Model name: model_name=MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Pd
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.8890872895717616
cohesive_energy=3.9103075413017163
mass=106.42
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4797334890998178e-19, 2.1216824075744998e-19, 2.63700650013426e-19, 3.0766918338028797e-19, 3.4625920978681194e-19, 3.8065633994215797e-19, 4.1158796203816196e-19, 4.39537933418292e-19, 4.6485392641212595e-19, 4.87793891457738e-19, 5.08556498457744e-19, 5.272987607222759e-19, 5.4414725020542e-19, 5.59209312741654e-19, 5.72574670222482e-19, 5.843202271263359e-19, 5.94510070518576e-19, 6.032034809346599e-19, 6.10451728026876e-19, 6.162996727409759e-19, 6.2078736949281e-19, 6.23953270521594e-19, 6.258310215366419e-19, 6.264510638939999e-19, 6.257717410011839e-19, 6.235495220098259e-19, 6.19454358533322e-19, 6.13092115119708e-19, 6.03978934425516e-19, 5.91518806742898e-19, 5.749763329968479e-19, 5.5343987468262e-19, 5.25768682036806e-19, 4.905272047953419e-19, 4.45898574655272e-19, 3.8956123767392994e-19, 3.1852072572237e-19, 2.2887734087343597e-19, 1.155068415986058e-19, -2.84163649982874e-20, -2.12107358045358e-19, -4.48165654592382e-19, -7.54146143800434e-19, -1.154927424442266e-18, -1.6865312337801e-18, -2.40241579738398e-18, -3.3841174863347997e-18, -4.7601468884456995e-18, -6.741094100489639e-18, -9.688314040498979e-18, -1.425844278015228e-17, -2.17332056048832e-17, -3.4857755937620996e-17, -6.030048110320439e-17]
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: 0.013031028441671153
Energy: 0.9133240236505066
Energy: 0.8991263800973588
Energy: 0.013287757818847286
Energy: 0.9058540579807997
Energy: 0.01348973677104814
Energy: 0.9133240236316897
Energy: 0.9513502728960573
Energy: 0.5045128739057892
Energy: 0.5045434752330092
Energy: 0.9372625111555261
Energy: 0.5021732805516567
Energy: 0.8991263800973588
Energy: 0.5045128739073849
Energy: 0.09754817229532638
Energy: 0.8995155538189681
Energy: 0.5036501084105064
Energy: 0.5022975315064232
Energy: 0.013287757818576324
Energy: 0.5045434752332502
Energy: 0.8995155538192392
Energy: 0.013293563434083422
Energy: 0.5027969613947297
Energy: 0.013525710478716845
Energy: 0.9058540579590926
Energy: 0.9372625111414964
Energy: 0.5036501084099645
Energy: 0.5027969613950006
Energy: 0.9242478937590836
Energy: 0.5055952223600948
Energy: 0.01348973677104814
Energy: 0.5021732805513857
Energy: 0.5022975315058813
Energy: 0.013525710478445882
Energy: 0.5055952223584991
Energy: 0.01381706265307319

minimum gb energy = 0.013031028441671153 eV
minimum distance =  2.74455658631075 Angstroms
sigma value = 1


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

Energy: 1.6741775271180894
Energy: 1.8676120027305112
Energy: 1.4839813341968355
Energy: 1.623251894494976
Energy: 1.9077270093347358
Energy: 1.480962492108839
Energy: 1.7211484214178756
Energy: 1.162483071235466
Energy: 1.1868489395818462
Energy: 1.6627398898287316
Energy: 1.1629834113993749
Energy: 1.138382928945241
Energy: 1.6260483336081017
Energy: 1.1620859356237843
Energy: 1.1819476334180385
Energy: 1.6378474520397697
Energy: 1.2064628462983162
Energy: 1.196413132836045
Energy: 1.8085271508301968
Energy: 1.6810330544746817
Energy: 1.4871803589655248
Energy: 1.8490841217050369
Energy: 1.6839330527712304
Energy: 1.649949091914294
Energy: 1.5858362835262907
Energy: 1.257245764311075
Energy: 1.1755317486412067
Energy: 1.5860545832254442
Energy: 1.2579911256096543
Energy: 1.1968607083050642
Energy: 1.523714366638922
Energy: 1.2408030334949876
Energy: 1.1805003266595462
Energy: 1.4914713898480354
Energy: 1.2659236498652915
Energy: 1.1826937210112236
Energy: 1.5528974822351158
Energy: 1.482574414561596
Energy: 1.37410012895513
Energy: 1.5552454696805966
Energy: 1.4831300965344196
Energy: 1.413900447435458
Energy: 1.5376662305159208
Energy: 1.4497502946339071
Energy: 1.382356634628123
Energy: 1.5394499922672482
Energy: 1.4636033798359673
Energy: 1.363108603900177
Energy: 1.2514239552027984
Energy: 1.2894263301921431
Energy: 1.1979529605471742
Energy: 1.252509566934932
Energy: 1.4878667128500118
Energy: 1.1538767683053832
Energy: 1.321780066263558
Energy: 1.411438556001675
Energy: 1.2381158291964005
Energy: 1.2835275344320003
Energy: 1.4484175645963309
Energy: 1.2091286216607429
Energy: 1.6869620921872461
Energy: 1.585575677076978
Energy: 1.5411154915985086
Energy: 1.6864717510485574
Energy: 1.5874834475854076
Energy: 1.5052297123309735
Energy: 1.2014541967512622
Energy: 1.2598471338014432
Energy: 1.1604670975423952
Energy: 1.2017860686335484
Energy: 1.695157939701661
Energy: 1.1417891577603845
Energy: 1.1243764960587581
Energy: 1.3299398093113945
Energy: 1.190326965126548
Energy: 1.1241698833987268
Energy: 1.7746347676440954
Energy: 1.1723054630044454
Energy: 1.196551904657222
Energy: 1.7432402996032113
Energy: 1.5815919229526592
Energy: 1.1926487481722456
Energy: 1.7537381699482777
Energy: 1.6309250743347439
Energy: 1.1675065195630587
Energy: 1.2764399694477917
Energy: 1.1604822077056676
Energy: 1.1682546871861146
Energy: 1.3365268995973623
Energy: 1.1449711711138335
Energy: 1.1740645010389186
Energy: 1.2671311418072295
Energy: 1.2113296296801874
Energy: 1.1740851744464649
Energy: 1.6121602797810983
Energy: 1.1351592779466118
Energy: 1.5603082710012153
Energy: 1.5843167494511647
Energy: 1.5021140022766426
Energy: 1.5616635878479779
Energy: 1.6045999178634156
Energy: 1.5250704216809265
Energy: 1.3738606248381189
Energy: 1.4487972912140348
Energy: 1.2817783415626904
Energy: 1.3753042959506727
Energy: 1.4484113405641346
Energy: 1.2781837424841929
Energy: 1.394914438812702
Energy: 1.3528727038689896
Energy: 1.2097374014205533
Energy: 1.4407661094293387
Energy: 1.4217872606881974
Energy: 1.1578619870353821
Energy: 1.5534641343849591
Energy: 1.3856531895336976
Energy: 1.328167516964143
Energy: 1.5531343047044555
Energy: 1.4373971614542642
Energy: 1.280181583594345
Energy: 1.6213668090940332
Energy: 1.5589570990225372
Energy: 1.41026170824646
Energy: 1.623285571858398
Energy: 1.5614315690266976
Energy: 1.508392336187219
Energy: 1.51999597460365
Energy: 1.1332546855121062
Energy: 1.1455445694605182
Energy: 1.5555536765225613
Energy: 1.1760672553298928
Energy: 1.1754710799230557
Energy: 1.7742590831350977
Energy: 1.2161475658104532
Energy: 1.244895054758006
Energy: 1.7558849813407724
Energy: 1.2160481236001832
Energy: 1.1305818925032651

minimum gb energy = 1.1241698833987268 eV
minimum distance =  2.51319724290764 Angstroms
sigma value = 33


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

Energy: 1.89268504225901
Energy: 1.646633110522106
Energy: 1.438216842696726
Energy: 1.778802113206143
Energy: 1.66592422373857
Energy: 1.500327630174703
Energy: 1.7320447461123085
Energy: 1.2800329535475365
Energy: 1.1137668096994242
Energy: 1.5817524693536036
Energy: 1.2700005347602104
Energy: 1.1988736050443336
Energy: 1.7104822574126721
Energy: 1.139099219882133
Energy: 1.337447344019863
Energy: 1.6715093340973624
Energy: 1.2438295452041033
Energy: 1.3953948673882306
Energy: 1.6042786958957826
Energy: 1.8484697965439445
Energy: 1.8629509744606036
Energy: 1.605171960285585
Energy: 1.887484252278279
Energy: 1.4322188881863902
Energy: 1.6382111031420978
Energy: 1.3527185404138842
Energy: 1.4232492233253153
Energy: 1.6330802744009474
Energy: 1.365701422069461
Energy: 1.4215107846656156
Energy: 1.6229521888916136
Energy: 1.3013351754820035
Energy: 1.3244319372900044
Energy: 1.610138593546767
Energy: 1.3199308412107182
Energy: 1.3555206486212918
Energy: 1.6229862857039163
Energy: 1.5556532468445599
Energy: 1.5342604826267445
Energy: 1.616017136737305
Energy: 1.5890225034186534
Energy: 1.527242710134428
Energy: 1.6807510288532077
Energy: 1.2564284503774503
Energy: 1.2916745835192813
Energy: 1.6441345371314176
Energy: 1.2536201688843926
Energy: 1.3072915608255484
Energy: 1.2951586186248045
Energy: 1.5087013088502457
Energy: 1.3407835105417722
Energy: 1.3058022495324657
Energy: 1.4618190838357017
Energy: 1.3328779363674557
Energy: 1.3932630666013435
Energy: 1.4006230093610834
Energy: 1.3747584995687008
Energy: 1.3940636600234662
Energy: 1.609762539803554
Energy: 1.2836587040864746
Energy: 1.586864267496165
Energy: 1.6426282490575308
Energy: 1.6465844241996166
Energy: 1.5876350236212713
Energy: 1.7660269051381916
Energy: 1.4925421886696957
Energy: 1.286187203008284
Energy: 1.3843461423912309
Energy: 1.2758424896244054
Energy: 1.279444173362425
Energy: 1.6243269651249277
Energy: 1.1597106104710742
Energy: 1.2594298877321628
Energy: 1.4333385190251984
Energy: 1.4070559756957328
Energy: 1.2587001713088508
Energy: 1.5619813485754506
Energy: 1.332821538248017
Energy: 1.9622745632262546
Energy: 1.6066002477545032
Energy: 1.3889564108392378
Energy: 1.9327366588927877
Energy: 1.6053990936453058
Energy: 1.4346976307362316
Energy: 1.3845196931867088
Energy: 1.4486277950156206
Energy: 1.431868303286151
Energy: 1.3680956675080616
Energy: 1.6200190940733257
Energy: 1.4245425786928623
Energy: 1.3736881355359982
Energy: 1.5264282738209598
Energy: 1.3577440373813139
Energy: 1.331950119941983
Energy: 1.6157459891668169
Energy: 1.3288442449461806
Energy: 1.5931093821879352
Energy: 1.579228928755735
Energy: 1.5788336655156983
Energy: 1.5976997716389763
Energy: 1.6366653602627905
Energy: 1.5040532879432302
Energy: 1.254411409462617
Energy: 1.4049430091814787
Energy: 1.4046026151451687
Energy: 1.2545267255006856
Energy: 1.5929590944271046
Energy: 1.318434417621518
Energy: 1.3266652476239302
Energy: 1.3530529008263708
Energy: 1.3345603461015456
Energy: 1.330024004240818
Energy: 1.2933742277345672
Energy: 1.315902710574895
Energy: 1.6693022020358042
Energy: 1.2570489836953855
Energy: 1.3025973431405258
Energy: 1.6553583999979538
Energy: 1.285030535298518
Energy: 1.341015380216427
Energy: 1.7601689534194462
Energy: 1.6979001365490425
Energy: 1.4923892486311487
Energy: 1.7607352095485902
Energy: 1.7177012454356422
Energy: 1.4184616895297357
Energy: 1.6576816068791012
Energy: 1.3201749600697743
Energy: 1.3192312916776303
Energy: 1.6747112852220958
Energy: 1.3213861873060182
Energy: 1.2538013651712008
Energy: 1.6924345778515295
Energy: 1.1453457667880722
Energy: 1.3535303529506024
Energy: 1.6516230103251524
Energy: 1.2620031365657118
Energy: 1.376582494477086
Energy: 1.6020207134584776
Energy: 1.8879810217027233
Energy: 1.8677756530268188
Energy: 1.603391287178709
Energy: 1.863043252787839
Energy: 1.375235086792459
Energy: 1.7141138680899273
Energy: 1.3494752133688184
Energy: 1.4233431866669919
Energy: 1.6310176103953316
Energy: 1.368417883646613
Energy: 1.4226689043853757
Energy: 1.5759925283642335
Energy: 1.3012797230708086
Energy: 1.319671687118216
Energy: 1.5583286127566585
Energy: 1.3240139919417986
Energy: 1.3024020520365267
Energy: 1.6095530550975032
Energy: 1.5411106879139373
Energy: 1.5242049060052172
Energy: 1.5906279637865455
Energy: 1.5628768025166395
Energy: 1.512314130817487
Energy: 1.6260488830877566
Energy: 1.3013722505166994
Energy: 1.3015216018841023
Energy: 1.5721740876762478
Energy: 1.2919214142897995
Energy: 1.3812433165732434
Energy: 1.3345956492104822
Energy: 1.4835515274376854
Energy: 1.3073461387420646
Energy: 1.2889679718137728
Energy: 1.3296404296130055
Energy: 1.3333218075362188
Energy: 1.220629249074028
Energy: 1.3471052248135105
Energy: 1.3467492934917422
Energy: 1.219238728804681
Energy: 1.6488782686737682
Energy: 1.2955956195519935
Energy: 1.606076638351335
Energy: 1.6846322385895596
Energy: 1.685099442716463
Energy: 1.6221344006407874
Energy: 1.9321344003159053
Energy: 1.5532264842463046
Energy: 1.289521870307275
Energy: 1.571593401664111
Energy: 1.3215242857101537
Energy: 1.2884409947040936
Energy: 1.7340504403270929
Energy: 1.2755485172312704
Energy: 1.2604658585586233
Energy: 1.3982615779222114
Energy: 1.3770183832623952
Energy: 1.262719325648056
Energy: 1.6486647665309209
Energy: 1.3734345855348615
Energy: 1.853027504660323
Energy: 1.607464620346394
Energy: 1.3642081414437273
Energy: 1.8397788898388938
Energy: 1.6050031942204144
Energy: 1.4267699911501925
Energy: 1.3833017522782065
Energy: 1.4363189436880235
Energy: 1.4165829807274575
Energy: 1.3663862198516017
Energy: 1.5745736052466888
Energy: 1.4251986045308842
Energy: 1.331702345098551
Energy: 1.4787614399700608
Energy: 1.245318723331923
Energy: 1.3117416008006622
Energy: 1.5596569156012032
Energy: 1.287995895293955
Energy: 1.6186764206564013
Energy: 1.4911278365387317
Energy: 1.4938840701704184
Energy: 1.562064127247082
Energy: 1.5848360420625496
Energy: 1.5106896862985078
Energy: 1.514426002503721
Energy: 1.3567163643663596
Energy: 1.393017054108622
Energy: 1.5212302287933888
Energy: 1.5627663419515196
Energy: 1.3850129713768895
Energy: 1.3295559675652635
Energy: 1.3440310762584173
Energy: 1.2806878735343417
Energy: 1.3289991509195682
Energy: 1.342619313899446
Energy: 1.345773816145875
Energy: 1.6886537947108076
Energy: 1.2111615133476528
Energy: 1.2715923455857099
Energy: 1.5558562450248128
Energy: 1.1200517177649107
Energy: 1.2842754185848781
Energy: 1.8763010595422076
Energy: 1.393749306818046
Energy: 1.5072900760551236
Energy: 1.73233919936043
Energy: 1.4663009194173175
Energy: 1.6403284387257007

minimum gb energy = 1.1137668096994242 eV
minimum distance =  2.47076789407736 Angstroms
sigma value = 51


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

Energy: 1.6835866221797933
Energy: 1.9152955574954462
Energy: 1.7075673880458717
Energy: 1.6847133776641543
Energy: 1.9449999543049874
Energy: 1.4061490374821872
Energy: 1.5905992472809694
Energy: 1.188060149997623
Energy: 1.1880400103328161
Energy: 1.5673301717495476
Energy: 1.1887043376522017
Energy: 1.2908027631297554
Energy: 1.6342781217371323
Energy: 1.1230121249758782
Energy: 1.1677704963054922
Energy: 1.6590172867365889
Energy: 1.2388884205021968
Energy: 1.1895824022829427
Energy: 1.4908989855110715
Energy: 1.6845238944931797
Energy: 1.646333585648638
Energy: 1.4915360533676127
Energy: 1.6841652366804447
Energy: 1.35041757786265
Energy: 1.5294363234333594
Energy: 1.330111159724672
Energy: 1.3590108558372225
Energy: 1.5376621980385827
Energy: 1.3458775157336083
Energy: 1.3592906620118617
Energy: 1.3452011740964325
Energy: 1.4123145433396143
Energy: 1.2993804143038996
Energy: 1.3466636442828863
Energy: 1.3661759049111069
Energy: 1.2739595666220365
Energy: 1.2736197271537744
Energy: 1.3695335388809315
Energy: 1.3539932349477999
Energy: 1.2741653089346983
Energy: 1.4185435756375055
Energy: 1.340500192879492
Energy: 1.5845877017474932
Energy: 1.6284038077355927
Energy: 1.5367493607929579
Energy: 1.5851350184786372
Energy: 1.7230586962777896
Energy: 1.4674947679791124
Energy: 1.2226308532645536
Energy: 1.581464240740943
Energy: 1.2992169059285708
Energy: 1.2256297823040032
Energy: 1.67052775006244
Energy: 1.204338966051308
Energy: 1.1943441603715874
Energy: 1.3177807177994587
Energy: 1.1141722048111875
Energy: 1.1948146019856616
Energy: 1.6007680087077498
Energy: 1.1289835009072933
Energy: 1.910711224792246
Energy: 1.7949563417124847
Energy: 1.6923584403683847
Energy: 1.8717979375387475
Energy: 1.922978221753313
Energy: 1.6001994140812
Energy: 1.2401262797072856
Energy: 1.3358125820922697
Energy: 1.179338325329245
Energy: 1.2555739511088286
Energy: 1.5793443295547849
Energy: 1.1853332020047829
Energy: 1.142697593311264
Energy: 1.466032926709111
Energy: 1.1735888077627497
Energy: 1.1440799478599237
Energy: 1.521773817040099
Energy: 1.1786485706245757
Energy: 1.5712903078385463
Energy: 1.410973225005868
Energy: 1.3375189938895766
Energy: 1.5732094043768228
Energy: 1.4653751108254243
Energy: 1.3843368326192727
Energy: 1.5395303587826221
Energy: 1.4568511532692667
Energy: 1.4029765317248355
Energy: 1.4879546429204737
Energy: 1.622211742614512
Energy: 1.4014420084538577
Energy: 1.3337802484743913
Energy: 1.328364648867317
Energy: 1.3265232039598718
Energy: 1.3356151492218364
Energy: 1.3558008556605479
Energy: 1.291291396929934
Energy: 1.581026027760473
Energy: 1.1742240225377036
Energy: 1.1935388876133952
Energy: 1.4965157668881075
Energy: 1.1824727471936503
Energy: 1.2941280006164222
Energy: 1.7751200586338147
Energy: 1.3869700978446051
Energy: 1.439962325473106
Energy: 1.7765796536776894
Energy: 1.3871403806254043
Energy: 1.296379373680296

minimum gb energy = 1.1141722048111875 eV
minimum distance =  2.52242562475055 Angstroms
sigma value = 19


