574679086501
Energy: 0.8720174485238367
Energy: 0.8900594816929334
Energy: 0.8720174485238367
Energy: 0.8900594816934273
Energy: 0.8720174485213675
Energy: 0.8900594816934273
Energy: 0.9433488485619196
Energy: 0.9413466623659227
Energy: 0.9433488485629071
Energy: 0.9413466623683916
Energy: 0.9433488485619196
Energy: 0.941346662369873
Energy: 0.8992138254155804
Energy: 0.8654433425524707
Energy: 0.8992138254155804
Energy: 0.865443342551483
Energy: 0.8992138254155804
Energy: 0.8654433425500015
Energy: 0.8696252946993609
Energy: 0.9870062262485813
Energy: 0.8696252946973858
Energy: 0.9870062262485813
Energy: 0.8696252946983735
Energy: 0.9870062262485813
Energy: 0.8570277218105137
Energy: 0.8656759558643566
Energy: 0.8570277218115013
Energy: 0.8656759558648506
Energy: 0.8570277218105137
Energy: 0.8656759558648506
Energy: 0.8685815284343167
Energy: 0.8634615819112066
Energy: 0.8685815284338227
Energy: 0.8634615819097253
Energy: 0.8685815284338227
Energy: 0.8634615819087376
Energy: 0.867494647476672
Energy: 0.8631265403908016
Energy: 0.8674946474742031
Energy: 0.8631265403903078
Energy: 0.8674946474737093
Energy: 0.8631265403898141
Energy: 0.853510015113038
Energy: 0.8569920062343209
Energy: 0.8535100151125443
Energy: 0.8569920062333335
Energy: 0.853510015113038
Energy: 0.8569920062353086

minimum gb energy = 0.8505196986549538 eV
minimum distance =  2.38062007089386 Angstroms
sigma value = 41


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

Energy: 1.0762204219465779
Energy: 1.089875131704912
Energy: 1.076220421947926
Energy: 1.089875131707547
Energy: 1.076220421947926
Energy: 1.089875131704912
Energy: 1.0845412625173854
Energy: 1.079681404589254
Energy: 1.0845412625173854
Energy: 1.0796814045906022
Energy: 1.0845412625173854
Energy: 1.0796814045906022
Energy: 1.1400285098173242
Energy: 1.0736056202608655
Energy: 1.1400285098186722
Energy: 1.0736056202608655
Energy: 1.1400285098173242
Energy: 1.0736056202608655
Energy: 1.0654517976612599
Energy: 1.1525651829386643
Energy: 1.0654517976612599
Energy: 1.1525651829386643
Energy: 1.0654517976612599
Energy: 1.1525651829386643
Energy: 1.1243773307374034
Energy: 1.0897355994895501
Energy: 1.1243773307387515
Energy: 1.0897355994895501
Energy: 1.1243773307374034
Energy: 1.0897355994882019
Energy: 1.1741247311865803
Energy: 1.1763865339516526
Energy: 1.174124731185232
Energy: 1.1763865339516526
Energy: 1.1741247311865803
Energy: 1.1763865339516526
Energy: 1.0606250592549666
Energy: 1.0877745103057415
Energy: 1.0606250592549666
Energy: 1.0877745103057415
Energy: 1.0606250592536184
Energy: 1.0877745103057415
Energy: 1.0991570304715867
Energy: 1.080159318224054
Energy: 1.0991570304702387
Energy: 1.0801593182227058
Energy: 1.0991570304702387
Energy: 1.080159318224054
Energy: 1.0869292548699319
Energy: 1.0822716059044937
Energy: 1.0869292548685838
Energy: 1.0822716059044937
Energy: 1.0869292548685838
Energy: 1.0822716059044937
Energy: 1.0659754844899985
Energy: 1.1072502248310137
Energy: 1.0659754844899985
Energy: 1.1072502248323615
Energy: 1.0659754844886502
Energy: 1.1072502248323615
Energy: 1.0832326268533412
Energy: 1.0739034085653794
Energy: 1.083232626857386
Energy: 1.0739034085653794
Energy: 1.083232626857386
Energy: 1.0739034085653794
Energy: 1.0974698876721156
Energy: 1.0793886513777629
Energy: 1.0974698876707676
Energy: 1.0793886513791109
Energy: 1.0974698876707676
Energy: 1.0793886513777629
Energy: 1.091598637832287
Energy: 1.1498891770286084
Energy: 1.0915986378309388
Energy: 1.1498891770286084
Energy: 1.091598637832287
Energy: 1.1498891770299569
Energy: 1.1221627814126949
Energy: 1.0800204649462994
Energy: 1.1221627814126949
Energy: 1.0800204649462994
Energy: 1.1221627814126949
Energy: 1.0800204649462994

minimum gb energy = 1.0606250592536184 eV
minimum distance =  2.36963020059884 Angstroms
sigma value = 11