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

Energy: 1.3457333581032727
Energy: 1.7064127202773345
Energy: 1.0757394450902797
Energy: 1.348255124520111
Energy: 1.8653960319963412
Energy: 1.1920799286204629
Energy: 1.539027876994003
Energy: 1.0139443273242776
Energy: 0.9792607799241801
Energy: 1.4058102550877754
Energy: 1.0136050573771074
Energy: 1.3527219645827728
Energy: 1.4674630528420625
Energy: 1.1375092862777116
Energy: 1.137988430716266
Energy: 1.285947573033989
Energy: 1.1375471314830365
Energy: 1.1382569447279562
Energy: 1.156798165258904
Energy: 1.5657128813951897
Energy: 1.6334404409797842
Energy: 1.1557265102405472
Energy: 1.5670056544546995
Energy: 1.6356638309615958
Energy: 1.5621163033846883
Energy: 1.3106560637016087
Energy: 1.4087345824299489
Energy: 1.5625023903948734
Energy: 1.3695783759940945
Energy: 1.4093589681833567
Energy: 1.2146906389841823
Energy: 1.1220949601266184
Energy: 1.1923365521315705
Energy: 1.2149199546956055
Energy: 1.01398388914357
Energy: 1.148303919422139
Energy: 1.1629292812876613
Energy: 1.526483445093776
Energy: 1.4645657997471104
Energy: 1.1621249057500584
Energy: 1.4732233711501344
Energy: 1.0918272778225881
Energy: 1.319350741558647
Energy: 1.3506544064700337
Energy: 1.1920052932228493
Energy: 1.3194341788724075
Energy: 1.3491258457388025
Energy: 1.2148508132219493
Energy: 1.0819300725506762
Energy: 1.3484127061615399
Energy: 1.1392581028394109
Energy: 1.0818369627692785
Energy: 1.3487484760593105
Energy: 1.1409637404627053
Energy: 1.1360506621229916
Energy: 1.4543780077245199
Energy: 1.4108185098810349
Energy: 1.1378145480439497
Energy: 1.4100060632545237
Energy: 1.1385369359688806
Energy: 1.5469841044981731
Energy: 1.2107747981823123
Energy: 1.194635753910587
Energy: 1.5480419570248105
Energy: 1.20947054727738
Energy: 1.620401010040663
Energy: 1.3939364386179078
Energy: 1.2184236707309486
Energy: 1.2192989972393036
Energy: 1.3381309796311356
Energy: 1.409767082070953
Energy: 1.3283632431904508
Energy: 1.0152781818361012
Energy: 1.2170508861272693
Energy: 1.1877985262005875
Energy: 1.0142764776405924
Energy: 1.249556616153678
Energy: 1.1869005607640915
Energy: 1.4813465629678984
Energy: 1.1607269847503945
Energy: 1.0918963542073252
Energy: 1.4826338408423818
Energy: 1.159838869772512
Energy: 1.3522954356507333
Energy: 1.4801637292437395
Energy: 1.3198864627553604
Energy: 1.2684874895473301
Energy: 1.481799277072191
Energy: 1.319258009236499
Energy: 1.1394673360043381
Energy: 1.3478148589113386
Energy: 1.0816372073445208
Energy: 1.215141863139621
Energy: 1.348550708089714
Energy: 1.0817869221611185
Energy: 1.140265264293149
Energy: 1.4669042451425391
Energy: 1.0268160558763086
Energy: 1.0281650997058456
Energy: 1.451045208121977
Energy: 1.137781444865508
Energy: 1.4967716461659337
Energy: 1.6182026215250205
Energy: 1.1375354127203463
Energy: 1.1379029975538593
Energy: 1.3644402407224778
Energy: 1.1374880445758393
Energy: 1.3239472486566581
Energy: 1.3325943731040053
Energy: 1.327796744831011
Energy: 1.3278317656942433
Energy: 1.3315533636347645
Energy: 1.3384475772200115
Energy: 1.3286578585240003
Energy: 1.2497533601235897
Energy: 1.0615032340952648
Energy: 1.1874831639443397
Energy: 1.249638120609792
Energy: 0.9556363192214483
Energy: 1.1874799957856779
Energy: 1.1580642560278946
Energy: 1.1913752023032296
Energy: 1.2041954567963111
Energy: 1.1595491491979384
Energy: 1.1901591513665952
Energy: 1.0919663255375656
Energy: 1.2688522056250902
Energy: 1.3559720135934714
Energy: 1.487180397028503
Energy: 1.2703425453990989
Energy: 1.450313852730014
Energy: 1.2270228465482844
Energy: 1.5784507919918922
Energy: 1.350906088772768
Energy: 1.1915291880406733
Energy: 1.4395155035327776
Energy: 1.3508496736172244
Energy: 1.2148118905768501
Energy: 1.079956455008464
Energy: 1.5370682609336797
Energy: 1.2251269997315566
Energy: 1.0136784268945618
Energy: 1.448692916385697
Energy: 1.0143783827546522
Energy: 1.1375629176870363
Energy: 1.4161968438346828
Energy: 1.2977206356620998
Energy: 1.1376129092905873
Energy: 1.3243883513521189
Energy: 1.13835356788462
Energy: 1.5606835814235265
Energy: 1.1550452211992939
Energy: 1.1953601460511354
Energy: 1.5619739752718573
Energy: 1.1559994375258065
Energy: 1.630834070776192
Energy: 1.3677604994409551
Energy: 1.409010222883756
Energy: 1.409409738164697
Energy: 1.3693569395542218
Energy: 1.421526101023549
Energy: 1.4095641077913788
Energy: 1.013755920714517
Energy: 1.2167621197294687
Energy: 1.1753267435913723
Energy: 1.015245262723192
Energy: 1.2157902445124253
Energy: 1.1476090602952362
Energy: 1.4823700978394767
Energy: 1.1600571799659647
Energy: 1.0917652903038277
Energy: 1.473097655084029
Energy: 1.1593066239661638
Energy: 1.353220277591884
Energy: 1.3476582951593465
Energy: 1.319458114886214
Energy: 1.2920253135732689
Energy: 1.348440450690332
Energy: 1.319351495191302
Energy: 1.2147878592228798

minimum gb energy = 0.9556363192214483 eV
minimum distance =  2.48250590750799 Angstroms
sigma value = 27


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

Energy: 1.2572050318772212
Energy: 1.8251955877126205
Energy: 1.442448519489533
Energy: 1.1440421566559191
Energy: 1.837405926162091
Energy: 1.5628802522200749
Energy: 1.6137720705924974
Energy: 1.1885057224407032
Energy: 1.1885465312380006
Energy: 1.5443924391909247
Energy: 1.1892435249888058
Energy: 1.310063813980195
Energy: 1.5666685626733665
Energy: 1.030047666524831
Energy: 1.0301462947914601
Energy: 1.5676876128849921
Energy: 1.0310092113466238
Energy: 1.1549319122343233
Energy: 1.5786037554575312
Energy: 1.205767417519693
Energy: 1.4300964666329872
Energy: 1.5804529480850522
Energy: 1.2058306226570588
Energy: 1.3232407010849914
Energy: 1.449426941441512
Energy: 1.364783890738385
Energy: 1.442360280998273
Energy: 1.4048066602189417
Energy: 1.3651217527820676
Energy: 1.4017486386072902
Energy: 1.139680523628376
Energy: 1.066365701013574
Energy: 1.1361326563782068
Energy: 1.0638371389541605
Energy: 1.1457238667186926
Energy: 1.325650935862781
Energy: 1.1787639545908877
Energy: 1.0943924610339588
Energy: 1.3776891287165498
Energy: 1.180092594135353
Energy: 1.5500332306258748
Energy: 1.235978346898466
Energy: 1.3945712689957923
Energy: 1.3856852748783648
Energy: 1.451011604692947
Energy: 1.180507690571348
Energy: 1.5209824267268106
Energy: 1.4828006848057695
Energy: 1.5703783471975852
Energy: 1.529559817576261
Energy: 1.584802322581586
Energy: 1.5223898886305263
Energy: 1.7061584421298899
Energy: 1.5593523967706358
Energy: 1.06399957501763
Energy: 1.0747219166929654
Energy: 1.1608474335326386
Energy: 1.0637768537045464
Energy: 1.2763000332414498
Energy: 1.0550992489605997
Energy: 1.20300305758062
Energy: 0.9964057968195746
Energy: 0.9977522004446142
Energy: 1.2025094392332871
Energy: 1.0329416169515595
Energy: 1.178304454041826
Energy: 1.616834531581407
Energy: 1.352962956595322
Energy: 1.3317344337380843
Energy: 1.549458435237662
Energy: 1.3527648595946624
Energy: 1.4457450413244524

minimum gb energy = 0.9964057968195746 eV
minimum distance =  2.50742651366451 Angstroms
sigma value = 9


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

Energy: 1.798642559947387
Energy: 1.9563497523315192
Energy: 1.381843979155571
Energy: 1.8013199135113898
Energy: 1.9552666199798836
Energy: 1.530534980408009
Energy: 1.5352520940941976
Energy: 1.1030145275843755
Energy: 1.1036627595254063
Energy: 1.6409968711900773
Energy: 1.1031890333269179
Energy: 1.186254106633423
Energy: 1.1644090902976023
Energy: 0.8788736289745298
Energy: 0.9374154375729365
Energy: 1.1646908738803015
Energy: 0.878993595232982
Energy: 1.1297648486913636
Energy: 1.136441905800948
Energy: 1.0748963288848596
Energy: 1.1043349395161228
Energy: 1.1394491953127321
Energy: 1.133389895441504
Energy: 1.0614536439650677
Energy: 1.402651585368849
Energy: 1.4312881867247478
Energy: 1.340650761878836
Energy: 1.4019784364679206
Energy: 1.6134688159825323
Energy: 1.2659007480866824
Energy: 1.2012882315958258
Energy: 1.2551017812638376
Energy: 1.3260234321615665
Energy: 1.2023597061132627
Energy: 1.3430322336260396
Energy: 1.2110192743118138
Energy: 1.061286490728291
Energy: 1.3355352041926163
Energy: 1.092029731446369
Energy: 1.0147153989115698
Energy: 1.3989471513494809
Energy: 1.044384806612928
Energy: 1.0334615240658733
Energy: 1.075737217464956
Energy: 1.2663098547855192
Energy: 1.0334616342469947
Energy: 1.138505892547446
Energy: 1.0891909011460366
Energy: 1.4276323096584658
Energy: 1.2818665752788503
Energy: 1.205766904873768
Energy: 1.4183349927389217
Energy: 1.4164497049518525
Energy: 1.2372216300531464
Energy: 1.3431085709084793
Energy: 1.2050552286854155
Energy: 1.269181283239647
Energy: 1.3384593458017495
Energy: 1.4565612348270016
Energy: 1.208824198418278
Energy: 1.4589813913712375
Energy: 0.9519240341956314
Energy: 0.9521445508434243
Energy: 1.4611412954618976
Energy: 1.0345446990268843
Energy: 1.2229937893340557
Energy: 1.592324051208854
Energy: 0.9970256037299416
Energy: 0.9976410468294304
Energy: 1.5924668335486383
Energy: 0.9988986550091141
Energy: 1.0483731275640245
Energy: 1.5681437872416149
Energy: 1.5699356269078355
Energy: 1.2703826381659895
Energy: 1.571123498330948
Energy: 1.5698159059188688
Energy: 1.3895693760137215
Energy: 1.1711667719569334
Energy: 1.3604662771249862
Energy: 1.2628300323131267
Energy: 1.1751484876573386
Energy: 1.3830386594089983
Energy: 1.3007242172258144
Energy: 0.9931360652283182
Energy: 0.8927090763515945
Energy: 0.896272631980869
Energy: 1.0000456603208896
Energy: 0.9344174670955557
Energy: 1.1211038877374622
Energy: 0.9533607844681209
Energy: 1.0507663460396772
Energy: 1.1160160578176836
Energy: 0.9525277042070545
Energy: 1.162945651750684
Energy: 1.0187556156045834
Energy: 1.1671085621228745
Energy: 1.455940367525755
Energy: 1.4165994370682033
Energy: 1.1682763857965128
Energy: 1.5522421422971846
Energy: 1.1402200940943463
Energy: 1.6357809007944772
Energy: 1.4646728629089072
Energy: 1.4590186341808684
Energy: 1.4152050901267805
Energy: 1.5607731127768956
Energy: 1.3936107025988973
Energy: 1.033017143904877
Energy: 1.377202564113775
Energy: 1.3692866966130646
Energy: 1.199234758323457
Energy: 1.3290174538158672
Energy: 1.199407199196051
Energy: 0.9216005732148436
Energy: 0.8685082363396026
Energy: 0.9619316183875851
Energy: 0.9232081018385226
Energy: 0.8856219572976967
Energy: 0.9877211599458986
Energy: 0.9667552648072996
Energy: 1.0706565007280964
Energy: 1.098232604002373
Energy: 0.978275468846811
Energy: 1.0880758800030244
Energy: 1.2101449996814138
Energy: 1.7704695093663068
Energy: 1.4927469163037845
Energy: 1.5503242506600807
Energy: 1.7717097099315877
Energy: 1.51753660350249
Energy: 1.4269505922940444
Energy: 1.8255756945676842
Energy: 1.2924353889019684
Energy: 1.2540851880794008
Energy: 1.8239302907335293
Energy: 1.387863600009899
Energy: 1.343964839200495
Energy: 1.2781104591145616
Energy: 0.9788427865934232
Energy: 1.0303590567279237
Energy: 1.2881501885877138
Energy: 0.9800167917914173
Energy: 1.1399118238621706
Energy: 1.1348990807679975
Energy: 1.012235993849664
Energy: 1.0426275842049733
Energy: 1.1372842127836067
Energy: 0.9536149944457716
Energy: 1.131642793727869
Energy: 1.301163431561435
Energy: 1.288628618545415
Energy: 1.226985094189382
Energy: 1.3004209934832152
Energy: 1.2636512702917155
Energy: 1.2015918764279916
Energy: 1.5555513551475346
Energy: 1.248454243887978
Energy: 1.1688209790515438
Energy: 1.554009567240166
Energy: 1.3412795084391094
Energy: 1.590887624411891
Energy: 1.013422281281857
Energy: 1.2915931997829249
Energy: 1.1425394973460377
Energy: 1.0134578089728121
Energy: 1.2858028666455998
Energy: 0.9729188800414071
Energy: 1.0332598901687053
Energy: 1.2796041305336143
Energy: 1.232879040922314
Energy: 1.0344736637646441
Energy: 1.4186582976286837
Energy: 1.0736520248423478
Energy: 1.59889271120449
Energy: 1.075638945257707
Energy: 1.2022601423615644
Energy: 1.3353590819355818
Energy: 1.1390948824430642
Energy: 1.2136635035506542
Energy: 1.4561560427084068
Energy: 1.3661644506015256
Energy: 1.2565206228862509
Energy: 1.3306375838281066
Energy: 1.3695514921528367
Energy: 1.2195448064442354
Energy: 1.341135577883892
Energy: 1.0315542079285678
Energy: 1.2464348422369893
Energy: 1.3420592276920542
Energy: 1.1137805237611227
Energy: 1.2092435813983062
Energy: 1.5422409528871774
Energy: 1.062319297598954
Energy: 1.0627327804590292
Energy: 1.41574637725689
Energy: 1.0630619514896087
Energy: 1.0623169264068317
Energy: 1.5563986820462499
Energy: 1.2941051054240489
Energy: 1.3697591151710804
Energy: 1.5577919639502804
Energy: 1.294157842992677
Energy: 1.3798589292647467
Energy: 1.6561543473526916
Energy: 1.3578304071156948
Energy: 1.3013802536135082
Energy: 1.657567798814692
Energy: 1.5458915470444419
Energy: 1.2966779595592715
Energy: 1.255516229835497
Energy: 1.0289482387363362
Energy: 1.1208958106322702
Energy: 1.1934792202058462
Energy: 1.0677793726660967
Energy: 1.0745621558773555
Energy: 0.8767489286620164
Energy: 1.0545202933559001
Energy: 1.0767158122339089
Energy: 0.8779258554263145
Energy: 1.079304085850154
Energy: 0.9832096136795724
Energy: 1.0954926740554842
Energy: 1.3470628996685419
Energy: 1.3050472487601932
Energy: 1.0956232580533016
Energy: 1.0320775601691277
Energy: 1.1096151806750976
Energy: 1.9138330207633125
Energy: 1.4617136899780188
Energy: 1.362329719063722
Energy: 1.9136759647503538
Energy: 1.5549577136297241
Energy: 1.6613238312611258
Energy: 1.224401126861949
Energy: 1.3263639727302363
Energy: 1.2884909124412904
Energy: 1.2245154300788579
Energy: 1.0302627343233193
Energy: 1.2165191246468492
Energy: 0.8825683110442185
Energy: 0.9223038905292276
Energy: 0.961620701352489
Energy: 0.8838130714848549
Energy: 0.884041301630408
Energy: 0.9502854257856855
Energy: 1.0117039924050792
Energy: 0.9048010843487688
Energy: 0.8820708266766374
Energy: 1.0096999782830667
Energy: 0.9230846377171862
Energy: 1.0101842493981914
Energy: 1.8247419830747282
Energy: 1.3356318446890842
Energy: 1.3361688812205572
Energy: 1.7750624659537324
Energy: 1.3678785496556363
Energy: 1.331070442031154

minimum gb energy = 0.8685082363396026 eV
minimum distance =  2.55344355730179 Angstroms
sigma value = 57


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

Energy: 0.4058471062486873
Energy: 1.4412761882181093
Energy: 0.4146540922071081
Energy: 0.40876437607267296
Energy: 1.441097765084778
Energy: 0.4063366300342505
Energy: 0.48488828452680394
Energy: 0.4464595514438969
Energy: 0.4468090038511891
Energy: 0.5875073125850826
Energy: 0.44574564931807653
Energy: 0.5605288860071721
Energy: 0.4876942746157705
Energy: 0.44702297705768324
Energy: 0.57453462271904
Energy: 0.48760404876911
Energy: 0.4469426516115799
Energy: 0.5741693319749408
Energy: 1.4765981236168828
Energy: 1.3044878536195477
Energy: 1.3035642189439123
Energy: 1.4770526133441337
Energy: 1.181386447236515
Energy: 1.3022954960875144
Energy: 0.484175577103272
Energy: 0.40667914186583354
Energy: 0.4069206065631134
Energy: 0.48509681582769315
Energy: 0.4065415799742767
Energy: 0.5736514710905892
Energy: 0.4476674148041324
Energy: 0.40641964353572113
Energy: 0.40656461400891136
Energy: 0.44748942018822735
Energy: 0.4064433938507128
Energy: 0.43453043348119424
Energy: 0.442827010918978
Energy: 0.5896325122457382
Energy: 0.5733911292253197
Energy: 0.4436689167592322
Energy: 0.48482068160243735
Energy: 0.5727175443631756
Energy: 1.1686920259955416
Energy: 1.2810435623479113
Energy: 1.2827463186537464
Energy: 1.1661311057600154
Energy: 1.4754142256535974
Energy: 1.285991951891038
Energy: 0.4860001806120283
Energy: 0.4916458904982285
Energy: 0.5900902499894471
Energy: 0.4867096140089128
Energy: 0.4878341392521221
Energy: 0.5896936480003506
Energy: 0.40631877936884536
Energy: 0.48757741879110766
Energy: 0.4144485720216813
Energy: 0.40640067346152564
Energy: 0.4874291345057901
Energy: 0.4066836280605657
Energy: 0.4063850506330686
Energy: 0.4472619261654689
Energy: 0.44712166511739837
Energy: 0.40651610763907814
Energy: 0.4474900705451392
Energy: 0.6287216142179635
Energy: 0.4860691776802002
Energy: 0.44686309618292674
Energy: 0.5741388532733571
Energy: 0.4865703221083759
Energy: 0.44604191733671417
Energy: 0.5739593595458148
Energy: 1.4758587833288617
Energy: 1.278804077518645
Energy: 1.2781561437687738
Energy: 1.4749299945024916
Energy: 1.1476487168782055
Energy: 1.2773420442814438
Energy: 0.4847984478161871
Energy: 0.573846102200467
Energy: 0.57356708883594
Energy: 0.4856939810125303
Energy: 0.587868617238093
Energy: 0.5742136057279563
Energy: 0.48779553589700564
Energy: 0.40621279473473293
Energy: 0.40630055746829896
Energy: 0.4875304634287825
Energy: 0.40896798983079863
Energy: 0.6347849745544645
Energy: 0.4456075582313227
Energy: 0.4460144195532095
Energy: 0.7743273355812843
Energy: 0.4459344068844527
Energy: 0.4067576760633946
Energy: 0.5609641684294254
Energy: 0.44703222697994327
Energy: 0.5743140211944014
Energy: 0.5745968786250244
Energy: 0.4466888900443448
Energy: 0.4887875869090717
Energy: 0.5741341393991733
Energy: 1.1749457545214752
Energy: 1.1994033527181311
Energy: 1.2989231939722843
Energy: 1.1752204066792546
Energy: 1.4751246646360956
Energy: 1.3000051343956553
Energy: 0.40640811319310677
Energy: 0.4867425863587328
Energy: 0.49022870223121556
Energy: 0.4065442740078071
Energy: 0.4855109246466566
Energy: 0.5734773793418523

minimum gb energy = 0.4058471062486873 eV
minimum distance =  2.60914193540906 Angstroms
sigma value = 11


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

Energy: 1.4449615139295162
Energy: 1.9290851150074035
Energy: 1.4248168844111864
Energy: 1.447682684983127
Energy: 1.9285615839427752
Energy: 1.570260398452389
Energy: 1.3589526054995122
Energy: 0.9297508580317426
Energy: 0.8594392881227347
Energy: 1.114922074240348
Energy: 0.924692947733427
Energy: 0.8489134319336751
Energy: 0.8838647834059001
Energy: 0.792067567552019
Energy: 0.8408513375810384
Energy: 0.853236779315657
Energy: 0.7740663386474842
Energy: 0.8545939458020261
Energy: 0.8606427426333906
Energy: 0.8810985706622156
Energy: 0.9914666629179129
Energy: 0.8625702556519529
Energy: 0.9807059767170231
Energy: 0.8669306337104838
Energy: 1.1086363634701368
Energy: 1.4561698739488365
Energy: 1.4105499990774482
Energy: 1.1032738806251257
Energy: 1.680572209978873
Energy: 1.0350335392565464
Energy: 1.7922368780181304
Energy: 1.6106632605547293
Energy: 1.424753082880771
Energy: 1.7801874644321187
Energy: 1.6343125780112802
Energy: 1.6510418859825402
Energy: 1.1121968695832978
Energy: 1.1648015883971725
Energy: 0.9864690112576082
Energy: 1.1147486926342864
Energy: 0.9493792921281484
Energy: 0.9761897421504891
Energy: 0.8064512621322123
Energy: 0.8414226441874183
Energy: 0.8925080524943673
Energy: 0.8127761240930975
Energy: 0.830510469399987
Energy: 1.0148276088090096
Energy: 1.4760981114822322
Energy: 0.8925362500076224
Energy: 0.8463186006408048
Energy: 1.4263116856415665
Energy: 1.01063410341511
Energy: 0.8594037617800154
Energy: 1.3275008694204138
Energy: 1.454515620699042
Energy: 1.3909632961949079
Energy: 1.3396200855294367
Energy: 1.456966484735873
Energy: 1.3790134328082182
Energy: 1.6715659285820355
Energy: 1.4718984659247234
Energy: 1.4357355517788128
Energy: 1.461763906383415
Energy: 1.4761758850018991
Energy: 1.2996890979062947
Energy: 1.2627709602534245
Energy: 1.118397063174599
Energy: 1.1919119670192477
Energy: 1.282113845566189
Energy: 1.1147717665805976
Energy: 1.1676040854351062
Energy: 1.0321441116743721
Energy: 1.0923031826592269
Energy: 1.074813989668773
Energy: 1.0329938654164246
Energy: 1.1183500362301226
Energy: 1.0434454131856323
Energy: 1.0663778134306257
Energy: 1.132912905822819
Energy: 1.0350183165637041
Energy: 1.0593735412774146
Energy: 1.4501006309644358
Energy: 1.0454259358441749
Energy: 1.2855053329424044
Energy: 1.2626745505472554
Energy: 1.1964653463676431
Energy: 1.2870411709169678
Energy: 1.283015067579426
Energy: 1.3219878168824097
Energy: 1.4021466916986611
Energy: 1.210895694314348
Energy: 1.206881118605282
Energy: 1.33664558005644
Energy: 1.3854911914188741
Energy: 1.2072705479557073
Energy: 1.1371788066652977
Energy: 1.322305510239783
Energy: 1.2556553950636435
Energy: 1.1391681462375045
Energy: 1.3235179640897607
Energy: 1.2937291430582907
Energy: 1.5798775479051383
Energy: 1.0798326929535704
Energy: 1.0800973089440193
Energy: 1.4194229067479416
Energy: 1.075212033572898
Energy: 1.1215959158580533
Energy: 1.3734592625618942
Energy: 0.9914922290381182
Energy: 0.9875958418836782
Energy: 1.2281535902407517
Energy: 0.9804582528876428
Energy: 1.0197381748298842
Energy: 0.9870549814749133
Energy: 1.0506445900390056
Energy: 1.1620462122070923
Energy: 0.9891809322321703
Energy: 1.0555065166406532
Energy: 1.197423509195089
Energy: 1.5575454253231715
Energy: 1.2836426852017502
Energy: 1.270696998663292
Energy: 1.3773044672801553
Energy: 1.556631745572433
Energy: 1.2731680722705971
Energy: 1.5795988328912038
Energy: 1.4450092618464128
Energy: 1.316758979421157
Energy: 1.5809550855850978
Energy: 1.466946325410418
Energy: 1.478763762932952
Energy: 1.1351819238371559
Energy: 1.186650654904475
Energy: 0.9884960645584238
Energy: 0.9993325960127338
Energy: 1.5792573291880927
Energy: 0.9888132186371107
Energy: 0.8318773327657286
Energy: 0.9751400555416443
Energy: 1.0209393260720585
Energy: 0.8327980513206749
Energy: 0.9713351822977088
Energy: 0.905784431492043
Energy: 1.0128208659013587
Energy: 0.951015612510388
Energy: 0.988489100330042
Energy: 0.9646923978287981
Energy: 0.9509062307911196
Energy: 1.017900031341624
Energy: 1.8432162478019891
Energy: 1.216408825412294
Energy: 1.1934785056335433
Energy: 1.7037804085272894
Energy: 1.5291530744292419
Energy: 1.3824672979552284

minimum gb energy = 0.7740663386474842 eV
minimum distance =  2.54344957596019 Angstroms
sigma value = 41


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

Energy: 1.3976417147571338
Energy: 1.8190757525305905
Energy: 1.5328577564667603
Energy: 1.3997528479250096
Energy: 1.8184972170757587
Energy: 1.2622022625586298
Energy: 1.4948959771891972
Energy: 1.0921726436439183
Energy: 1.1092366734284331
Energy: 1.146227816422308
Energy: 1.0918397028032916
Energy: 1.109340562039059
Energy: 0.8559122094350693
Energy: 0.9145399712273202
Energy: 0.9755049365413769
Energy: 0.8550224023227345
Energy: 0.8894492141975456
Energy: 0.9519313687666409
Energy: 0.9961518786173991
Energy: 1.0999841653567382
Energy: 1.08931590085267
Energy: 0.9344979755544595
Energy: 0.9993452622411029
Energy: 0.9234292988662474
Energy: 1.1051462262417606
Energy: 1.5470756431424064
Energy: 1.522387072870392
Energy: 1.1052198753330735
Energy: 1.6426446766976712
Energy: 1.0495403656794025
Energy: 1.2296589100189177
Energy: 1.5368343744858257
Energy: 1.388174655195965
Energy: 1.5930548257814077
Energy: 1.6907403385911914
Energy: 1.3799055352546756
Energy: 1.2431002594146519
Energy: 1.201150202843389
Energy: 1.16592089916632
Energy: 0.9980383382863828
Energy: 1.1869145715835574
Energy: 1.113378998217262
Energy: 0.9316379720019887
Energy: 0.991462009797272
Energy: 1.0749752133583659
Energy: 0.9341150131193887
Energy: 1.0014806657516515
Energy: 1.0833218504194777
Energy: 1.5644659061079151
Energy: 0.9504886911387577
Energy: 0.9454498760189569
Energy: 1.3390235367953642
Energy: 0.9593643532163441
Energy: 0.9683565735896098
Energy: 1.1831316176594657
Energy: 1.2872347928584082
Energy: 1.3312347495298984
Energy: 1.1844846723176328
Energy: 1.2875270039019344
Energy: 1.336223440724695
Energy: 1.452480294364127
Energy: 1.534496754407898
Energy: 1.4477780867915961
Energy: 1.4515898914295224
Energy: 1.5292919103258737
Energy: 1.1739115363174588
Energy: 1.5524887835194248
Energy: 1.2654296806532834
Energy: 1.2488918924509325
Energy: 1.535088133023595
Energy: 1.3514410147717704
Energy: 1.254807611801152
Energy: 1.2381048871356644
Energy: 1.2650216651166508
Energy: 1.2253404449835468
Energy: 1.2378525763990715
Energy: 1.3512261967541908
Energy: 1.1824266233428367
Energy: 0.9905936962167983
Energy: 1.1144889973538346
Energy: 0.9670018242450066
Energy: 0.991996776335923
Energy: 1.1367011466442132
Energy: 0.9670483571719052
Energy: 0.9639419858414938
Energy: 1.1741551077892995
Energy: 1.173294454099061
Energy: 0.9495043768003772
Energy: 1.165485285583733
Energy: 1.1251541498467872
Energy: 1.147458183341314
Energy: 1.1169126018990774
Energy: 1.1171074072226186
Energy: 1.1173681729011904
Energy: 1.2618352944660491
Energy: 1.1509548526361641
Energy: 1.4166876539215854
Energy: 1.7491864984715035
Energy: 1.5443691471459478
Energy: 1.4178260343363847
Energy: 1.6954554457294864
Energy: 1.4029691125921067
Energy: 1.881662102292969
Energy: 1.09431172213301
Energy: 1.1493353536482722
Energy: 1.4655399896592476
Energy: 1.0776304373982408
Energy: 1.3905109517470837
Energy: 1.098341751161823
Energy: 0.9031367465251697
Energy: 0.8960364024067415
Energy: 1.0997450815156855
Energy: 0.8926572630238009
Energy: 0.9374868924322608
Energy: 0.8741483379071661
Energy: 0.9255881098627127
Energy: 0.9386913632869687
Energy: 0.8757581217383082
Energy: 0.8588351108501158
Energy: 0.927201151512688
Energy: 0.9979491524340004
Energy: 1.0896065563214015
Energy: 0.8994304044621144
Energy: 0.9348528520815367
Energy: 1.1522141802911472
Energy: 0.9221310733378721
Energy: 1.7730489203716417
Energy: 1.6387115345076324
Energy: 1.4624169219220766
Energy: 1.7586705581526536
Energy: 1.6807067171042116
Energy: 1.4383788326171334
Energy: 1.2217870602317709
Energy: 1.1205392354718242
Energy: 1.097159884717619
Energy: 1.2004024612766282
Energy: 1.0788897748093376
Energy: 1.172605104407928
Energy: 0.9314778571986155
Energy: 1.0063718743706842
Energy: 1.0842986086620825
Energy: 0.9342479320753543
Energy: 1.0045601995766011
Energy: 1.0243684169013563
Energy: 1.463045775887537
Energy: 0.9506690114435007
Energy: 0.9452753439252374
Energy: 1.2075702073551584
Energy: 0.9501591844030096
Energy: 0.968343298068004
Energy: 1.4956700204733153
Energy: 1.1691871248975667
Energy: 1.2014757661610118
Energy: 1.2351880591056685
Energy: 1.1691937211189973
Energy: 1.2455990208347967
Energy: 1.165669989570469
Energy: 1.333793792443277
Energy: 1.365150915440624
Energy: 1.1829286219366997
Energy: 1.3338553411805552
Energy: 1.5640968118707521
Energy: 1.551214806689396
Energy: 1.2132648023403019
Energy: 1.1536596130237566
Energy: 1.5883943284851596
Energy: 1.1753677683297519
Energy: 1.2789002422615419
Energy: 1.3146076446065988
Energy: 1.3686513716329816
Energy: 1.3680664163953804
Energy: 1.315363520820895
Energy: 1.4032270063759962
Energy: 1.2483487334557604
Energy: 0.9919727406306169
Energy: 1.2620527920266273
Energy: 0.9673853498978964
Energy: 0.9925476719705293
Energy: 1.5299983922411584
Energy: 0.9889806965305646
Energy: 0.927253575390425
Energy: 1.1713863622802712
Energy: 1.0750857453228624
Energy: 0.9270476433714098
Energy: 1.1665385618175137
Energy: 1.0516878212719138
Energy: 1.106845786101281
Energy: 1.1564010652451588
Energy: 1.2327067876170898
Energy: 1.1407061798021463
Energy: 0.8884988184465897
Energy: 1.1885351080463729
Energy: 1.490414267540457
Energy: 1.2369569666400275
Energy: 1.434016160400566
Energy: 1.426634102829019
Energy: 1.2089521841158637
Energy: 1.4798965320386868

minimum gb energy = 0.8550224023227345 eV
minimum distance =  2.49380860518995 Angstroms
sigma value = 33