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

Energy: 1.2984373382448369
Energy: 1.3122800019116747
Energy: 1.2984373382448369
Energy: 1.3122800019116747
Energy: 1.2984373382442445
Energy: 1.3122800019116747
Energy: 1.2923569197465237
Energy: 1.2639286761626836
Energy: 1.2923569197465237
Energy: 1.2639286761626836
Energy: 1.2923569197465237
Energy: 1.2639286761626836
Energy: 1.370040987315203
Energy: 1.2636900902020887
Energy: 1.370040987316388
Energy: 1.2636900902020887
Energy: 1.3700409873157955
Energy: 1.2636900902020887
Energy: 1.2587953756061443
Energy: 1.3384750356707187
Energy: 1.2587953756061443
Energy: 1.3384750356707187
Energy: 1.2587953756061443
Energy: 1.3384750356707187
Energy: 1.3488922996147001
Energy: 1.2920615576770391
Energy: 1.3488922996147001
Energy: 1.2920615576770391
Energy: 1.3488922996158847
Energy: 1.2920615576770391
Energy: 1.2659699555416073
Energy: 1.3180221592591128
Energy: 1.265969955541015
Energy: 1.3180221592597048
Energy: 1.265969955541015
Energy: 1.3180221592591128
Energy: 1.2780660731864273
Energy: 1.3312622262142697
Energy: 1.2780660731864273
Energy: 1.3312622262142697
Energy: 1.2780660731870197
Energy: 1.3312622262142697
Energy: 1.3033828365152034
Energy: 1.2588243255708098
Energy: 1.3033828365157956
Energy: 1.2588243255708098
Energy: 1.3033828365157956
Energy: 1.2588243255708098
Energy: 1.3035328987120463
Energy: 1.2584650012209724
Energy: 1.3035328987120463
Energy: 1.2584650012209724
Energy: 1.3035328987120463
Energy: 1.2584650012209724
Energy: 1.2709904753174486
Energy: 1.3695747877761808
Energy: 1.2709904753174486
Energy: 1.3695747877761808
Energy: 1.2709904753168562
Energy: 1.3695747877767732
Energy: 1.32392634558669
Energy: 1.2912642380910677
Energy: 1.32392634558669
Energy: 1.29126423809166
Energy: 1.323926345586098
Energy: 1.29126423809166
Energy: 1.3227633933507037
Energy: 1.3367140042481571
Energy: 1.3227633933507037
Energy: 1.3367140042475647
Energy: 1.3227633933507037
Energy: 1.3367140042475647
Energy: 1.2581575926363056
Energy: 1.3181000208840696
Energy: 1.2581575926368977
Energy: 1.3181000208840696
Energy: 1.2581575926363056
Energy: 1.3181000208840696
Energy: 1.3641306769522363
Energy: 1.258742023248209
Energy: 1.3641306769522363
Energy: 1.258742023248209
Energy: 1.3641306769522363
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Energy: 1.3036866892590457
Energy: 1.2731004698079533
Energy: 1.3036866892590457
Energy: 1.2731004698079533
Energy: 1.3036866892590457
Energy: 1.2731004698079533
Energy: 1.2798326841403798
Energy: 1.3365489171286458
Energy: 1.2798326841397876
Energy: 1.3365489171286458
Energy: 1.2798326841403798
Energy: 1.3365489171286458
Energy: 1.314022437560238
Energy: 1.2792537150120293
Energy: 1.314022437560238
Energy: 1.2792537150120293
Energy: 1.314022437560238
Energy: 1.2792537150120293
Energy: 1.303275787859466
Energy: 1.322823981280815
Energy: 1.3032757878588739
Energy: 1.322823981280815
Energy: 1.3032757878588739
Energy: 1.322823981281407
Energy: 1.271568501310961
Energy: 1.3169902206723072
Energy: 1.2715685013103686
Energy: 1.3169902206717148
Energy: 1.271568501310961
Energy: 1.3169902206711226
Energy: 1.3198754334162444
Energy: 1.2897331628811162
Energy: 1.319875433415652
Energy: 1.2897331628817081
Energy: 1.3198754334168366
Energy: 1.2897331628811162
Energy: 1.2514231546809196
Energy: 1.304591003100372
Energy: 1.2514231546809196
Energy: 1.3045910030997798
Energy: 1.2514231546815116
Energy: 1.3045910030997798
Energy: 1.2663630416592584
Energy: 1.3301572905151797
Energy: 1.2663630416592584
Energy: 1.3301572905145875
Energy: 1.2663630416592584
Energy: 1.3301572905139951
Energy: 1.3336194528996415
Energy: 1.2640244264112364
Energy: 1.333619452899049
Energy: 1.2640244264112364
Energy: 1.3336194528996415
Energy: 1.2640244264112364
Energy: 1.3257002272852831
Energy: 1.2642124564009307
Energy: 1.3257002272852831
Energy: 1.2642124564009307
Energy: 1.3257002272858753
Energy: 1.2642124564009307
Energy: 1.2934371410554946
Energy: 1.3417702916120837
Energy: 1.2934371410549022
Energy: 1.3417702916120837
Energy: 1.2934371410554946
Energy: 1.3417702916120837
Energy: 1.3359691186419853
Energy: 1.2896070616134607
Energy: 1.335969118641393
Energy: 1.2896070616134607
Energy: 1.335969118641393
Energy: 1.2896070616134607
Energy: 1.265475307848452
Energy: 1.3568192049553385
Energy: 1.265475307848452
Energy: 1.3568192049553385
Energy: 1.265475307848452
Energy: 1.3568192049553385
Energy: 1.258633570200282
Energy: 1.296511481274054
Energy: 1.2586335701996896
Energy: 1.2965114812734615
Energy: 1.2586335701996896
Energy: 1.2965114812734615
Energy: 1.3075103272164585
Energy: 1.2790485950482207
Energy: 1.3075103272158661
Energy: 1.2790485950488126
Energy: 1.3075103272164585
Energy: 1.2790485950482207
Energy: 1.281967669365783
Energy: 1.2595704708660465
Energy: 1.2819676693663753
Energy: 1.2595704708666389
Energy: 1.2819676693663753
Energy: 1.2595704708660465
Energy: 1.271170728132512
Energy: 1.360239495097588
Energy: 1.2711707281319198
Energy: 1.3602394950981802
Energy: 1.271170728132512
Energy: 1.3602394950964036

minimum gb energy = 1.2514231546809196 eV
minimum distance =  2.34943585317152 Angstroms
sigma value = 57


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

Energy: 1.3182823587731725
Energy: 1.4372628333386175
Energy: 1.3182823587752803
Energy: 1.4372628333386175
Energy: 1.3182823587731725
Energy: 1.4372628333386175
Energy: 1.3182642753214355
Energy: 1.3799952149307009
Energy: 1.3182642753235434
Energy: 1.379995214929647
Energy: 1.3182642753193277
Energy: 1.3799952149307009
Energy: 1.4369784472202627
Energy: 1.3835482058047734
Energy: 1.4369784472223706
Energy: 1.3835482058047734
Energy: 1.4369784472149931
Energy: 1.3835482058047734
Energy: 1.3038590463582216
Energy: 1.4034425981861713
Energy: 1.3038590463572155
Energy: 1.4034425981861713
Energy: 1.3038590463572155
Energy: 1.4034425981861713
Energy: 1.4372228223304433
Energy: 1.3835572684181292
Energy: 1.4372228223293892
Energy: 1.3835572684191835
Energy: 1.4372228223293892
Energy: 1.3835572684191835
Energy: 1.3182511650312971
Energy: 1.4300611130396634
Energy: 1.318251165033405
Energy: 1.4300611130396634
Energy: 1.3182511650323512
Energy: 1.4300611130396634
Energy: 1.3182823587731725
Energy: 1.4372628333396715
Energy: 1.3182823587721186
Energy: 1.4372628333396715
Energy: 1.3182823587731725
Energy: 1.4372628333396715
Energy: 1.3182642753203815
Energy: 1.379995214933863
Energy: 1.3182642753193277
Energy: 1.379995214933863
Energy: 1.3182642753214355
Energy: 1.379995214933863
Energy: 1.4369784472265865
Energy: 1.3835482058047734
Energy: 1.436978447218155
Energy: 1.3835482058058273
Energy: 1.4369784472213167
Energy: 1.3835482058058273
Energy: 1.3038590463540536
Energy: 1.4622854939683696
Energy: 1.3038590463540536
Energy: 1.4622854939694234
Energy: 1.3038590463540536
Energy: 1.4622854939704775
Energy: 1.4372228223325514
Energy: 1.383557268423399
Energy: 1.4372228223325514
Energy: 1.3835572684244533
Energy: 1.4372228223314971
Energy: 1.3835572684244533
Energy: 1.318251165033405
Energy: 1.4300611130449332
Energy: 1.3182511650344593
Energy: 1.4300611130449332
Energy: 1.318251165033405
Energy: 1.4300611130449332
Energy: 1.3182823587742263
Energy: 1.4372628333386175
Energy: 1.3182823587752803
Energy: 1.4372628333396715
Energy: 1.3182823587742263
Energy: 1.4372628333396715
Energy: 1.3182642753172198
Energy: 1.3799952149307009
Energy: 1.3182642753182736
Energy: 1.379995214931755
Energy: 1.3182642753214355
Energy: 1.3799952149307009
Energy: 1.4369784472286944
Energy: 1.3835482058047734
Energy: 1.4369784472276406
Energy: 1.3835482058047734
Energy: 1.4369784472244784
Energy: 1.3835482058047734
Energy: 1.3038590463582216
Energy: 1.4622854939673153
Energy: 1.3038590463582216
Energy: 1.4622854939683696
Energy: 1.3038590463582216
Energy: 1.4622854939673153
Energy: 1.4372228223304433
Energy: 1.3835572684181292
Energy: 1.4372228223314971
Energy: 1.3835572684181292
Energy: 1.4372228223293892
Energy: 1.3835572684191835

minimum gb energy = 1.3038590463540536 eV
minimum distance =  2.37570060097737 Angstroms
sigma value = 9