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

Energy: 1.1683105133816494
Energy: 1.6679514063640795
Energy: 1.3327932277422714
Energy: 1.1692397024329753
Energy: 1.6682462070689326
Energy: 1.4951868117218858
Energy: 1.192431462001958
Energy: 0.9956254018658492
Energy: 0.9740168340110874
Energy: 1.2672529060763316
Energy: 0.9269547978721847
Energy: 1.0137765509017145
Energy: 0.9639862696981399
Energy: 1.0264992553160364
Energy: 1.0276069962998373
Energy: 0.9651177523879535
Energy: 0.9982120244522594
Energy: 1.0193563512261836
Energy: 1.024078515035673
Energy: 1.120547349290044
Energy: 1.075029156069792
Energy: 1.0251514606047643
Energy: 1.157756626927153
Energy: 1.0068707283846563
Energy: 1.2022359785949512
Energy: 1.4742750736782018
Energy: 0.9895245105422162
Energy: 1.1960284271456538
Energy: 1.5636963810757756
Energy: 1.254777515958239
Energy: 1.6362945869083325
Energy: 1.3676332053542208
Energy: 1.2980293896327488
Energy: 1.6394925497070878
Energy: 1.4107996087858037
Energy: 1.3036851509960434
Energy: 1.2391797514022007
Energy: 1.2375835186511708
Energy: 1.168027453996314
Energy: 1.2778391685971775
Energy: 0.9852894974578053
Energy: 1.1317750332330374
Energy: 1.083743057374296
Energy: 1.1112728154693055
Energy: 1.1206330557536135
Energy: 1.0859880426580883
Energy: 1.201119991686763
Energy: 1.157146269138103
Energy: 1.642006775881358
Energy: 0.9908144173951402
Energy: 0.9890132812311597
Energy: 1.5100077561883187
Energy: 0.9668918022353298
Energy: 0.9694700690757434
Energy: 1.4083039450274062
Energy: 1.044571981069731
Energy: 1.097626876844214
Energy: 1.4098326722567613
Energy: 1.0467281117860545
Energy: 1.0977665944561141
Energy: 1.3128169747959906
Energy: 1.2996779410029369
Energy: 1.3156492502075279
Energy: 0.9661324306392423
Energy: 1.261228934661986
Energy: 1.3509971599373376
Energy: 1.418937319563138
Energy: 1.5361944445744056
Energy: 1.4200136523786293
Energy: 1.4188916377444327
Energy: 1.5906277096671342
Energy: 1.4114681907829854
Energy: 1.1933112505897654
Energy: 1.6070500608255385
Energy: 1.4123987649888827
Energy: 1.1938126797625985
Energy: 1.6077040959020032
Energy: 1.4114624127094944
Energy: 1.0105446378921767
Energy: 0.9899725784270706
Energy: 1.0172930667253997
Energy: 0.9371638560376551
Energy: 1.236563673919864
Energy: 0.9948005167509142
Energy: 0.9108210811284104
Energy: 0.9899261845349451
Energy: 1.034396805672655
Energy: 0.9691195786430854
Energy: 0.9803404724707592
Energy: 1.03428228471615
Energy: 1.3265065283391224
Energy: 1.0257316558147593
Energy: 1.0250856381197087
Energy: 1.4228991987225097
Energy: 1.0269022382267128
Energy: 0.9987956985478151
Energy: 1.4062414017772573
Energy: 1.6298066924198817
Energy: 1.1275809664805065
Energy: 1.408686478339246
Energy: 1.618425673889692
Energy: 1.2905086360540834
Energy: 1.6639820203636757
Energy: 1.3165332261678606
Energy: 1.3168230562964085
Energy: 1.550578223597629
Energy: 1.3413663501439945
Energy: 1.1032320742220707
Energy: 1.13792128014349
Energy: 1.1969671487814237
Energy: 1.0964569212627828
Energy: 1.2165236954708782
Energy: 1.0604953802555694
Energy: 1.1720556376004145
Energy: 1.0446585797570305
Energy: 1.1471447306587677
Energy: 1.0515940206229644
Energy: 1.0678472380364705
Energy: 1.048335147198394
Energy: 1.0981984286673538
Energy: 1.1239815119482335
Energy: 0.9743637873691828
Energy: 0.9685308600656011
Energy: 0.9980793411013964
Energy: 1.2865191419067121
Energy: 0.9478406714663152
Energy: 1.1031088011486572
Energy: 1.40336891344073
Energy: 1.3941598238915123
Energy: 1.1045601898090254
Energy: 1.4065771145959531
Energy: 1.1670806671062917
Energy: 1.209221346615133
Energy: 1.0958797819313182
Energy: 1.276297636523996
Energy: 1.2204217952153713
Energy: 1.3044480426189966
Energy: 1.3218382601740641
Energy: 1.2413027281240299
Energy: 1.6858887787558676
Energy: 1.3370482618615485
Energy: 1.7604030647958588
Energy: 1.6301687247232617
Energy: 1.4732978803842578
Energy: 1.6431268575901927
Energy: 0.9655231519860148
Energy: 0.9656055660349735
Energy: 1.2543318008224467
Energy: 1.1444598233189123
Energy: 1.0590528886420447
Energy: 0.9299537984439212
Energy: 0.9628591024621211
Energy: 0.9748453405187683
Energy: 0.9305212749763491
Energy: 0.9801953091682288
Energy: 0.9734533817702876
Energy: 1.025454674537706
Energy: 0.9630078739103118
Energy: 0.978733748590795
Energy: 0.9860559827318837
Energy: 0.9824918998871949
Energy: 0.9842793786704974
Energy: 1.0248861141510737
Energy: 1.1044224057365895
Energy: 1.082738720872631
Energy: 1.193967249011431
Energy: 1.4275376800511588
Energy: 1.0169088486377964
Energy: 1.6311315560938866
Energy: 1.365867026849997
Energy: 1.2217143947309967
Energy: 1.70608581059311
Energy: 1.4360127534568095
Energy: 1.1904878353235773
Energy: 1.2398958845768246
Energy: 1.0422140062027614
Energy: 1.124292345877274
Energy: 1.2793647372968318
Energy: 1.4995004067720707
Energy: 1.1216499627565526
Energy: 1.0830340860394558
Energy: 1.1128944152928484
Energy: 1.0166196664534943
Energy: 1.0562775999540122
Energy: 1.1826520903839077
Energy: 1.1799441482528779
Energy: 1.7023905333250466
Energy: 0.9900181730145031
Energy: 0.9880811962735517
Energy: 1.6816058870982453
Energy: 0.967552894400629
Energy: 0.9873813708082241
Energy: 1.4060026148097307
Energy: 1.044414822423588
Energy: 1.0966512725039694
Energy: 1.3318200506809361
Energy: 1.0445521767682886
Energy: 1.09670128382492
Energy: 1.3517805487199408
Energy: 1.18694000717136
Energy: 1.2633905384582826
Energy: 1.3615451339001325
Energy: 1.0731850088459012
Energy: 1.2823985106861158
Energy: 1.4192786043011845
Energy: 1.4351417767539254
Energy: 1.2353563990388639
Energy: 1.331211754740606
Energy: 1.2600420794753942
Energy: 1.26835306049077
Energy: 1.6032227978602367
Energy: 1.5647542650778996
Energy: 1.5658611345574553
Energy: 1.506475362876179
Energy: 1.7554642033739025
Energy: 1.3110849367895885
Energy: 1.0117302136707758
Energy: 1.4357495912843616
Energy: 0.9918604256992599
Energy: 0.9241740179722836
Energy: 1.2330790664043154
Energy: 0.992215510569457
Energy: 0.9389671625224094
Energy: 0.9713879986512324
Energy: 1.0343532713605794
Energy: 0.9400524532124755
Energy: 0.9861173067387028
Energy: 0.9992486514027944
Energy: 1.3239915432629514
Energy: 1.0258776897949826
Energy: 1.0052781547225218
Energy: 1.290012758362891
Energy: 1.0278169493556526
Energy: 1.0097593494155652
Energy: 1.4085802170417296
Energy: 1.2029311620430354
Energy: 1.2975459550282762
Energy: 1.4104412943491178
Energy: 1.4597361487256153
Energy: 1.366016615075889
Energy: 1.5467591439222195
Energy: 1.3126798673535565
Energy: 1.312489618786657
Energy: 1.5482589013082586
Energy: 1.3434904114247022
Energy: 1.1206310662505121
Energy: 1.1378827151359066
Energy: 1.1994377685935462
Energy: 1.0534278976058813
Energy: 1.3013650356014472
Energy: 1.1985230592960865
Energy: 1.1327101168057716
Energy: 1.11591090082487
Energy: 1.1569273488615197
Energy: 1.1847355629142948
Energy: 1.1171526366599505
Energy: 1.0578434850377243
Energy: 1.1430896261469017
Energy: 0.9936499041362229
Energy: 0.9736886285155253
Energy: 0.9684685777102041
Energy: 0.9949263989290157
Energy: 1.437250456017587
Energy: 0.9700357965662887
Energy: 1.1080199729780262
Energy: 1.4130325583645036
Energy: 1.4190794981546915
Energy: 1.1094518662086463
Energy: 1.4063375623161394
Energy: 1.254085726381922
Energy: 1.2063549793773283
Energy: 1.0960371276953529
Energy: 1.274927597437669
Energy: 1.207109240935605
Energy: 1.2393847609866881
Energy: 1.3202502255033026
Energy: 1.7562811983581972
Energy: 1.5334155059113304
Energy: 1.3111870220301387
Energy: 1.754691946662882
Energy: 1.5342447625806415
Energy: 1.4117650188513993

minimum gb energy = 0.9108210811284104 eV
minimum distance =  2.4891186575883 Angstroms
sigma value = 67


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

Energy: 1.2510316688208158
Energy: 1.3634549548160364
Energy: 0.8716799802935634
Energy: 1.2539972186664308
Energy: 1.3619461186795097
Energy: 1.276668709091576
Energy: 1.4850773559804669
Energy: 1.0308638652239215
Energy: 0.9528007248800344
Energy: 1.0909023495036376
Energy: 1.0308573576711872
Energy: 0.8050439824029549
Energy: 1.061870436557352
Energy: 1.0016690535586825
Energy: 1.1045519181747991
Energy: 1.0632208359232151
Energy: 1.0028586108557966
Energy: 1.1113802668881418
Energy: 1.0644378442017397
Energy: 1.0163341973426172
Energy: 1.143263459493484
Energy: 1.05997429860584
Energy: 1.355440850700805
Energy: 1.0067448627947064
Energy: 1.316770948930766
Energy: 1.1425230411823801
Energy: 1.1225332257413427
Energy: 1.321299274809229
Energy: 1.2869786338553415
Energy: 1.0173322908478806
Energy: 1.3216956966048727
Energy: 1.0654550923414
Energy: 1.551844742851261
Energy: 1.3212308393846297
Energy: 1.2458305288853795
Energy: 1.4626972434810606
Energy: 1.4307857118969054
Energy: 1.0720639684758038
Energy: 1.1588458264399775
Energy: 1.3607821642232394
Energy: 1.3504108627667153
Energy: 0.9685720552804752

minimum gb energy = 0.8050439824029549 eV
minimum distance =  2.52684408778804 Angstroms
sigma value = 3


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

Energy: 1.7026835030814924
Energy: 1.7565487294548112
Energy: 1.3933628787876506
Energy: 1.70357847556565
Energy: 1.791901429310749
Energy: 1.5479037779886966
Energy: 1.5528774238273573
Energy: 1.412027244142228
Energy: 1.542408980117497
Energy: 1.4558309990786256
Energy: 1.4881646741098664
Energy: 1.4360128795005063
Energy: 1.3467880296916852
Energy: 1.3911326946483482
Energy: 1.328173989814934
Energy: 1.3487155123387249
Energy: 1.4837554865274512
Energy: 1.3647722353769944
Energy: 0.9859956497240832
Energy: 1.2288122879164507
Energy: 1.019868529070601
Energy: 0.9874823009697935
Energy: 1.4778340345701244
Energy: 0.9223528503384493
Energy: 1.1482380253022328
Energy: 1.2459835039622504
Energy: 1.1804900821384194
Energy: 1.1301294786403384
Energy: 1.3758740502355218
Energy: 1.0766586316010072
Energy: 1.311241601603355
Energy: 1.3223963435058879
Energy: 1.2712746959130534
Energy: 1.3100739485809452
Energy: 1.3712782910896002
Energy: 1.3023981817846484
Energy: 1.5647918760811832
Energy: 1.2184040814580097
Energy: 1.249748375658599
Energy: 1.4620789822948055
Energy: 1.2631625237104642
Energy: 1.272216616470281
Energy: 1.5864397592197024
Energy: 1.5395662794631344
Energy: 1.3821080328639286
Energy: 1.5877246987039064
Energy: 1.492763951113406
Energy: 1.4620351212412395
Energy: 1.5532810949159488
Energy: 1.5451696482228248
Energy: 1.4549025957595292
Energy: 1.4898421665361232
Energy: 1.5369226334113901
Energy: 1.4832699969994316
Energy: 1.5639105398643198
Energy: 1.6251666325895338
Energy: 1.3298319447811675
Energy: 1.5569899357174486
Energy: 1.6734839392129899
Energy: 1.5641177251052438
Energy: 1.1771119265792271
Energy: 1.3520247503735818
Energy: 1.2057009468951894
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Energy: 1.5522976629957317
Energy: 1.1909275888852728
Energy: 1.4312065894674886
Energy: 1.284082353465603
Energy: 1.3096473502641535
Energy: 1.381599234562494
Energy: 1.3379477316023465
Energy: 1.2548388326922466
Energy: 1.4208288332506533
Energy: 1.1228061159236653
Energy: 1.1213054280657302
Energy: 1.4098725307518523
Energy: 1.116348199405586
Energy: 1.1841516976117408
Energy: 1.6188560053803505
Energy: 0.9543892561969849
Energy: 0.9491795676608363
Energy: 1.5288619875620248
Energy: 0.9494614259157457
Energy: 0.9492682010973608
Energy: 1.43617965863238
Energy: 1.0664422065011827
Energy: 1.2762641075055379
Energy: 1.437943937415581
Energy: 1.066325957625261
Energy: 1.336329486974684
Energy: 1.4787102990207726
Energy: 1.4730155635495783
Energy: 1.3858523443215196
Energy: 1.4805709332508608
Energy: 1.4380718828149253
Energy: 1.4942787077095343
Energy: 1.5720803791126259
Energy: 1.7721882199549157
Energy: 1.393422169334411
Energy: 1.5637373186502932
Energy: 1.82532118513309
Energy: 1.581240673987771
Energy: 1.5139913788293118
Energy: 1.400651220615588
Energy: 1.4942819799554994
Energy: 1.494958708769844
Energy: 1.3793249323053054
Energy: 1.5605629099890188
Energy: 1.7447804443329717
Energy: 1.3936336396234348
Energy: 1.4239745253674037
Energy: 1.6997575648628764
Energy: 1.3717654693978205
Energy: 1.4019047898774337
Energy: 1.5514213685726288
Energy: 1.0739153177474823
Energy: 1.1253872487956533
Energy: 1.7372889585478097
Energy: 1.0799901330496702
Energy: 1.2759132803594162
Energy: 1.494287761527257
Energy: 1.1592006349319406
Energy: 1.2125112107942295
Energy: 1.4226541522202791
Energy: 1.143661449918214
Energy: 1.1400304575513582
Energy: 1.198840597130861
Energy: 1.3203591069058298
Energy: 1.321783541759075
Energy: 1.2290708123042007
Energy: 1.3124053048268087
Energy: 1.3038266384481254
Energy: 1.0672553195394507
Energy: 1.3440488806734814
Energy: 1.0533583218518632
Energy: 1.0691767018883123
Energy: 1.5515830477324788
Energy: 1.021035203874531
Energy: 1.2671645758584964
Energy: 1.5359564816040383
Energy: 1.2871975585093238
Energy: 1.2688775166601287
Energy: 1.5278580508477135
Energy: 1.2876346739361622
Energy: 1.508781031554445
Energy: 1.426162937496541
Energy: 1.4568354156698209
Energy: 1.4362640921948728
Energy: 1.5948001221586847
Energy: 1.4299282633528028
Energy: 1.713132664494713
Energy: 1.455675899879851
Energy: 1.4374775166045823
Energy: 1.7159058114464516
Energy: 1.4148145918313775
Energy: 1.4541450879890327
Energy: 1.7120943322396578
Energy: 1.3588051526092437
Energy: 1.3478012239724297
Energy: 1.8293623840561557
Energy: 1.3749201099120403
Energy: 1.3447234197179057
Energy: 1.4941003447423247
Energy: 1.4402095405120923
Energy: 1.3823183252074556
Energy: 1.4542247241361859
Energy: 1.384913354747385
Energy: 1.3436205499160703
Energy: 1.1453161994596488
Energy: 1.4536540360247627
Energy: 1.2947112901476965
Energy: 1.146729162003759
Energy: 1.438930721473126
Energy: 1.2296637464863536
Energy: 0.9625651206954906
Energy: 1.303847249403718
Energy: 0.9656993019183097
Energy: 0.9646358121470199
Energy: 1.5819836674962136
Energy: 0.9481338664836927
Energy: 1.1394183691969042
Energy: 1.3248275200886568
Energy: 1.2916672316944602
Energy: 1.1381371807971417
Energy: 1.320553890293682
Energy: 1.2970129772301497
Energy: 1.479419592183467
Energy: 1.2560078863141808
Energy: 1.2300808776553975
Energy: 1.3579131163604832
Energy: 1.3337351376506412
Energy: 1.2919812286121413
Energy: 1.705038143563777
Energy: 1.2932209768570182
Energy: 1.2717478433851321
Energy: 1.6937926895278177
Energy: 1.340657388023516
Energy: 1.365350018326605
Energy: 1.751081533116081
Energy: 1.464749027526804
Energy: 1.4713357642077263
Energy: 1.7247162831381162
Energy: 1.5088114479899837
Energy: 1.5878393946517257
Energy: 1.459798427228132
Energy: 1.3799859424217158
Energy: 1.4611916148749784
Energy: 1.4668567324643225
Energy: 1.359613543294656
Energy: 1.5069020111244606
Energy: 1.3863631623234343
Energy: 1.5117575688394829
Energy: 1.326159030369581
Energy: 1.3617801311928257
Energy: 1.6769307328551393
Energy: 1.4104620757215616
Energy: 1.325753026083698
Energy: 1.367926391750336
Energy: 1.2158454895932576
Energy: 1.2596561650145508
Energy: 1.5312383691295848
Energy: 1.2547721813242694
Energy: 1.3274346968306003
Energy: 1.112856373856437
Energy: 1.2311275708923834
Energy: 1.3066374034913382
Energy: 1.1104431882015269
Energy: 1.3168394783224668
Energy: 1.53680343188691
Energy: 0.9318558147743656
Energy: 0.9219076832615155
Energy: 1.504780885550443
Energy: 1.0002502830370783
Energy: 1.0061289718802184
Energy: 1.502780384089282
Energy: 1.1309961446585586
Energy: 1.1233538017970723
Energy: 1.4659651434339198
Energy: 1.1274040749112708
Energy: 1.181971950342764
Energy: 1.597414441224979
Energy: 1.3751644829779541
Energy: 1.3827058539278505
Energy: 1.5662077593096846
Energy: 1.3848077130946095
Energy: 1.320497242602273
Energy: 1.429088524127892
Energy: 1.4504294255318058
Energy: 1.4693470421416943
Energy: 1.3995274403196063
Energy: 1.8575985101282015
Energy: 1.3776515915264214
Energy: 1.5922646052228642
Energy: 1.6346235169982655
Energy: 1.3934799029301983
Energy: 1.5930218163675494
Energy: 1.8990902266811842
Energy: 1.603433441901326
Energy: 1.6469710368105688
Energy: 1.4854160307906439
Energy: 1.4356994280331379
Energy: 1.5663767598461023
Energy: 1.457470326988702
Energy: 1.4577865140114132
Energy: 1.4834304599108967
Energy: 1.1838495478280127
Energy: 1.2555184478639718
Energy: 1.4851740412355046
Energy: 1.19420050491092
Energy: 1.3789353803510302
Energy: 1.5759498828852552
Energy: 1.0248916197314675
Energy: 1.0029121955504778
Energy: 1.4812928508063823
Energy: 1.0099337958902517
Energy: 1.0030721524883932
Energy: 1.3405025204655598
Energy: 1.1811590152715792
Energy: 1.2077050283912851
Energy: 1.2636489453601065
Energy: 1.2164704113242104
Energy: 1.2863064441425736
Energy: 1.211063271233488
Energy: 1.2864963795103288
Energy: 1.252302543626271
Energy: 1.2076420483989543
Energy: 1.294058685880053
Energy: 1.1176544972733704
Energy: 1.0212400960648789
Energy: 1.5190803053761963
Energy: 1.2873393771809483
Energy: 1.0865532870827133
Energy: 1.606774076988317
Energy: 1.0979161707703542
Energy: 1.5494547934195773
Energy: 1.5589904544326763
Energy: 1.3513365412669285
Energy: 1.450521726913342
Energy: 1.6460721689101065
Energy: 1.4548244332563909
Energy: 1.5614366275440956
Energy: 1.4596730943623368
Energy: 1.599292198492687
Energy: 1.4619039970054282
Energy: 1.540718517757204
Energy: 1.4788915405831868

minimum gb energy = 0.9219076832615155 eV
minimum distance =  2.51470921633672 Angstroms
sigma value = 81


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

Energy: 1.6427360568818752
Energy: 1.4779777603696311
Energy: 1.087041321543595
Energy: 1.6388639933926636
Energy: 1.4781176834865604
Energy: 1.395466921711395
Energy: 1.5502969226607424
Energy: 1.0305866433950017
Energy: 1.030427584086689
Energy: 1.4317585790644096
Energy: 1.0317026165841578
Energy: 0.9267054235252373
Energy: 1.1292400918838552
Energy: 1.1097372496794333
Energy: 1.2169075212679918
Energy: 1.1158104218525187
Energy: 1.1583301467194063
Energy: 1.3185369245111236
Energy: 1.0396610986150847
Energy: 1.2423050543672658
Energy: 1.0987663588200591
Energy: 1.0412847904411198
Energy: 1.348193144993512
Energy: 0.9007895658768176
Energy: 1.0283472818022454
Energy: 1.339349597510293
Energy: 0.992878628271022
Energy: 1.0283164153643156
Energy: 1.3090769272868705
Energy: 0.9693671353208484
Energy: 1.3350266501499817
Energy: 1.221378494338889
Energy: 1.2213780460794788
Energy: 1.3369233018261293
Energy: 1.3092478619318648
Energy: 1.2211180333003175
Energy: 1.2392553047857804
Energy: 1.0216291217513322
Energy: 0.9079795004132283
Energy: 1.2544355491022445
Energy: 1.0208286124629509
Energy: 1.1882880925972636
Energy: 1.3743994656216678
Energy: 1.4375038435025436
Energy: 1.6278815883097157
Energy: 1.3751724932666722
Energy: 1.4387418189575345
Energy: 1.1675755688250091
Energy: 1.2518265590113864
Energy: 0.9063931689767198
Energy: 1.3949082761379086
Energy: 1.2535911047133568
Energy: 1.3793961588424029
Energy: 1.327027814422537
Energy: 1.3711231094586123
Energy: 1.4567440752136955
Energy: 1.360830606339159
Energy: 1.2281492002735706
Energy: 1.6680603628893247
Energy: 1.2179524042772873
Energy: 1.031517034293957
Energy: 1.5419111796432068
Energy: 1.1337212262597542
Energy: 1.0315443330588514
Energy: 1.546557248034286
Energy: 0.9890362934117656
Energy: 1.1425997638352918
Energy: 1.3018851701314766
Energy: 1.293000535029051
Energy: 1.1428778978870142
Energy: 1.1707877460217782
Energy: 1.302336161761066
Energy: 1.1568949498918746
Energy: 1.062569664036408
Energy: 1.0734637864839471
Energy: 1.1116951252804206
Energy: 1.0627871724895046
Energy: 1.300813437414952
Energy: 1.337316375081679
Energy: 0.9877410633086572
Energy: 0.9720402725922586
Energy: 1.334603288918795
Energy: 0.9040831765609925
Energy: 0.9690773209858473
Energy: 1.3780027813292708
Energy: 1.3011173605863313
Energy: 1.3182169483047683
Energy: 1.3926883891645212
Energy: 1.2489749537596846
Energy: 1.2940272117259892
Energy: 1.207732006833106
Energy: 1.1990177055815294
Energy: 1.1808974285353069
Energy: 1.209000292469418
Energy: 1.2545051912620089
Energy: 1.253196411726899
Energy: 1.4242658512569388
Energy: 1.376213809866557
Energy: 1.1672427550274371
Energy: 1.429211565183292
Energy: 1.3800140447584859
Energy: 1.16725927881448
Energy: 1.2002801419215416
Energy: 1.3668034606749773
Energy: 1.3287286810644214
Energy: 1.1901676405572232
Energy: 1.2524397448918407
Energy: 1.3959609859921334
Energy: 1.6953812553222831
Energy: 1.2281546701699946
Energy: 1.0851700542712044
Energy: 1.5833043052566396
Energy: 1.2272363601673217
Energy: 1.1336348456105312
Energy: 1.6945559420386547
Energy: 0.9898855725113458
Energy: 1.1417534498053519
Energy: 1.6409402569282294
Energy: 1.0316084923105242
Energy: 1.1367018083068758
Energy: 1.3617752290674805
Energy: 1.040997658901785
Energy: 1.134166281020378
Energy: 1.36296131357677
Energy: 1.041287498332504
Energy: 1.1350350315876658
Energy: 1.1081372264057203
Energy: 1.1143340631500092
Energy: 1.244618675231713
Energy: 1.109410601237785
Energy: 1.1142179273402164
Energy: 1.2435083499647954
Energy: 0.8987835210624908
Energy: 1.1617270872014314
Energy: 0.9693096751587855
Energy: 0.8999960218662278
Energy: 1.3362638196885717
Energy: 0.9676576598976381
Energy: 1.0832690334727695
Energy: 1.4182523849585114
Energy: 1.2685203239953244
Energy: 1.098686600825002
Energy: 1.3935960721249936
Energy: 1.0796651055354416
Energy: 1.200073643455966
Energy: 1.3261101269614122
Energy: 1.269195094683979
Energy: 1.1376317055613379
Energy: 1.3375747465122232
Energy: 1.2257149202363435
Energy: 1.5018114467509414
Energy: 1.3231756736477376
Energy: 1.3249530473704616
Energy: 1.5183618483220784
Energy: 1.3242208291538267
Energy: 1.3829910394955691
Energy: 1.4462274381801772
Energy: 1.3041456667511275
Energy: 1.3896014526580718
Energy: 1.447668950839352
Energy: 1.3042781567501223
Energy: 1.3896247953465204
Energy: 1.3625402284426233
Energy: 1.251786686875349
Energy: 1.2158963941746956
Energy: 1.362199639904643
Energy: 1.5117003485215341
Energy: 1.2043891962952662
Energy: 1.1275556294893871
Energy: 1.3909289620451957
Energy: 1.4692223271168263
Energy: 1.0830557442538482
Energy: 1.6673939357764174
Energy: 1.084505942577496
Energy: 1.0410034682285219
Energy: 1.1028873775679997
Energy: 0.9260064272173127
Energy: 1.0421882602821673
Energy: 1.4230602171851794
Energy: 1.1361600613665128
Energy: 1.10964202068935
Energy: 1.108445495914873
Energy: 1.337295764432108
Energy: 1.1125076238925862
Energy: 1.1082932833208279
Energy: 1.2459666304353403
Energy: 1.4156103680923435
Energy: 0.9005494668267523
Energy: 0.9001393632150122
Energy: 1.3106790160996098
Energy: 0.9138821230156257
Energy: 0.9000497916280092
Energy: 1.3904442378896895
Energy: 1.061000668016193
Energy: 1.07986954505662
Energy: 1.3923182460089412
Energy: 1.0639679070204262
Energy: 1.0832550256184015
Energy: 1.3350855465796534
Energy: 1.2277952289973286
Energy: 1.182272167416645
Energy: 1.3283095868785886
Energy: 1.3200214467594624
Energy: 1.203240801217117
Energy: 0.9063227216360006
Energy: 1.2031037406440526
Energy: 1.2214156785348813
Energy: 1.0225787433433193
Energy: 1.7099430797448694
Energy: 1.1400721225215864
Energy: 1.5446925071109658
Energy: 1.3904516769770334
Energy: 1.1673979339200744
Energy: 1.434996781877008
Energy: 1.3765978799713041
Energy: 1.639968499454363
Energy: 1.4243493344416502
Energy: 1.2004065660785952
Energy: 1.2473216440050714
Energy: 1.424733038442884
Energy: 1.2010893844902069
Energy: 1.1245244212000245
Energy: 1.639523093453971
Energy: 1.1252864044275754
Energy: 1.083522048716754
Energy: 1.6411908964246293
Energy: 1.12528888609384
Energy: 1.2366369422815253

minimum gb energy = 0.8987835210624908 eV
minimum distance =  2.52505703432761 Angstroms
sigma value = 43


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

Energy: 1.6973439930488834
Energy: 1.7008029243163865
Energy: 1.3438339959889767
Energy: 1.697235269920973
Energy: 1.7597897303033088
Energy: 1.225244519861756
Energy: 1.6582218648347518
Energy: 1.3126893610429284
Energy: 1.1790413565301785
Energy: 1.4810190233175053
Energy: 1.3128235785135125
Energy: 1.2856830187784731
Energy: 1.384272749630161
Energy: 1.4313054856778658
Energy: 1.3417334995713412
Energy: 1.3223816889361821
Energy: 1.476538374703567
Energy: 1.3743718254841466
Energy: 1.0080766773471626
Energy: 1.2319159395737074
Energy: 1.0187934631831301
Energy: 0.9509529980573866
Energy: 1.4363487850315517
Energy: 0.9360437608268694
Energy: 1.1838688949102665
Energy: 1.2429795322157302
Energy: 1.2112527326910738
Energy: 1.1335997623022536
Energy: 1.2815294434005386
Energy: 1.1439036227592065
Energy: 1.3614735933468973
Energy: 1.189721565127973
Energy: 1.1464817865278134
Energy: 1.3399219195191956
Energy: 1.1876022761171108
Energy: 1.1682979767034096
Energy: 1.4355131031702058
Energy: 0.9509761727459357
Energy: 0.9503981826656965
Energy: 1.421406407355877
Energy: 0.9519200715292827
Energy: 0.9506244095145157
Energy: 1.4984909106255822
Energy: 1.0959100087370117
Energy: 1.1550335875134743
Energy: 1.4634634080842883
Energy: 1.2047635764044848
Energy: 1.3843627889901475
Energy: 1.4449344960603385
Energy: 1.2435503220042066
Energy: 1.3830830256412865
Energy: 1.3724787745310503
Energy: 1.3539352253952852
Energy: 1.379525017094922
Energy: 1.5296945351226727
Energy: 1.5685568096329667
Energy: 1.3769415164881416
Energy: 1.5352242407376302
Energy: 1.7166450820271737
Energy: 1.3215659859026667
Energy: 1.4101531458533147
Energy: 1.4094039703037877
Energy: 1.3899542313679902
Energy: 1.3644964469817624
Energy: 1.6119180087014873
Energy: 1.3865556299923638
Energy: 1.491617613564896
Energy: 1.2946403846193062
Energy: 1.334781410805129
Energy: 1.5407611835534494
Energy: 1.2949920784074145
Energy: 1.3926382311829795
Energy: 1.620226247102535
Energy: 1.138242802504552
Energy: 1.1560977047257899
Energy: 1.6224287243016373
Energy: 1.1382904555107929
Energy: 1.272947015444281
Energy: 1.4339566926469776
Energy: 1.0872704802231312
Energy: 1.1705252883569808
Energy: 1.4555951242701497
Energy: 1.0893018049709866
Energy: 1.1824628084705844
Energy: 1.1488305872984235
Energy: 1.3267337070055527
Energy: 1.3263490556805737
Energy: 1.1449839118843579
Energy: 1.2274295303554978
Energy: 1.2568508955380302
Energy: 0.9570743286285666
Energy: 1.2607019453082098
Energy: 0.9171799135925593
Energy: 0.9564308730673858
Energy: 1.3331431495833472
Energy: 0.9194735333684314
Energy: 1.1102857420496675
Energy: 1.4733058322913872
Energy: 1.2837310711354757
Energy: 1.1077589035162732
Energy: 1.4092431890077155
Energy: 1.1365010654233763
Energy: 1.363779293493585
Energy: 1.245591778630618
Energy: 1.3133983653024204
Energy: 1.3234325478148854
Energy: 1.2254385451330316
Energy: 1.2908311888211954
Energy: 1.6653504385025293
Energy: 1.2226515103062814
Energy: 1.2224203117721564
Energy: 1.6570865007924913
Energy: 1.192968932711817
Energy: 1.2369937597753022
Energy: 1.6584079782986645
Energy: 1.365880541000218
Energy: 1.3870535691919021
Energy: 1.597823314291803
Energy: 1.3669267812642196
Energy: 1.4180227444306726
Energy: 1.3546574851560773
Energy: 1.2257824921075686
Energy: 1.4151510726022192
Energy: 1.376428474394109
Energy: 1.3886076200392192
Energy: 1.364547909002351
Energy: 1.4495118146896604
Energy: 1.5353081749646598
Energy: 1.2976061106125667
Energy: 1.4524244576321572
Energy: 1.574150759363018
Energy: 1.206859518164157
Energy: 1.229809917125449
Energy: 1.20911569334043
Energy: 1.1623320643875161
Energy: 1.1923035921336842
Energy: 1.3888470796035437
Energy: 1.141611221624653
Energy: 1.4248181948432028
Energy: 1.2030973928177875
Energy: 1.2983267581165034
Energy: 1.4085330112573566
Energy: 1.2039244238687812
Energy: 1.3710284013060883
Energy: 1.4314711338961694
Energy: 0.9108342453792897
Energy: 0.9107721099610818
Energy: 1.4383911278857267
Energy: 0.9511941522118138
Energy: 0.9113597910338961
Energy: 1.422293391615073
Energy: 1.1179950075123337
Energy: 1.1182403220909136
Energy: 1.3562644311620062
Energy: 1.0827783532441018
Energy: 1.144842021415782
Energy: 1.3082342774697056
Energy: 1.324841992022219
Energy: 1.2477960115409559
Energy: 1.2934252258029524
Energy: 1.281022826676733
Energy: 1.2000535788182662
Energy: 1.074733930174164
Energy: 1.3190100234970892
Energy: 1.0404352761317786
Energy: 1.0596041420185167
Energy: 1.394257590364844
Energy: 1.007548676904448
Energy: 1.4198458831248901
Energy: 1.4932680663041888
Energy: 1.3513451264937135
Energy: 1.3550635194747427
Energy: 1.520122328899512
Energy: 1.3340612447540774
Energy: 1.4346129818954545
Energy: 1.3079478155370103
Energy: 1.4411253240596884
Energy: 1.3407551392057868
Energy: 1.420984838401386
Energy: 1.2307657303909603
Energy: 1.7631613830890787
Energy: 1.6395771552420007
Energy: 1.4395324506865679
Energy: 1.755063521759756
Energy: 1.6090578248805654
Energy: 1.439206977041238

minimum gb energy = 0.9107721099610818 eV
minimum distance =  2.52046502549112 Angstroms
sigma value = 57


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

Energy: 1.523760335309517
Energy: 1.4420143431970383
Energy: 1.1160548440780458
Energy: 1.4544229931413353
Energy: 1.633181953715757
Energy: 1.5258074037463203
Energy: 1.4745062148613612
Energy: 1.1005623575448495
Energy: 1.100719193567342
Energy: 1.3669050719374172
Energy: 1.0609225951240242
Energy: 1.162026926984584
Energy: 1.3509875556764854
Energy: 1.2723375119981188
Energy: 1.186078422719367
Energy: 1.2319535441642566
Energy: 1.4004722096500133
Energy: 1.2398810507485134
Energy: 0.9664616191116905
Energy: 1.3166900476505379
Energy: 1.3613273508622303
Energy: 0.9680433268357163
Energy: 1.425097913102634
Energy: 0.9644153276937222
Energy: 1.1711207151488556
Energy: 1.1749064215424567
Energy: 1.175044497925398
Energy: 1.1059041092791815
Energy: 1.2684211877853107
Energy: 1.0525519361794637
Energy: 1.2259906395128095
Energy: 1.1199247012012599
Energy: 1.1593357033999214
Energy: 1.2955837371250714
Energy: 1.119610210236565
Energy: 1.161038412574013
Energy: 1.2925796989499636
Energy: 0.9625424533257878
Energy: 0.962996581028169
Energy: 1.2944139718532017
Energy: 0.9650546348250395
Energy: 0.9642543409243522
Energy: 1.3230425882592916
Energy: 1.3069266205987353
Energy: 1.317687672347346
Energy: 1.3216552659198328
Energy: 1.1708469232115017
Energy: 1.3924320130000882
Energy: 1.196153981176715
Energy: 1.19712712142028
Energy: 1.0477326345447948
Energy: 1.2212239500059883
Energy: 1.1810254000285014
Energy: 1.3085759112170003
Energy: 1.3053561105133262
Energy: 1.4859515967371646
Energy: 1.4218981459935642
Energy: 1.3060818153775307
Energy: 1.5297082673726066
Energy: 1.2758496255845313
Energy: 1.211628394967041
Energy: 1.1724291996359781
Energy: 1.3052678442290155
Energy: 1.2121219650406672
Energy: 1.2994011028027355
Energy: 1.3047938378276307
Energy: 1.4213267080732852
Energy: 1.1804627950326547
Energy: 1.1787561876288546
Energy: 1.4233536330953165
Energy: 1.3834547920409808
Energy: 1.2718263484062913
Energy: 1.767919220742856
Energy: 1.1452358244777932
Energy: 1.174549920930024
Energy: 1.5996510048724033
Energy: 1.149163561288185
Energy: 1.2827859333947262
Energy: 1.4463274232847347
Energy: 1.05909465561131
Energy: 1.1837261889450548
Energy: 1.3786399444851316
Energy: 1.1494893092249845
Energy: 1.1363242789759722
Energy: 1.1900208077561005
Energy: 1.3230257439630622
Energy: 1.3502547411818404
Energy: 1.1905119204148775
Energy: 1.3224837480699514
Energy: 1.2141645380055863
Energy: 0.9257649524585319
Energy: 1.1243664533705704
Energy: 0.9716333147574234
Energy: 0.9270034271449236
Energy: 1.378059062610643
Energy: 1.0160686957253833
Energy: 1.2747608088881783
Energy: 1.2811334834515868
Energy: 1.2307444021889076
Energy: 1.209765218606387
Energy: 1.2882056536067827
Energy: 1.1550823700431678
Energy: 1.4126101244018854
Energy: 0.9289297429220075
Energy: 0.9285549873103454
Energy: 1.3896029305826962
Energy: 1.0215866597758267
Energy: 1.0418622727393778
Energy: 1.3875192645685945
Energy: 0.964471967550737
Energy: 0.9727656630381148
Energy: 1.3620556232007819
Energy: 0.9647677802713892
Energy: 0.9731801721812602
Energy: 1.6050037860889743
Energy: 1.2595104561187895
Energy: 1.2119745298832407
Energy: 1.3598483310025176
Energy: 1.227010681820535
Energy: 1.3092701182860953
Energy: 1.2238349402667836
Energy: 1.0431623317625636
Energy: 1.0430426341807666
Energy: 1.2208191327118234
Energy: 1.5580413982707593
Energy: 1.1171517313210546
Energy: 1.4767071042875988
Energy: 1.425050500606412
Energy: 1.2460165226757538
Energy: 1.4781512532544383
Energy: 1.543218948388274
Energy: 1.1847080090060023
Energy: 1.3715257506466205
Energy: 1.058861705474736
Energy: 1.1842991624884767
Energy: 1.3724414172759485
Energy: 1.2128406108713132
Energy: 1.0595390911994143
Energy: 1.7675917975918025
Energy: 1.2500034426145126
Energy: 1.135090186376199
Energy: 1.5994284005367194
Energy: 1.2484858733498971
Energy: 1.231194150405729

minimum gb energy = 0.9257649524585319 eV
minimum distance =  2.4862762790334 Angstroms
sigma value = 17