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

Energy: 1.3761811505111161
Energy: 1.4180544572051847
Energy: 1.3761811505102557
Energy: 1.4180544572051847
Energy: 1.376181150509395
Energy: 1.4180544572051847
Energy: 1.3929807963396708
Energy: 1.3962905093763203
Energy: 1.3929807963405314
Energy: 1.3962905093754596
Energy: 1.3929807963405314
Energy: 1.3962905093754596
Energy: 1.4148974917751038
Energy: 1.3778571643960753
Energy: 1.4148974917751038
Energy: 1.3778571643960753
Energy: 1.4148974917751038
Energy: 1.3778571643960753
Energy: 1.3718748576256057
Energy: 1.4956199661345506
Energy: 1.3718748576256057
Energy: 1.4956199661345506
Energy: 1.3718748576264663
Energy: 1.4956199661345506
Energy: 1.4332474675992428
Energy: 1.4032185108979933
Energy: 1.4332474675983824
Energy: 1.4032185108979933
Energy: 1.4332474675992428
Energy: 1.4032185108979933
Energy: 1.458986467629385
Energy: 1.3734864727583744
Energy: 1.4589864676302458
Energy: 1.3734864727583744
Energy: 1.458986467629385
Energy: 1.3734864727583744
Energy: 1.371865714039319
Energy: 1.4144636898364245
Energy: 1.3718657140401795
Energy: 1.414463689835564
Energy: 1.371865714039319
Energy: 1.4144636898364245
Energy: 1.4078276201169655
Energy: 1.3936616476446395
Energy: 1.4078276201186863
Energy: 1.3936616476446395
Energy: 1.407827620117826
Energy: 1.3936616476446395
Energy: 1.4635554681283611
Energy: 1.3756400744299262
Energy: 1.4635554681275007
Energy: 1.3756400744299262
Energy: 1.4635554681275007
Energy: 1.3756400744299262
Energy: 1.3725931482481575
Energy: 1.425549997269797
Energy: 1.3725931482490181
Energy: 1.425549997269797
Energy: 1.3725931482490181
Energy: 1.425549997269797
Energy: 1.4185255570666826
Energy: 1.3940045656016307
Energy: 1.4185255570666826
Energy: 1.3940045656016307
Energy: 1.4185255570658222
Energy: 1.3940045656016307
Energy: 1.4433075547672212
Energy: 1.3940882230713076
Energy: 1.4433075547672212
Energy: 1.3940882230713076
Energy: 1.4433075547672212
Energy: 1.3940882230695868
Energy: 1.3759361641736993
Energy: 1.4792048184856585
Energy: 1.3759361641736993
Energy: 1.4792048184856585
Energy: 1.3759361641736993
Energy: 1.479204818484798
Energy: 1.3986700510110734
Energy: 1.4179558862400485
Energy: 1.3986700510110734
Energy: 1.4179558862400485
Energy: 1.3986700510102128
Energy: 1.417955886239188
Energy: 1.415016376742202
Energy: 1.3700060719645184
Energy: 1.4150163767413415
Energy: 1.3700060719645184
Energy: 1.4150163767413415
Energy: 1.3700060719645184
Energy: 1.3869653156456083
Energy: 1.4662942547925883
Energy: 1.3869653156456083
Energy: 1.4662942547925883
Energy: 1.3869653156456083
Energy: 1.4662942547925883
Energy: 1.4198716727246359
Energy: 1.411034766770042
Energy: 1.4198716727246359
Energy: 1.411034766770042
Energy: 1.4198716727246359
Energy: 1.411034766770042
Energy: 1.5579363241212525
Energy: 1.3942358586355024
Energy: 1.5579363241203918
Energy: 1.3942358586346415
Energy: 1.5579363241212525
Energy: 1.3942358586355024
Energy: 1.3799702542933374
Energy: 1.4149700510610876
Energy: 1.3799702542933374
Energy: 1.4149700510619483
Energy: 1.3799702542933374
Energy: 1.4149700510619483
Energy: 1.4105445882882222
Energy: 1.4018309427509053
Energy: 1.4105445882873615
Energy: 1.4018309427517657
Energy: 1.4105445882882222
Energy: 1.4018309427517657
Energy: 1.4422141245310238
Energy: 1.407072421025681
Energy: 1.4422141245310238
Energy: 1.407072421025681
Energy: 1.4422141245301634
Energy: 1.407072421025681

minimum gb energy = 1.3700060719645184 eV
minimum distance =  2.33567580654136 Angstroms
sigma value = 27


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

Energy: 1.4918423754289232
Energy: 1.4101670450214259
Energy: 1.4286723257955138
Energy: 1.4101670450192496
Energy: 1.4918423754289232
Energy: 1.4101670450062256
Energy: 1.5182617353725518
Energy: 1.3362773645361654
Energy: 1.5182617353740024
Energy: 1.3362773645368908
Energy: 1.5182617353725518
Energy: 1.3362773645397923
Energy: 1.3510467001223512
Energy: 1.4197161354159331
Energy: 1.3510467001230768
Energy: 1.4197161354159331
Energy: 1.3510467001223512
Energy: 1.4197161354166585
Energy: 1.3887930966210247
Energy: 1.415714130159517
Energy: 1.38879309662175
Energy: 1.4157141301602427
Energy: 1.3887930966210247
Energy: 1.4157141301587919
Energy: 1.3869656893062101
Energy: 1.473735621949077
Energy: 1.3869656893083864
Energy: 1.473735621949077
Energy: 1.3869656893062101
Energy: 1.4737356219512532
Energy: 1.454167126371324
Energy: 1.4848708529129953
Energy: 1.4541671263684224
Energy: 1.4848708529129953
Energy: 1.4541671263705986
Energy: 1.484870852908643
Energy: 1.410519782036689
Energy: 1.4730193828035416
Energy: 1.4105197820359636
Energy: 1.4730193828042668
Energy: 1.4105197820374145
Energy: 1.4730193828064428
Energy: 1.5173784252121796
Energy: 1.3443511254909604
Energy: 1.5173784252092781
Energy: 1.344351125493862
Energy: 1.5173784252121796
Energy: 1.3443511254924112
Energy: 1.5282248772191889
Energy: 1.3917110880531218
Energy: 1.5305612666091155
Energy: 1.391711088053847
Energy: 1.5282248772184635
Energy: 1.391711088051671
Energy: 1.5166978129250928
Energy: 1.3847797070903056
Energy: 1.5169669174354048
Energy: 1.3847797070903056
Energy: 1.5166978129250928
Energy: 1.3847797070881294
Energy: 1.526496626592998
Energy: 1.37979514587928
Energy: 1.5267701113267438
Energy: 1.3797951458800055
Energy: 1.5264966265937232
Energy: 1.3797951458850835
Energy: 1.464121328768308
Energy: 1.3880953876483098
Energy: 1.464121328768308
Energy: 1.3880953876475843
Energy: 1.4641213287690333
Energy: 1.3880953876475843
Energy: 1.3391739962692817
Energy: 1.439569813183486
Energy: 1.3391739978056758
Energy: 1.439569813183486
Energy: 1.3391739963425124
Energy: 1.439569813179859
Energy: 1.4112995841219766
Energy: 1.3871676843874043
Energy: 1.411299584124878
Energy: 1.3871676843874043
Energy: 1.4112995841219766
Energy: 1.3871676843859537
Energy: 1.4817817868396645
Energy: 1.4449919580524428
Energy: 1.4834827765077025
Energy: 1.4449919580524428
Energy: 1.4817817868382137
Energy: 1.4449919580538937
Energy: 1.363673680833218
Energy: 1.4540464880117296
Energy: 1.3636736808339434
Energy: 1.4540464880117296
Energy: 1.3636736808324925
Energy: 1.4540464880117296
Energy: 1.446249483741358
Energy: 1.347694994192899
Energy: 1.4462494837399071
Energy: 1.347694994192899
Energy: 1.446249483741358
Energy: 1.347694994192899
Energy: 1.4494771854838833
Energy: 1.439291512895473
Energy: 1.4494771854831578
Energy: 1.4392915128961985
Energy: 1.4494771854838833
Energy: 1.4392915128991
Energy: 1.448324960717633
Energy: 1.3885465146275553
Energy: 1.32781664307906
Energy: 1.3885465146275553
Energy: 1.4483249607183584
Energy: 1.388546514629006
Energy: 1.4918423754310994
Energy: 1.4101670450112704
Energy: 1.428672325794063
Energy: 1.4101670450134467
Energy: 1.4918423754318246
Energy: 1.4101670450221513
Energy: 1.5182617353703753
Energy: 1.3362773645361654
Energy: 1.518261735371101
Energy: 1.3362773645361654
Energy: 1.5182617353681993
Energy: 1.3362773645368908
Energy: 1.3510467001172737
Energy: 1.4197161354159331
Energy: 1.3510467001187243
Energy: 1.419716135413757
Energy: 1.3510467001172737
Energy: 1.4197161354108554
Energy: 1.3887930966202993
Energy: 1.415714130159517
Energy: 1.3887930966202993
Energy: 1.4157141301580665
Energy: 1.3887930966202993
Energy: 1.4157141301558902
Energy: 1.3869656893091118
Energy: 1.4737356219498023
Energy: 1.3869656893105624
Energy: 1.4737356219498023
Energy: 1.3869656893091118
Energy: 1.4737356219519786
Energy: 1.4541671263727745
Energy: 1.4848708529137207
Energy: 1.4541671263698732
Energy: 1.4848708529137207
Energy: 1.4541671263735
Energy: 1.484870852908643

minimum gb energy = 1.32781664307906 eV
minimum distance =  2.29815976092785 Angstroms
sigma value = 19