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

Energy: 1.427839516010087
Energy: 1.4776435070120895
Energy: 1.089399009510604
Energy: 1.4292492194016366
Energy: 1.4776631932366855
Energy: 1.310685591405854
Energy: 1.3907820857697772
Energy: 1.1531633056786617
Energy: 1.1019747839928138
Energy: 1.2515888425184383
Energy: 1.1555834152804974
Energy: 1.2434441344619522
Energy: 1.2931102663462473
Energy: 1.2237646313503847
Energy: 1.1538260722611584
Energy: 1.1892532394767261
Energy: 1.407586502743027
Energy: 1.1691106434548713
Energy: 0.9681322236870531
Energy: 1.174027823325386
Energy: 1.1740113460389539
Energy: 0.9691622220900491
Energy: 1.2569493290883267
Energy: 0.9658848176322924
Energy: 1.0785618966446013
Energy: 1.2371443527579344
Energy: 1.09251700610274
Energy: 1.0784455169000344
Energy: 1.25843309490348
Energy: 1.139510548410014
Energy: 1.3413087949425613
Energy: 0.8909924381407407
Energy: 1.0741918974643143
Energy: 1.3160493790899805
Energy: 0.9592518260937563
Energy: 1.1878016267534375
Energy: 1.2378658918060206
Energy: 0.8242992561428983
Energy: 0.853959246611791
Energy: 1.2172630321552453
Energy: 0.8278306467284751
Energy: 0.9776827663064366
Energy: 1.2892768731015327
Energy: 1.1804413759346348
Energy: 1.2069352767440227
Energy: 1.290972486216265
Energy: 1.1774284001873065
Energy: 1.2081851046982828
Energy: 0.8961912607594066
Energy: 1.1850122946891701
Energy: 1.0478782769185953
Energy: 0.8977285674698678
Energy: 1.196716286358698
Energy: 0.8247647940245135
Energy: 1.0293630207101743
Energy: 1.2517102985162272
Energy: 1.0994645172233588
Energy: 0.953921050096555
Energy: 1.3337430225076203
Energy: 1.1011511536251488
Energy: 1.3844478047087176
Energy: 1.1954989847096837
Energy: 1.133686080154636
Energy: 1.2649478182780354
Energy: 1.1866464632624083
Energy: 1.1085461389586109
Energy: 1.467343745422147
Energy: 0.9655429992315779
Energy: 0.9663922319407732
Energy: 1.35000036468327
Energy: 0.969024013403821
Energy: 0.9659407880557708
Energy: 1.440044177257518
Energy: 1.1889680911061424
Energy: 1.2047261080809701
Energy: 1.4415876714675666
Energy: 1.1916595026334493
Energy: 1.2701179126562452
Energy: 1.172225533387539
Energy: 1.3465737852416044
Energy: 1.1634389715468834
Energy: 1.173679368387815
Energy: 1.3483811658138454
Energy: 1.2361792742258333
Energy: 1.2920654000353857
Energy: 1.4807743202371284
Energy: 1.1440655908342987
Energy: 1.2926763537588715
Energy: 1.4818848888439515
Energy: 1.1451781452631833
Energy: 1.2853621196814642
Energy: 1.1615425083937696
Energy: 1.2195639636140345
Energy: 1.2870675427229037
Energy: 1.345413706642159
Energy: 1.1783137856437604
Energy: 1.531407004029418
Energy: 1.1882909163252018
Energy: 1.1194169021237723
Energy: 1.5005108219705041
Energy: 1.245954312616021
Energy: 1.186021783096516

minimum gb energy = 0.8242992561428983 eV
minimum distance =  2.52914610252403 Angstroms
sigma value = 17


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

Energy: 1.4889153002438307
Energy: 1.3587070123866836
Energy: 1.3351961320126604
Energy: 1.5261603182876011
Energy: 1.3595374451169522
Energy: 1.202300505364647
Energy: 1.3366712571366686
Energy: 1.0412790107065455
Energy: 0.9952935648369646
Energy: 1.1874159916009968
Energy: 1.0830096298259035
Energy: 1.2191813852340734
Energy: 1.1787952181324652
Energy: 1.2515567756172297
Energy: 1.1107364503590518
Energy: 1.1799736534438814
Energy: 1.347807508924603
Energy: 1.087072880149783
Energy: 0.9183757953553873
Energy: 1.0428004474188108
Energy: 0.9396137877517375
Energy: 0.9196514951777671
Energy: 1.291182898291717
Energy: 0.93315930470499
Energy: 1.1260090713411421
Energy: 1.1531618310567537
Energy: 1.153007271981988
Energy: 1.1261137153928864
Energy: 1.200836728940912
Energy: 1.0966113279627672
Energy: 1.3533072304564895
Energy: 0.8333793456389423
Energy: 1.1416639550385843
Energy: 1.3341459918786869
Energy: 0.8331228958362229
Energy: 1.1723804908361877
Energy: 1.2502730976249647
Energy: 0.7970851328644926
Energy: 0.7902028940123409
Energy: 1.1412575634421314
Energy: 0.7929377918026725
Energy: 1.041969587686663
Energy: 1.1302519208296917
Energy: 1.1129474282411111
Energy: 1.1783295236530271
Energy: 1.1317794831448793
Energy: 1.2591064683620765
Energy: 1.1247635581384343
Energy: 0.7529464705076157
Energy: 1.021436261073453
Energy: 0.7857766992034572
Energy: 0.7542621165498747
Energy: 1.0649110116459917
Energy: 0.7896154864710987
Energy: 1.0687745239640947
Energy: 1.1010273932211285
Energy: 1.0362536228838481
Energy: 0.8544694965922089
Energy: 1.219885216933259
Energy: 0.9377725109647117
Energy: 1.2200440138861313
Energy: 0.9616998344508234
Energy: 0.9121947716857501
Energy: 1.2214695709582224
Energy: 0.8014909923412512
Energy: 1.0237334491147376
Energy: 1.2065943319333208
Energy: 0.7929749626818118
Energy: 0.7894363090968196
Energy: 1.1603904861074363
Energy: 0.7720696946320689
Energy: 0.7893294777842272
Energy: 1.33468797235718
Energy: 1.1931445488818087
Energy: 1.0807443853195096
Energy: 1.1979011595179792
Energy: 1.1817228264457438
Energy: 1.0675434798519792
Energy: 0.8398740226486446
Energy: 1.0330149440244687
Energy: 1.0562590909705996
Energy: 0.7909136766779759
Energy: 1.14089652315859
Energy: 0.8056837282270697
Energy: 0.9942561392806535
Energy: 1.278126007951979
Energy: 1.2147486703328592
Energy: 0.9410563280439306
Energy: 1.302881159844335
Energy: 1.0193811899291336
Energy: 1.2491541908165542
Energy: 1.0467370131892804
Energy: 1.0454630526466304
Energy: 1.2533490210227045
Energy: 1.0737191062038176
Energy: 1.0006412615003881
Energy: 1.3694735676305398
Energy: 0.917144713225432
Energy: 0.9174387344566863
Energy: 1.3736105815075452
Energy: 0.9224341001364105
Energy: 1.0411472948486502
Energy: 1.3748165569699191
Energy: 1.1347056456464018
Energy: 1.1160830916849986
Energy: 1.324368168762589
Energy: 1.0997653555832911
Energy: 1.0974009485784813
Energy: 1.1032994524761788
Energy: 1.0362244984983668
Energy: 1.1953154966524913
Energy: 1.1001383893771486
Energy: 1.2755818699510475
Energy: 1.1645129392567235
Energy: 1.280217907271457
Energy: 1.4232712532215062
Energy: 1.3073418595156587
Energy: 1.2803900621056832
Energy: 1.4546522537694482
Energy: 1.1164430926870181
Energy: 1.269804772033775
Energy: 1.2559941112440374
Energy: 1.0134403590425967
Energy: 1.1849282104494963
Energy: 1.2608476235134467
Energy: 1.058320270695925
Energy: 1.5682879794869766
Energy: 1.1393797915174773
Energy: 1.050207528600175
Energy: 1.4508916411795487
Energy: 1.1432081748237626
Energy: 1.0825500403190929
Energy: 1.4507270709464604
Energy: 1.0807165716587916
Energy: 1.097576371619164
Energy: 1.3447740397488241
Energy: 1.0959375273076435
Energy: 1.1270526678670136
Energy: 1.1908996302796206
Energy: 1.1329364291649
Energy: 1.071381590969221
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Energy: 1.2723850614894714
Energy: 1.0559581111608738
Energy: 0.9827600452865675
Energy: 1.3407651463931907
Energy: 1.1785540320771157
Energy: 0.9224849830875389
Energy: 1.3894280718783714
Energy: 1.249314165803073
Energy: 0.9801820761766348
Energy: 1.0643623255833405
Energy: 1.0236578987777738
Energy: 0.9813950423448925
Energy: 1.2160392846584511
Energy: 1.1680821871993694
Energy: 1.3875423000816287
Energy: 1.1324758516569855
Energy: 1.1203477360112915
Energy: 1.388918962983455
Energy: 1.0821029144575252
Energy: 1.1691610912742052
Energy: 1.232390289030207
Energy: 0.8268838312449858
Energy: 0.8218420987656787
Energy: 1.1154988260864354
Energy: 0.7922925527490123
Energy: 0.8215914586615419
Energy: 1.2475886529249158
Energy: 1.11691556623346
Energy: 1.0759863356147525
Energy: 1.172630230749088
Energy: 1.1698884777965428
Energy: 1.1048486904455788
Energy: 0.7982446383180055
Energy: 1.1617856432145022
Energy: 1.0251414668626164
Energy: 0.8476234931030683
Energy: 1.2451149215630624
Energy: 0.7852821617938561
Energy: 0.880910014567596
Energy: 1.0045639874037284
Energy: 0.9899991755870373
Energy: 0.7744493297299677
Energy: 1.0807721809995585
Energy: 0.9007798643462654
Energy: 1.163574739502653
Energy: 1.043727889782966
Energy: 1.0938392159136139
Energy: 1.162665106084439
Energy: 1.076420758005231
Energy: 1.0007260649155618
Energy: 1.1166330947823206
Energy: 0.7581383414772833
Energy: 0.7522920775178942
Energy: 1.1175479891560243
Energy: 0.7532286507763718
Energy: 0.7683198297218004
Energy: 1.247951993408551
Energy: 0.8736819196013791
Energy: 1.0967436309305725
Energy: 1.250297650884958
Energy: 0.9704245584587711
Energy: 1.0521904954424297
Energy: 0.8491598056746917
Energy: 1.1126078457777777
Energy: 1.010006669528958
Energy: 0.8980789181964869
Energy: 1.1139130870049176
Energy: 1.0663470685208407
Energy: 0.8270162644588062
Energy: 1.183274865568699
Energy: 1.0237793858078932
Energy: 0.8284761011924457
Energy: 1.2663598796953017
Energy: 0.8212960074465772
Energy: 1.2497037849766002
Energy: 1.1016429797603982
Energy: 1.1553091419520995
Energy: 1.1758493514265471
Energy: 1.200380364997079
Energy: 1.1176460720484314
Energy: 1.2541494437365774
Energy: 0.9071782048982524
Energy: 0.9170502117822001
Energy: 1.204000909098379
Energy: 0.903397407045256
Energy: 0.9166826999227198
Energy: 1.4400744919765514
Energy: 1.1165986385381046
Energy: 1.0767423533794669
Energy: 1.4204747565229585
Energy: 1.1048581152241657
Energy: 1.2458513454040365
Energy: 1.1833780995652778
Energy: 1.1291340142451478
Energy: 0.9752555223962773
Energy: 1.167567825964752
Energy: 1.2889436603208773
Energy: 1.1269568439738322
Energy: 1.1936448417610903
Energy: 1.363796925397015
Energy: 1.1571523447907528
Energy: 1.1085954831804454
Energy: 1.4811450551037242
Energy: 0.9861054771812611
Energy: 1.1747569945393124
Energy: 1.2361482062970297
Energy: 1.0546516239961772
Energy: 1.176039139407019
Energy: 1.2659823085603932
Energy: 1.2038727334799542
Energy: 1.4401454700218157
Energy: 1.1474168654804402
Energy: 1.1663239941021206
Energy: 1.316475114304253
Energy: 1.1619636437993466
Energy: 1.0915920311460094

minimum gb energy = 0.7522920775178942 eV
minimum distance =  2.5147034664177 Angstroms
sigma value = 57


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

Energy: 1.4013811471223494
Energy: 1.2704203671862264
Energy: 1.1102912664563194
Energy: 1.4027138638446806
Energy: 1.2706125119107294
Energy: 1.1886096500377206
Energy: 1.2108030084440347
Energy: 0.9816947133336004
Energy: 0.9503141716003184
Energy: 1.196621717637042
Energy: 0.9969599951319417
Energy: 1.0132029908031794
Energy: 1.0889775179427188
Energy: 1.129910282173167
Energy: 1.139518243150507
Energy: 1.0900790606250157
Energy: 1.3028643140784633
Energy: 1.0307986376204796
Energy: 0.8731886263843985
Energy: 1.1684302589151123
Energy: 1.00262959950018
Energy: 0.8743518531046288
Energy: 1.1709944108404777
Energy: 0.8867352177186315
Energy: 1.102829819626753
Energy: 1.089623347309797
Energy: 1.0827063154291439
Energy: 1.0256689243483221
Energy: 1.0990519108796972
Energy: 1.012522737690737
Energy: 1.283190965522579
Energy: 0.7902269845712848
Energy: 1.0800401298430198
Energy: 1.285099769841723
Energy: 0.803675056514084
Energy: 1.0837011649583028
Energy: 1.1524736014556962
Energy: 0.7652698102097303
Energy: 0.7679450677012216
Energy: 1.0876958750667485
Energy: 0.7620878715736352
Energy: 1.0459636867939177
Energy: 1.044187864464207
Energy: 1.0557180373550548
Energy: 1.0649959700864173
Energy: 1.0304596779494106
Energy: 1.2029894158850327
Energy: 1.1368850311160885
Energy: 0.7358466789135873
Energy: 0.9420961826933386
Energy: 0.7341642556655605
Energy: 0.737369085291839
Energy: 1.127072070248862
Energy: 0.7346846173169006
Energy: 1.175635640039157
Energy: 1.0668894246861766
Energy: 0.9672339794308159
Energy: 1.0708834927309248
Energy: 1.1699624773298678
Energy: 0.9811753668007839
Energy: 1.1852731343416152
Energy: 0.8660353355725662
Energy: 0.8690368456853453
Energy: 1.18755968284141
Energy: 0.7355311268832596
Energy: 0.9373380802780246
Energy: 1.1099020539333462
Energy: 0.710975262860521
Energy: 0.7230632211421958
Energy: 1.0708445984573736
Energy: 0.7090397256152418
Energy: 0.9078184940906534
Energy: 1.1404404203442822
Energy: 1.0815420102986428
Energy: 0.9889557477436538
Energy: 1.135532602172207
Energy: 1.1195394860693761
Energy: 0.9687146601146914
Energy: 0.6922979941900327
Energy: 0.9448752168239565
Energy: 0.7234003486411857
Energy: 0.6936867847122045
Energy: 1.0027001124271637
Energy: 0.6915377168468417
Energy: 0.9609949529190271
Energy: 1.0456145139365238
Energy: 0.9760269978749236
Energy: 0.9212436446613794
Energy: 1.1755095371540645
Energy: 0.9477218914919968
Energy: 1.112844700477522
Energy: 0.7910467979387439
Energy: 0.9854525653637602
Energy: 1.1145726626250845
Energy: 0.8284148774536568
Energy: 0.8808172864678976
Energy: 1.2230083576283572
Energy: 0.7431996501713691
Energy: 0.7351924446268772
Energy: 1.1722312661347474
Energy: 0.7392524508214187
Energy: 0.7339878036415629
Energy: 1.2296187875856013
Energy: 1.0786073385886694
Energy: 1.006336236863521
Energy: 1.2284817344816885
Energy: 1.1297398609273779
Energy: 0.9785677043167078
Energy: 0.7691771115148118
Energy: 0.9543838746362667
Energy: 0.7886567371489899
Energy: 0.7708184827304269
Energy: 1.0906910357472672
Energy: 0.7800013363099811
Energy: 1.017152336981066
Energy: 1.24759739492749
Energy: 1.1131300002688176
Energy: 1.0068372853023047
Energy: 1.306800885354902
Energy: 1.1242951993596049
Energy: 1.171231764420976
Energy: 0.9277544889597017
Energy: 0.8805086104109753
Energy: 1.140801746340821
Energy: 0.9250471409615019
Energy: 0.945534983639854
Energy: 1.355607927636344
Energy: 0.881250670221138
Energy: 0.8505598782143015
Energy: 1.321503436349544
Energy: 0.8778172351708874
Energy: 1.1882359334284234
Energy: 1.3335191348945168
Energy: 1.070222279822361
Energy: 1.072424609940478
Energy: 1.2571128514818228
Energy: 1.0514205106497638
Energy: 1.0823643179509284
Energy: 1.032272801216391
Energy: 1.1166241734979883
Energy: 1.0902598192656325
Energy: 1.033643110360278
Energy: 1.2478095253385506
Energy: 1.084924119931893
Energy: 1.1380582216535027
Energy: 1.3164116520077145
Energy: 1.235898905637089
Energy: 1.1391698718127619
Energy: 1.4326441791424684
Energy: 1.1152871131633555
Energy: 1.1489665956913504
Energy: 1.1196605163346682
Energy: 0.9348537700482944
Energy: 1.1498785661310997
Energy: 1.156078703479813
Energy: 1.0019091853932853
Energy: 1.415379610700149
Energy: 1.083569201061509
Energy: 1.1689069378067665
Energy: 1.4172141323431293
Energy: 1.079191041467904
Energy: 1.1806331266762982

minimum gb energy = 0.6915377168468417 eV
minimum distance =  2.50911064469805 Angstroms
sigma value = 43