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

Energy: 1.4068447686408379
Energy: 1.3545027746603153
Energy: 1.4068447686408379
Energy: 1.3545027746603153
Energy: 1.406844768641464
Energy: 1.3545027746603153
Energy: 1.3213949930991946
Energy: 1.34961522649546
Energy: 1.3213949930985684
Energy: 1.34961522649546
Energy: 1.3213949930985684
Energy: 1.34961522649546
Energy: 1.3369228213259576
Energy: 1.3715678542224685
Energy: 1.3369228213265836
Energy: 1.3715678542224685
Energy: 1.3369228213259576
Energy: 1.3715678542224685
Energy: 1.3632034803013708
Energy: 1.3073324571877458
Energy: 1.3632034803013708
Energy: 1.3073324571883722
Energy: 1.363203480300745
Energy: 1.3073324571877458
Energy: 1.319134918042109
Energy: 1.3222143756363947
Energy: 1.319134918042109
Energy: 1.3222143756363947
Energy: 1.319134918042109
Energy: 1.3222143756363947
Energy: 1.2979588332742888
Energy: 1.3829927875275634
Energy: 1.2979588332742888
Energy: 1.3829927875275634
Energy: 1.297958833274915
Energy: 1.3829927875275634
Energy: 1.33327897977253
Energy: 1.337270825552648
Energy: 1.333278979773156
Energy: 1.3372708255532741
Energy: 1.333278979773156
Energy: 1.3372708255538999
Energy: 1.372745345591146
Energy: 1.34661361534973
Energy: 1.3727453455905199
Energy: 1.34661361534973
Energy: 1.372745345591146
Energy: 1.34661361534973
Energy: 1.378484034137467
Energy: 1.3596678737215087
Energy: 1.378484034138093
Energy: 1.3596678737215087
Energy: 1.378484034137467
Energy: 1.3596678737215087
Energy: 1.3505370410815385
Energy: 1.3108710788909397
Energy: 1.3505370410821647
Energy: 1.3108710788909397
Energy: 1.3505370410821647
Energy: 1.3108710788909397
Energy: 1.3737840265933103
Energy: 1.3664497940157665
Energy: 1.3737840265933103
Energy: 1.3664497940163924
Energy: 1.3737840265933103
Energy: 1.3664497940163924
Energy: 1.3229747850979119
Energy: 1.3299166021921942
Energy: 1.322974785098538
Energy: 1.3299166021921942
Energy: 1.322974785097286
Energy: 1.3299166021921942
Energy: 1.3054959043311765
Energy: 1.3421817943762488
Energy: 1.3054959043318026
Energy: 1.3421817943762488
Energy: 1.3054959043318026
Energy: 1.3421817943762488
Energy: 1.3747416864427673
Energy: 1.3078164812200646
Energy: 1.3747416864427673
Energy: 1.3078164812206907
Energy: 1.3747416864427673
Energy: 1.3078164812206907
Energy: 1.3432589155144503
Energy: 1.3274425543228403
Energy: 1.3432589155144503
Energy: 1.3274425543228403
Energy: 1.3432589155138241
Energy: 1.3274425543228403
Energy: 1.3544611187370974
Energy: 1.3379564500029453
Energy: 1.3544611187377238
Energy: 1.3379564500029453
Energy: 1.3544611187377238
Energy: 1.337956450001693
Energy: 1.3449504079719339
Energy: 1.3190661751822814
Energy: 1.3449504079719339
Energy: 1.319066175181029
Energy: 1.3449504079706818
Energy: 1.3190661751822814
Energy: 1.360488538996968
Energy: 1.3388360641638488
Energy: 1.3604885389963421
Energy: 1.3388360641638488
Energy: 1.3604885389963421
Energy: 1.3388360641638488
Energy: 1.3125756545465468
Energy: 1.3866380398657063
Energy: 1.3125756545465468
Energy: 1.3866380398657063
Energy: 1.312575654547173
Energy: 1.3866380398657063
Energy: 1.3425175988700113
Energy: 1.301425463846734
Energy: 1.3425175988700113
Energy: 1.3014254638461078
Energy: 1.3425175988700113
Energy: 1.3014254638461078
Energy: 1.3313721502049674
Energy: 1.3570515106280086
Energy: 1.3313721502049674
Energy: 1.3570515106280086
Energy: 1.3313721502055935
Energy: 1.3570515106286347
Energy: 1.38666863219331
Energy: 1.3653524055151447
Energy: 1.3866686321926835
Energy: 1.3653524055151447
Energy: 1.3866686321914312
Energy: 1.3653524055157709
Energy: 1.3613082670077077
Energy: 1.334212210108915
Energy: 1.3613082670083338
Energy: 1.334212210108915
Energy: 1.3613082670077077
Energy: 1.334212210108915
Energy: 1.3939400003714766
Energy: 1.3510308005629534
Energy: 1.393940000372729
Energy: 1.3510308005635798
Energy: 1.3939400003714766
Energy: 1.3510308005629534
Energy: 1.3069159945659379
Energy: 1.328155550555665
Energy: 1.3069159945659379
Energy: 1.3281555505550389
Energy: 1.306915994566564
Energy: 1.328155550555665
Energy: 1.333564353917752
Energy: 1.3499310749199507
Energy: 1.3335643539171258
Energy: 1.3499310749193247
Energy: 1.333564353917752
Energy: 1.3499310749193247
Energy: 1.3641368981596729
Energy: 1.3325349683146623
Energy: 1.364136898160299
Energy: 1.3325349683152883
Energy: 1.3641368981596729
Energy: 1.3325349683146623
Energy: 1.336020291327743
Energy: 1.357059041360344
Energy: 1.3360202913289951
Energy: 1.357059041360344
Energy: 1.3360202913283692
Energy: 1.3570590413597179
Energy: 1.3206554938988109
Energy: 1.3547777265432488
Energy: 1.3206554938981847
Energy: 1.3547777265432488
Energy: 1.3206554938988109
Energy: 1.3547777265432488