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

Energy: 1.2950194505219321
Energy: 1.0732322492168045
Energy: 0.9999789662878797
Energy: 1.280898172691365
Energy: 1.0986465071182565
Energy: 1.0168722683904523
Energy: 1.0344901848995882
Energy: 0.8584961420850139
Energy: 0.8163132048964713
Energy: 0.9191818660831712
Energy: 0.875303578208563
Energy: 0.8102857601001758
Energy: 0.924561009153719
Energy: 1.0643426251513806
Energy: 1.0452397339478774
Energy: 0.92592082169045
Energy: 1.1277005501763218
Energy: 0.9080994291530596
Energy: 0.7622464247537027
Energy: 0.979056036517037
Energy: 0.8046104254928047
Energy: 0.7630973343842451
Energy: 1.0606992688300214
Energy: 0.7706780207198837
Energy: 1.1345708609818463
Energy: 0.9154033152442627
Energy: 0.8471463038694755
Energy: 0.927649487513015
Energy: 0.9074328626627108
Energy: 0.8505389601348796
Energy: 1.2154737800853472
Energy: 0.694293159802777
Energy: 0.9384638279282621
Energy: 1.2173575105488785
Energy: 0.6939934793258088
Energy: 1.0040294097344793
Energy: 1.0171403470220457
Energy: 0.6873023486089211
Energy: 0.6873043856664673
Energy: 0.9604117369407839
Energy: 0.693551213433352
Energy: 0.8790370660579726
Energy: 0.8807974489717267
Energy: 1.0382636568223478
Energy: 1.0101015596846237
Energy: 0.8822434750186722
Energy: 1.1254027147982408
Energy: 0.9494382329394736
Energy: 0.6470564920958217
Energy: 0.8031552444719818
Energy: 0.6463995204142615
Energy: 0.6487116762179413
Energy: 1.0934951535468767
Energy: 0.6460425149986557
Energy: 1.0371894769603365
Energy: 0.9245238465618866
Energy: 0.8953052663231403
Energy: 0.9780667676918094
Energy: 0.9606160237151217
Energy: 0.8273682835680684
Energy: 1.140582706500783
Energy: 0.6242835374015203
Energy: 0.6248113675490942
Energy: 1.142274219913086
Energy: 0.6286158445970537
Energy: 0.9412057888115923
Energy: 1.0728726929370034
Energy: 0.6140101359800199
Energy: 0.6137777376010178
Energy: 0.9790508817263285
Energy: 0.6136979839370371
Energy: 0.802625276860001
Energy: 0.940579359022249
Energy: 1.0175508043060864
Energy: 0.9376077865045893
Energy: 0.941344084728971
Energy: 1.1028395212512598
Energy: 0.8783957842316418
Energy: 0.5903781764844699
Energy: 0.8705167202239653
Energy: 0.6049053518510621
Energy: 0.5919397607729727
Energy: 0.9452342004201381
Energy: 0.6049416640241823
Energy: 1.0416983826365254
Energy: 0.9361851836141475
Energy: 0.9227915358070589
Energy: 0.9660379869907109
Energy: 0.9513133012215205
Energy: 0.8696938459111877
Energy: 1.0726305312877638
Energy: 0.5981005676330421
Energy: 0.5983223215862724
Energy: 1.019872244933081
Energy: 0.6285129550107719
Energy: 0.8436216429299302
Energy: 1.0217461748205303
Energy: 0.5983469834489362
Energy: 0.5987022105816531
Energy: 1.0051455082213179
Energy: 0.5981371069025596
Energy: 0.7318133149602024
Energy: 0.998173166715412
Energy: 0.9551601441456674
Energy: 0.8710503798877917
Energy: 0.8823087127435045
Energy: 1.0193606479459383
Energy: 0.8354784196038016
Energy: 0.5832063393993124
Energy: 0.8258191893558583
Energy: 0.5904776065725781
Energy: 0.5841465244444681
Energy: 0.828652758705408
Energy: 0.5832606753635576
Energy: 0.9608689098378642
Energy: 0.9975737840257465
Energy: 0.8910002279308231
Energy: 0.9324844503046883
Energy: 1.0760081527682268
Energy: 0.8660889249713555
Energy: 0.995060613130912
Energy: 0.6064091163627283
Energy: 0.8164262668684135
Energy: 0.9878086929375828
Energy: 0.6355857402024491
Energy: 0.7392076440369789
Energy: 1.1142929312465069
Energy: 0.605060200506945
Energy: 0.6058897415222144
Energy: 1.0414223239999187
Energy: 0.6052074703454409
Energy: 0.8797457889104247
Energy: 1.0658294847443328
Energy: 0.8959037244422806
Energy: 0.8866935217479556
Energy: 1.0075011936853506
Energy: 0.9466906678341778
Energy: 0.8591389571805412
Energy: 0.6126484547063639
Energy: 0.985843815639174
Energy: 0.6199809997610087
Energy: 0.6142874088094463
Energy: 0.9736543706346925
Energy: 0.6199844130188934
Energy: 0.9154573881930843
Energy: 1.0548347430923422
Energy: 0.9863227813646619
Energy: 0.9106865970723407
Energy: 1.1402082206713893
Energy: 0.9274959074382302
Energy: 1.0516698380821918
Energy: 0.6388798978068149
Energy: 0.638538696816386
Energy: 0.9886536923580971
Energy: 0.6388031138225748
Energy: 0.7833273129855292
Energy: 1.1810099618713967
Energy: 0.6465267736582158
Energy: 0.6463262926429164
Energy: 1.182520934629747
Energy: 0.6541286377810434
Energy: 0.9828430372767317
Energy: 1.0844986783281387
Energy: 0.9225100489199042
Energy: 0.9112964103459179
Energy: 1.0249625088361443
Energy: 0.960459500117507
Energy: 0.8355731399137369
Energy: 0.6885806090626839
Energy: 0.7981630410155682
Energy: 0.6872126777336138
Energy: 0.6899068973369502
Energy: 1.1029230139061774
Energy: 0.6873853753022183
Energy: 0.9125358032989842
Energy: 1.080145541989491
Energy: 1.0564494697065372
Energy: 0.8667582469005288
Energy: 1.1678081302688714
Energy: 0.994565909014235
Energy: 1.002598941567701
Energy: 0.7590321931470948
Energy: 0.7590678514185965
Energy: 1.0025303581672829
Energy: 0.7647596728746798
Energy: 0.801063027957887
Energy: 1.2622111614338483
Energy: 0.7623572788648443
Energy: 0.9632306958067479
Energy: 1.2636102855421087
Energy: 0.7617371026520631
Energy: 1.021941055067796
Energy: 1.188435183744521
Energy: 0.8943094922944306
Energy: 0.8586869164212997
Energy: 0.9801705987603029
Energy: 0.8873466846792974
Energy: 0.813126200457226
Energy: 0.8845408805419923
Energy: 0.8453526262113537
Energy: 0.8180045396484965
Energy: 0.8858704075457083
Energy: 1.1174169677734827
Energy: 0.8122106984787166
Energy: 0.9279662313994955
Energy: 1.1125814246195678
Energy: 0.8922881123443798
Energy: 0.924704261575604
Energy: 1.0778791860574046
Energy: 0.8310763423414635
Energy: 1.0304400431065002
Energy: 0.8996088698512938
Energy: 0.8151318267655505
Energy: 0.9125571554392637
Energy: 0.9274837094153181
Energy: 0.8067296735457345

minimum gb energy = 0.5832063393993124 eV
minimum distance =  2.51454791238162 Angstroms
sigma value = 81


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

Energy: 0.2748651037682811
Energy: 0.9948280971423824
Energy: 0.2516833992455458
Energy: 0.06568044576127273
Energy: 0.8993375611448728
Energy: 0.2750736105251583
Energy: 1.332947915395221
Energy: 0.6772622394204538
Energy: 0.4814571549339076
Energy: 0.9773065032087556
Energy: 0.6237361131722374
Energy: 0.677190439378511
Energy: 0.9744704255835874
Energy: 0.0641571888686179
Energy: 0.0643461604951346
Energy: 1.0333062719051895
Energy: 0.06406745182650164
Energy: 0.5741616711406045
Energy: 0.49538847391443364
Energy: 0.0642950504782771
Energy: 0.25167250008387787
Energy: 0.4799518638378366
Energy: 0.06419659015784804
Energy: 0.25175716341944027
Energy: 0.2515495261498668
Energy: 0.9705911373459435
Energy: 1.1034418726617594
Energy: 0.25156319957975676
Energy: 1.0274412658638445
Energy: 0.6868024646412152
Energy: 0.06482756419867435
Energy: 0.6688975089712952
Energy: 0.2516654795699282
Energy: 0.06608607421237905
Energy: 0.48266685487824695
Energy: 0.06418235693546592
Energy: 0.9746999195168924
Energy: 0.47955261165318164
Energy: 0.48045156819792995
Energy: 1.2027695848095612
Energy: 0.48431569613619585
Energy: 0.48233104003117666
Energy: 0.9741426416908298
Energy: 0.06412269382393866
Energy: 0.06429350097046332
Energy: 0.9587817271285366
Energy: 0.06404099206305884
Energy: 0.06417608512582226
Energy: 0.4907868128482443
Energy: 0.25171606934992186
Energy: 0.2517524276138774
Energy: 0.5021928389783586
Energy: 0.06419601365995514
Energy: 0.25169849076020645
Energy: 0.4619734418070018
Energy: 1.1608272029917026
Energy: 0.9600533685598875
Energy: 0.2516140445381178
Energy: 1.1032456138192375
Energy: 0.8695111272263447

minimum gb energy = 0.06404099206305884 eV
minimum distance =  2.55283510384591 Angstroms
sigma value = 3


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

Energy: 1.3373593025682502
Energy: 1.3016231500079722
Energy: 1.0341665321353508
Energy: 1.3773767581129943
Energy: 1.3093042962498211
Energy: 1.1789805332009018
Energy: 0.9965257484296218
Energy: 0.8651594740228229
Energy: 0.8678107986798986
Energy: 0.9472808158045221
Energy: 0.8648985153456106
Energy: 0.8909186538806813
Energy: 0.9079948351802672
Energy: 1.093376170998488
Energy: 1.0122816705182356
Energy: 0.9090063192885007
Energy: 1.1756913396259014
Energy: 0.948084746009165
Energy: 0.8262491061355477
Energy: 0.9698486514679272
Energy: 0.9236138108927929
Energy: 0.8273251502901149
Energy: 1.2495639932496714
Energy: 0.9867766694020993
Energy: 1.140234638959329
Energy: 0.8939376107571879
Energy: 0.8975552933766359
Energy: 0.9104443330029812
Energy: 0.895089886268684
Energy: 0.9818730123760976
Energy: 1.3235738668507102
Energy: 0.9738134263548397
Energy: 1.0214119612154005
Energy: 1.2914418193117376
Energy: 0.898798931007644
Energy: 1.0648177156779264
Energy: 0.891856732913513
Energy: 0.8780307615331882
Energy: 0.8635896632187308
Energy: 0.891861861587392
Energy: 0.89306901308767
Energy: 0.8420493824639055
Energy: 0.8427451165789005
Energy: 0.9731266309042061
Energy: 1.0542955424835276
Energy: 0.8426578846033087
Energy: 1.1332181907794625
Energy: 1.0258729269817906
Energy: 0.9219556762812217
Energy: 0.9571944513348247
Energy: 0.8956729322411577
Energy: 0.9232888379227525
Energy: 1.0664183844590607
Energy: 0.9548312371581685
Energy: 1.1029088247911556
Energy: 0.7763224612956783
Energy: 0.7763216282220787
Energy: 1.0412974865373847
Energy: 0.7792460006835003
Energy: 0.7576451764713592
Energy: 1.2213888930433996
Energy: 0.7892891563056695
Energy: 0.9446952559629426
Energy: 1.1661076981050862
Energy: 0.7917644510008001
Energy: 0.9707169496143737
Energy: 0.7770823102911952
Energy: 0.9177806374049656
Energy: 0.8486602970352225
Energy: 0.707304355875952
Energy: 0.9281669837334748
Energy: 0.7467219128232773
Energy: 0.6651713829445317
Energy: 1.0058373594268206
Energy: 0.9775967404637895
Energy: 0.665264716535811
Energy: 1.1343208182549238
Energy: 0.9556736863896295
Energy: 0.9743651249401261
Energy: 0.763488023603181
Energy: 0.8144638099328341
Energy: 0.9729502069224147
Energy: 0.764784921571777
Energy: 0.854930448208757
Energy: 1.0751049460742383
Energy: 0.6398494985067866
Energy: 0.6400620471272794
Energy: 0.9888797644879807
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Energy: 0.7565847891816367
Energy: 1.1245952410261066
Energy: 0.8402650533332117
Energy: 0.8425198795452302
Energy: 1.102124092449016
Energy: 0.8699424283581919
Energy: 0.9115729022416863
Energy: 0.6298254060869596
Energy: 0.874705427841406
Energy: 0.9496586745085555
Energy: 0.6292236874407882
Energy: 0.9200256946908022
Energy: 0.7014209108230081
Energy: 0.6318222519211725
Energy: 0.9839616232532403
Energy: 0.9617753317613519
Energy: 0.6313493816716764
Energy: 1.056222804207536
Energy: 0.7886383222765142
Energy: 1.0911818872972456
Energy: 0.7016130907750254
Energy: 0.8443191208881312
Energy: 1.0540528270916074
Energy: 0.6965500817948798
Energy: 0.9190785884644106
Energy: 1.060150486138982
Energy: 0.6291659753007679
Energy: 0.6294922767602473
Energy: 0.8870873661650535
Energy: 0.6324383455708679
Energy: 0.7012887696582601
Energy: 1.0270862595964618
Energy: 0.9712547784873049
Energy: 0.9125663663215673
Energy: 0.9704346561808207
Energy: 1.009032255332273
Energy: 0.8807196169962307
Energy: 0.6764365680996893
Energy: 0.8991320862185866
Energy: 0.7091085477838867
Energy: 0.677247326401604
Energy: 0.9691838984249255
Energy: 0.6740488734327891
Energy: 0.750074808018185
Energy: 0.9056794303583057
Energy: 0.8755522433890012
Energy: 0.7136943534157129
Energy: 0.9476052462543386
Energy: 0.8493704017750494
Energy: 1.1285548557194918
Energy: 0.665478596263645
Energy: 0.9815754652300751
Energy: 1.1733646031649867
Energy: 0.6654193222037565
Energy: 0.9858564815422024
Energy: 0.940331784466035
Energy: 0.6661211951644096
Energy: 0.6694441129689863
Energy: 0.9404089772795026
Energy: 0.70045200476813
Energy: 0.746557389333153
Energy: 0.9406317888503801
Energy: 0.9714168966657405
Energy: 0.9539682026372639
Energy: 0.9245846329807544
Energy: 1.0881265028758347
Energy: 0.9148962216300194
Energy: 0.7768138591351251
Energy: 0.9722764188176239
Energy: 0.9461189723711171
Energy: 0.7782071836107013
Energy: 1.0975024747860345
Energy: 0.776258756450687
Energy: 0.7960955553764286
Energy: 0.9152850604011659
Energy: 0.8613684308743391
Energy: 0.7549327438491965
Energy: 0.8962140448791335
Energy: 0.8915474416254127
Energy: 1.2682310124772402
Energy: 0.8082238484906973
Energy: 0.8009635828752496
Energy: 1.2455827294774677
Energy: 0.7747428293550084
Energy: 1.0205095289940618
Energy: 1.030962012929978
Energy: 0.8524797864693436
Energy: 0.863444009910715
Energy: 0.977899039993962
Energy: 0.8198411301879982
Energy: 0.8429726359992574
Energy: 0.9301194545962487
Energy: 1.085575112035564
Energy: 1.130256717067142
Energy: 0.9303525011479054
Energy: 1.2083619395669567
Energy: 1.0686246156407522
Energy: 0.8979973067346182
Energy: 0.9403607073133328
Energy: 0.9333121704265871
Energy: 0.8991492012170713
Energy: 1.1337448495521856
Energy: 0.9202228822847338
Energy: 1.0331070985115467
Energy: 0.8876666180112145
Energy: 0.888355833821334
Energy: 0.9971140385392275
Energy: 0.889660337904087
Energy: 0.9741503425295891

minimum gb energy = 0.6291659753007679 eV
minimum distance =  2.50419134390747 Angstroms
sigma value = 67