minimum gb energy = 1.2979588332742888 eV
minimum distance =  2.31999310410904 Angstroms
sigma value = 101


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

Energy: 1.32442937413102
Energy: 1.2684471222813376
Energy: 1.3244293741315707
Energy: 1.2684471222813376
Energy: 1.3244293741315707
Energy: 1.2684471222813376
Energy: 1.3045063890906232
Energy: 1.2785249209614067
Energy: 1.3045063890895223
Energy: 1.2785249209608565
Energy: 1.3045063890895223
Energy: 1.2785249209608565
Energy: 1.2621621892088717
Energy: 1.266473490715292
Energy: 1.2621621892110233
Energy: 1.266473490715292
Energy: 1.2621621892094221
Energy: 1.266473490715292
Energy: 1.2808973993562747
Energy: 1.265040059203692
Energy: 1.2808973993562747
Energy: 1.2650400592031417
Energy: 1.2808973993562747
Energy: 1.2650400592031417
Energy: 1.2871885292724081
Energy: 1.2512220725679135
Energy: 1.2871885292724081
Energy: 1.2512220725684642
Energy: 1.2871885292729586
Energy: 1.2512220725684642
Energy: 1.2472045418122775
Energy: 1.2814183799644925
Energy: 1.2472045418122775
Energy: 1.281418379963942
Energy: 1.2472045418128281
Energy: 1.281418379963942
Energy: 1.2781687948867901
Energy: 1.292222468468245
Energy: 1.27816879488624
Energy: 1.292222468468245
Energy: 1.27816879488624
Energy: 1.292222468468245
Energy: 1.2797804083039293
Energy: 1.2693771953935484
Energy: 1.2797804083039293
Energy: 1.2693771953946493
Energy: 1.2797804083039293
Energy: 1.2693771953946493
Energy: 1.2435638817039771
Energy: 1.2863700190197023
Energy: 1.2435638817039771
Energy: 1.2863700190191518
Energy: 1.2435638817045276
Energy: 1.2863700190191518
Energy: 1.2756728747351207
Energy: 1.3062215492168905
Energy: 1.27567287473457
Energy: 1.30622154921634
Energy: 1.27567287473457
Energy: 1.3062215492168905
Energy: 1.2786628532464877
Energy: 1.4235687341905274
Energy: 1.2786628532475885
Energy: 1.4235687341943806
Energy: 1.2786628532470383
Energy: 1.4235687341932795
Energy: 1.3301156103090443
Energy: 1.2918128949386822
Energy: 1.3301156103095948
Energy: 1.2918128949386822
Energy: 1.3301156103090443
Energy: 1.2918128949386822
Energy: 1.2204460033524291
Energy: 1.2664888074157756
Energy: 1.220446003351879
Energy: 1.2664888074157756
Energy: 1.2204460033529798
Energy: 1.266488807415225
Energy: 1.3290596922238105
Energy: 1.30698816830917
Energy: 1.3290596922238105
Energy: 1.3602166497267878
Energy: 1.3290596922238105
Energy: 1.2942552552973523
Energy: 1.3053993664400887
Energy: 1.2708539461890362
Energy: 1.3053993664400887
Energy: 1.2708539461884856
Energy: 1.3053993664400887
Energy: 1.2708539461890362
Energy: 1.2613978408339526
Energy: 1.2976184834143605
Energy: 1.2613978408345028
Energy: 1.297618483414911
Energy: 1.2613978408345028
Energy: 1.297618483414911
Energy: 1.2753786036313812
Energy: 1.3230922068673518
Energy: 1.2753786036313812
Energy: 1.3230922068673518
Energy: 1.2753786036308308
Energy: 1.3230922068673518
Energy: 1.3042104776334316
Energy: 1.2520162117414242
Energy: 1.304210477633982
Energy: 1.252016211740874
Energy: 1.3042104776328813
Energy: 1.2520162117414242
Energy: 1.2468753308665634
Energy: 1.2861739881563798
Energy: 1.246875330867114
Energy: 1.2861739881563798
Energy: 1.2468753308660134
Energy: 1.2861739881563798
Energy: 1.2906840942852462
Energy: 1.2782155079902136
Energy: 1.2906840942846958
Energy: 1.2782155079902136
Energy: 1.2906840942846958
Energy: 1.2782155079902136
Energy: 1.2776229448319052
Energy: 1.417636759385947
Energy: 1.277622944830804
Energy: 1.4176367593848462
Energy: 1.277622944830804
Energy: 1.4176367593853965
Energy: 1.3178309036991755
Energy: 1.294535554661887
Energy: 1.3178309036986253
Energy: 1.294535554661887
Energy: 1.3178309037002767
Energy: 1.294535554661887
Energy: 1.3168524251877944
Energy: 1.272412946539519
Energy: 1.3168524251877944
Energy: 1.272412946539519
Energy: 1.3168524251877944
Energy: 1.272412946539519
Energy: 1.2811824801713938
Energy: 1.3200712504385044
Energy: 1.281182480171944
Energy: 1.3200712504385044
Energy: 1.281182480171944
Energy: 1.3200712504385044
Energy: 1.3333607409128758
Energy: 1.2707559517564087
Energy: 1.3333607409128758
Energy: 1.2707559517564087
Energy: 1.3333607409128758
Energy: 1.2707559517558582
Energy: 1.2261738531043749
Energy: 1.2955221033186228
Energy: 1.2261738531043749
Energy: 1.2955221033186228
Energy: 1.2261738531043749
Energy: 1.2955221033180722
Energy: 1.3369667247580646
Energy: 1.3068025237871295
Energy: 1.3369667247580646
Energy: 1.3068025237871295
Energy: 1.3369667247580646
Energy: 1.3068025237871295
Energy: 1.3081906734512867
Energy: 1.2717930601337912
Energy: 1.3081906734507365
Energy: 1.2717930601337912
Energy: 1.3081906734507365
Energy: 1.2717930601337912
Energy: 1.3199702296933253
Energy: 1.2917910991001906
Energy: 1.3199702296944265
Energy: 1.2917910991001906
Energy: 1.319970229693876
Energy: 1.2917910990996404
Energy: 1.2734291699784457
Energy: 1.27307733949063
Energy: 1.273429169978996
Energy: 1.2730773394911803
Energy: 1.2734291699795466
Energy: 1.27307733949063
Energy: 1.2756587863919264
Energy: 1.2580416582664955
Energy: 1.2756587863919264
Energy: 1.2580416582664955
Energy: 1.2756587863919264
Energy: 1.2580416582664955
Energy: 1.3181592565179692
Energy: 1.2977624605727047
Energy: 1.3181592565185194
Energy: 1.2977624605727047
Energy: 1.3181592565174187
Energy: 1.2977624605727047
Energy: 1.321957850696344
Energy: 1.2720317093113085
Energy: 1.321957850696344
Energy: 1.272031709310758
Energy: 1.3219578506968948
Energy: 1.272031709310758

minimum gb energy = 1.220446003351879 eV
minimum distance =  2.31931613771965 Angstroms
sigma value = 33


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

Energy: 0.019851131201324767
Energy: 1.0479248379802764
Energy: 0.019851131200867445
Energy: 1.0479248379815975
Energy: 0.019851131200867445
Energy: 1.047924837977583
Energy: 0.0205329949268706
Energy: 0.16909232187114148
Energy: 0.020532994926413282
Energy: 0.16909232187159878
Energy: 0.0205329949268706
Energy: 0.16909232187114148
Energy: 1.0460368049816389
Energy: 0.1698104886790433
Energy: 1.046036804973153
Energy: 0.1698104886817364
Energy: 1.0460368049691389
Energy: 0.16981048867726484
Energy: 0.020532994927327918
Energy: 0.16909232187068415
Energy: 0.020532994927327918
Energy: 0.16909232187068415
Energy: 0.0205329949268706
Energy: 0.16909232187068415

minimum gb energy = 0.019851131200867445 eV
minimum distance =  2.51341909396962 Angstroms
sigma value = 1