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

Energy: 1.3080089156126646
Energy: 1.4804658292009945
Energy: 1.3081902620136472
Energy: 1.3099085540139166
Energy: 1.478866340921598
Energy: 1.359424807740371
Energy: 1.1096101697398801
Energy: 1.0065918888629115
Energy: 1.004733967512293
Energy: 1.1888000294698073
Energy: 1.0047084591624933
Energy: 1.078419630977645
Energy: 1.058253267876973
Energy: 1.314885546442829
Energy: 1.1465873002800442
Energy: 1.0594967360838654
Energy: 1.370865610753298
Energy: 1.07853132872983
Energy: 0.9742545000081374
Energy: 1.2971939109965571
Energy: 1.318629731001206
Energy: 0.9707861466833141
Energy: 1.3848300816504238
Energy: 1.1615033209715704
Energy: 1.2561069686850115
Energy: 1.0584249886172745
Energy: 1.1134367613855523
Energy: 1.1983057565187543
Energy: 1.0482693077542438
Energy: 1.1067136035793503
Energy: 1.2948458688591984
Energy: 1.1404277218876488
Energy: 1.2214109524118373
Energy: 1.4275417235932688
Energy: 1.0551068340060652
Energy: 1.1793816223793125
Energy: 1.031561378922608
Energy: 1.0964909624545427
Energy: 1.067883572784718
Energy: 0.9857278594120648
Energy: 1.0541818599182031
Energy: 0.9628852364965271
Energy: 0.9811327520025002
Energy: 1.178664470215492
Energy: 1.1315668335979785
Energy: 0.9331776209767897
Energy: 1.2446572827948215
Energy: 0.9967097405776183
Energy: 1.087426712185575
Energy: 1.0659980802189315
Energy: 1.0712192374779503
Energy: 1.0884399198704913
Energy: 0.8744917085618368
Energy: 1.0444294975766806
Energy: 1.1949532885174194
Energy: 0.9050710374472564
Energy: 0.8217938919435636
Energy: 1.1219404063200744
Energy: 0.9009210186433046
Energy: 0.9261702587648106
Energy: 1.2537139768423353
Energy: 0.9084390734799651
Energy: 1.0442455387557938
Energy: 1.2556070762513332
Energy: 0.9065141685440933
Energy: 1.1127692051969036
Energy: 0.775472152916006
Energy: 1.0361335722309555
Energy: 1.144072416003417
Energy: 0.7764823558719571
Energy: 1.1348310393202232
Energy: 0.8762092806890013
Energy: 0.7740147461499107
Energy: 1.131038612695879
Energy: 1.116757206140235
Energy: 0.7749703830685722
Energy: 1.1646273584221771
Energy: 0.9897991010826582
Energy: 1.2287641581868245
Energy: 0.8906719074910262
Energy: 0.990275718092277
Energy: 1.1814822489005825
Energy: 0.8874631457146014
Energy: 1.045023657425524
Energy: 1.1480215679921686
Energy: 0.8305690219888704
Energy: 0.7958837552141443
Energy: 1.0952493912173122
Energy: 0.8177454560183012
Energy: 0.8989337275078698
Energy: 1.1359653723232117
Energy: 0.980152253973177
Energy: 0.9901052634965707
Energy: 1.137317794874692
Energy: 0.887032191162318
Energy: 0.9907957303866105
Energy: 0.8536532708875647
Energy: 1.0375625168991307
Energy: 1.0807904102953911
Energy: 0.8549664229306048
Energy: 1.17895879892205
Energy: 0.80281032695274
Energy: 0.8638218628275957
Energy: 1.0681271505371228
Energy: 1.007180742503223
Energy: 0.8629860998053449
Energy: 1.0961437319072567
Energy: 0.9678337053578695
Energy: 1.2235495493315134
Energy: 0.9919660595976527
Energy: 1.1057893910608445
Energy: 1.3347900769937229
Energy: 0.9511064096118595
Energy: 1.181471374089811
Energy: 1.1180577831582914
Energy: 0.9450387747810091
Energy: 0.9376560239157403
Energy: 1.073684981394852
Energy: 0.9348651811534472
Energy: 1.0211725417134703
Energy: 1.0352436197290205
Energy: 1.219758481519729
Energy: 1.265973478845642
Energy: 1.0133012298445956
Energy: 1.3005271157028435
Energy: 1.1728985724672487
Energy: 1.099191954647405
Energy: 1.2556254242735647
Energy: 1.2268853097646382
Energy: 1.1001983000578544
Energy: 1.2864256450576228
Energy: 1.0934229231645396
Energy: 1.1335699878895134
Energy: 0.9939742536450679
Energy: 0.9889814478792331
Energy: 1.028527805006533
Energy: 0.9799693533315208
Energy: 1.075879890103969

minimum gb energy = 0.7740147461499107 eV
minimum distance =  2.50556325257962 Angstroms
sigma value = 33


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

Energy: 1.4493610842591087
Energy: 1.5895176070992902
Energy: 1.3611621653437298
Energy: 1.4517519946897655
Energy: 1.5840729004967695
Energy: 1.3695318422090275
Energy: 1.1819875483231352
Energy: 1.0714866142519872
Energy: 1.0749623772633123
Energy: 1.1803927082757741
Energy: 1.0982487402131036
Energy: 1.1230858065756126
Energy: 1.1422818901786027
Energy: 1.318454489832007
Energy: 1.2620401341075103
Energy: 1.143425062442765
Energy: 1.4569161171487386
Energy: 1.1780031936934532
Energy: 1.0408816126650946
Energy: 1.2233404061075515
Energy: 1.3089969043761986
Energy: 1.038110239767223
Energy: 1.185876988807789
Energy: 1.223211627854679
Energy: 1.3347933901295679
Energy: 1.1997448610400783
Energy: 1.2045675330417156
Energy: 1.1371018567503295
Energy: 1.1466716413874924
Energy: 1.2891067378526355
Energy: 1.428858897202092
Energy: 1.2604197710235603
Energy: 1.290370672210462
Energy: 1.3494228189904214
Energy: 1.1219037907864582
Energy: 1.2917430862530137
Energy: 0.9948325134578826
Energy: 1.1816753201584291
Energy: 1.1633820765829779
Energy: 0.9949247617149466
Energy: 1.1497928184633677
Energy: 1.029937749220442
Energy: 1.056165831721033
Energy: 1.1751566634769688
Energy: 1.1722206349457138
Energy: 0.9977832064533669
Energy: 1.2707569937432428
Energy: 1.013676407620425
Energy: 1.2108340803285094
Energy: 1.0682265768994614
Energy: 1.0910939417118095
Energy: 1.1957541200603317
Energy: 0.9240895403243562
Energy: 1.1311819608523488
Energy: 1.2089637194955927
Energy: 0.8801039392105413
Energy: 0.8846324004549769
Energy: 1.206630208744726
Energy: 0.8758209530948609
Energy: 1.0197730266733078
Energy: 1.3424342162720488
Energy: 1.0271233648347788
Energy: 1.0865147394366912
Energy: 1.3122642008507288
Energy: 0.9717164124523735
Energy: 1.1371038156330475
Energy: 0.8627947591297827
Energy: 1.1884383768918922
Energy: 1.182427303177706
Energy: 0.862800238361066
Energy: 1.2594961503585167
Energy: 1.1432100371182186
Energy: 0.865572379624882
Energy: 1.1645728410167944
Energy: 1.1467447047473682
Energy: 0.8652445462323379
Energy: 1.124327589065438
Energy: 1.0672130619172613
Energy: 1.3278424088500096
Energy: 1.0592240419122956
Energy: 1.1704933886305406
Energy: 1.3296636800222714
Energy: 1.0089636158129076
Energy: 1.202424801965637
Energy: 1.0725224906249191
Energy: 1.0124071754760908
Energy: 1.0058256797410725
Energy: 1.0701513146464758
Energy: 1.0082625414566122
Energy: 1.091954324785377
Energy: 1.1267894067117832
Energy: 1.1826330311749005
Energy: 1.1843145464359737
Energy: 1.120395133078202
Energy: 0.9963146985359445
Energy: 1.3025985760449992
Energy: 1.1950586430322576
Energy: 1.2623318196009436
Energy: 1.27916205446671
Energy: 1.1958029858652204
Energy: 1.4313977164178737
Energy: 1.0481941124471386
Energy: 1.1797870659857679
Energy: 1.0575777609921937
Energy: 1.0581207732772326
Energy: 1.1746812090922223
Energy: 1.082947162698955
Energy: 1.184330867586284
Energy: 1.5277875265933794
Energy: 1.1580406106880796
Energy: 1.3156478344162794
Energy: 1.4933486818889288
Energy: 1.0976608108429318
Energy: 1.251834800926482
Energy: 1.3139798979359294
Energy: 1.1437489283297726
Energy: 1.0803543930509263
Energy: 1.1035108475486988
Energy: 1.0879625227551977
Energy: 1.2202613293620856
Energy: 1.1406490375363176
Energy: 1.231038395347268
Energy: 1.2335186100909277
Energy: 1.141659244765475
Energy: 1.1334799938280309
Energy: 1.1782330904480618
Energy: 1.1114969149275473
Energy: 1.3392789549096438
Energy: 1.2260059612261451
Energy: 1.112694581550421
Energy: 1.4918131364335552
Energy: 1.2230194643614072
Energy: 1.1352651667535258
Energy: 1.1573717082954755
Energy: 1.150382953990012
Energy: 1.1354317094850612
Energy: 1.1527522144839408
Energy: 1.16626145606302
Energy: 1.3461687046252409
Energy: 1.1994539962999398
Energy: 1.2875885405226704
Energy: 1.3476124596053305
Energy: 1.1356855754403303
Energy: 1.2870032607984903
Energy: 0.9950490021589379
Energy: 1.1705368119733728
Energy: 1.1698400829463294
Energy: 0.9954186545248662
Energy: 1.1504011283846558
Energy: 1.214676964536999
Energy: 1.0569774084482433
Energy: 1.2413163879886866
Energy: 1.1738790461408501
Energy: 1.058072757307358
Energy: 1.2223483089513787
Energy: 0.9941126533421306
Energy: 1.1817088899902084
Energy: 1.1235445677081792
Energy: 1.122120969868428
Energy: 1.1644887938912367
Energy: 0.9241606622059491
Energy: 1.1317167579609795
Energy: 1.2074101101405796
Energy: 0.8801761717553013
Energy: 0.8739156537710483
Energy: 1.2061439147937125
Energy: 0.8763929444479088
Energy: 1.009547542573356
Energy: 1.3420124829360687
Energy: 0.9617366687136268
Energy: 1.106501506102498
Energy: 1.2078112545468187
Energy: 0.9165845116453973
Energy: 1.1368244691442622
Energy: 0.8618528819163904
Energy: 1.174225016384501
Energy: 1.1834792712968922
Energy: 0.8618162376104486
Energy: 1.223738880824803
Energy: 1.1557317311923838
Energy: 0.8677508115688106
Energy: 1.201118444047735
Energy: 1.1961132177203162
Energy: 0.8682835490026151
Energy: 1.1817867839125147
Energy: 0.9776440334389205
Energy: 1.3147062269739958
Energy: 1.0073148467008417
Energy: 1.1498077678205703
Energy: 1.277397654650099
Energy: 1.0098251045283044
Energy: 1.1175859983139733
Energy: 1.3148610953695419
Energy: 1.0006368698616135
Energy: 1.005739042802552
Energy: 1.1128374205355254
Energy: 0.9962076635586307
Energy: 1.0728202483711744
Energy: 1.1257610029318736
Energy: 1.129990853598232
Energy: 1.2754327033905553
Energy: 1.0951956464611847
Energy: 1.0955102830582872
Energy: 1.1326421554400032
Energy: 1.1922922025775107
Energy: 1.3793217711951145
Energy: 1.2790707454797403
Energy: 1.1324423637051089
Energy: 1.3495361308124905
Energy: 1.1308797825011638
Energy: 1.178235456604318
Energy: 1.0811126435848668
Energy: 1.0580495899444393
Energy: 1.1729333106263842
Energy: 1.0841947182485823
Energy: 1.1281505804842624
Energy: 1.5533903473049926
Energy: 1.1492509037573253
Energy: 1.3174041878405978
Energy: 1.5294913750522392
Energy: 1.0971775705326003
Energy: 1.4142863387869755

minimum gb energy = 0.8618162376104486 eV
minimum distance =  2.51989031725797 Angstroms
sigma value = 41


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

Energy: 1.4229577504854711
Energy: 1.6984523799145375
Energy: 1.459302838863904
Energy: 1.3492214324855654
Energy: 1.7177735501557736
Energy: 1.681927782416767
Energy: 1.2083770374086662
Energy: 1.1380732369162962
Energy: 1.1408320285042548
Energy: 1.2095132623494715
Energy: 1.2080676145165576
Energy: 1.3633719558112627
Energy: 1.3492724288838096
Energy: 1.4178910314063757
Energy: 1.289012516159834
Energy: 1.350480025999389
Energy: 1.445516637141903
Energy: 1.1920740323652324
Energy: 1.371058944709265
Energy: 1.3575620797593395
Energy: 1.4024366294266475
Energy: 1.210379260333982
Energy: 1.3074007304769968
Energy: 1.2062133219966138
Energy: 1.2010743123075647
Energy: 1.4748004914251573
Energy: 1.4026676904475868
Energy: 1.2012509806676475
Energy: 1.2714093046097077
Energy: 1.3332949846887134
Energy: 1.3808262866074965
Energy: 1.3075872178184882
Energy: 1.3215323172960938
Energy: 1.2874505848197781
Energy: 1.2119267772911744
Energy: 1.4661338106463724
Energy: 1.0027910850736383
Energy: 1.245254669585111
Energy: 1.2710117644869692
Energy: 1.0017556451966365
Energy: 1.2214865886152666
Energy: 1.23973602822455
Energy: 0.9981911420269342
Energy: 1.2811276903598365
Energy: 1.1987476566851665
Energy: 0.9993626013819923
Energy: 1.362943867025769
Energy: 1.0553767321818368
Energy: 1.292741213628162
Energy: 1.1262857314243147
Energy: 1.1961764514253295
Energy: 1.2950648077643927
Energy: 1.0770712882601663
Energy: 1.2751202505233132
Energy: 1.2904702746825876
Energy: 1.1054995575797135
Energy: 1.0138234803246953
Energy: 1.2859028335275606
Energy: 1.100926905430384
Energy: 1.1166398681365475
Energy: 1.2655526782699182
Energy: 1.1615227452113481
Energy: 1.3340691587531794
Energy: 1.266863181687748
Energy: 1.1211269311847665
Energy: 1.2730316509830943
Energy: 1.219168592363131
Energy: 1.3618663925950372
Energy: 1.2754797893176812
Energy: 1.2202221988760777
Energy: 1.3623845467993627
Energy: 1.161528118084284
Energy: 1.2054357192484408
Energy: 1.1749115044359932
Energy: 1.3010166445459288
Energy: 1.1830054897984232
Energy: 1.1707090537430616
Energy: 1.2148332630572134
Energy: 1.4776031902070208
Energy: 1.2488496913783416
Energy: 1.4016384644031814
Energy: 1.4776868811175599
Energy: 1.1802949509498768
Energy: 1.6172648129628882

minimum gb energy = 0.9981911420269342 eV
minimum distance =  2.45853508795823 Angstroms
sigma value = 11


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

Energy: 1.6593497200567482
Energy: 1.9155448450122725
Energy: 1.6559899351101535
Energy: 1.6606596939908906
Energy: 2.0291620781694975
Energy: 1.5199304636050996
Energy: 1.4236648407840673
Energy: 1.1655962478665969
Energy: 1.2805380543302707
Energy: 1.4240831077344318
Energy: 1.1675808702922181
Energy: 1.369153017897512
Energy: 1.5232074904866444
Energy: 1.56880955564938
Energy: 1.4406167962595582
Energy: 1.506439391370344
Energy: 1.637329308447872
Energy: 1.406544464137539
Energy: 1.4163309337021104
Energy: 1.4057844632831769
Energy: 1.4146285024341654
Energy: 1.4205889950136907
Energy: 1.3649058675087762
Energy: 1.4252495737434419
Energy: 1.4002814952248608
Energy: 1.2166793583792586
Energy: 1.2101754083192346
Energy: 1.3814790480391892
Energy: 1.2178060927816392
Energy: 1.3426333550101501
Energy: 1.5788924075758348
Energy: 1.165546053810519
Energy: 1.247981995456218
Energy: 1.2870471842880076
Energy: 1.1652082274826596
Energy: 1.2956691505959916
Energy: 1.1433656836361048
Energy: 1.4144353039391628
Energy: 1.3271136380247033
Energy: 1.1520443868011832
Energy: 1.2579451896626326
Energy: 1.249747544023569
Energy: 1.1610405049836752
Energy: 1.3318030175152331
Energy: 1.3865443636864554
Energy: 1.1591889780280573
Energy: 1.319839124890321
Energy: 1.271170445816394
Energy: 1.5740057777143257
Energy: 1.4062654271404909
Energy: 1.4091327038133945
Energy: 1.521664515324855
Energy: 1.4012539657597598
Energy: 1.534296581895335
Energy: 1.5985786640706992
Energy: 1.4680207117548023
Energy: 1.4681229235025965
Energy: 1.5217742850344897
Energy: 1.4816301570843067
Energy: 1.52480889396598
Energy: 1.274289406471398
Energy: 1.2835237951841203
Energy: 1.3227181867391264
Energy: 1.2546114618714372
Energy: 1.3154650756631217
Energy: 1.3668270630165247
Energy: 1.5798385324099344
Energy: 1.7557321961802648
Energy: 1.551054523387586
Energy: 1.5810042361803507
Energy: 1.6479542214511873
Energy: 1.5501335344765426
Energy: 1.2430513372284735
Energy: 1.4934945733950202
Energy: 1.39531525584188
Energy: 1.1572956882269252
Energy: 1.4589644814193556
Energy: 1.327746692075817
Energy: 1.5757888292026978
Energy: 1.4152805784212323
Energy: 1.4068559772381084
Energy: 1.5417807729894917
Energy: 1.3930655092435589
Energy: 1.4768149702418085
Energy: 1.1328966787756156
Energy: 1.4428907448129311
Energy: 1.4221312009885443
Energy: 1.1331194894582173
Energy: 1.426203248227918
Energy: 1.2594726126480706
Energy: 1.1877862031983444
Energy: 1.2951087442436453
Energy: 1.2890183901458903
Energy: 1.189374204413958
Energy: 1.353366799750002
Energy: 1.1067592488413267
Energy: 1.1127619309764614
Energy: 1.3759747182300883
Energy: 1.2650119867404614
Energy: 1.1126656948420515
Energy: 1.4540401618439378
Energy: 1.2501199452649765
Energy: 1.3845694515677736
Energy: 1.2617606971236301
Energy: 1.3040340144330858
Energy: 1.3618973402838144
Energy: 1.2375913698199674
Energy: 1.3269838069350406
Energy: 1.3635043344686952
Energy: 1.2682132704212492
Energy: 1.2555449541900883
Energy: 1.2747298390286637
Energy: 1.2693098200780673
Energy: 1.282634914391282
Energy: 1.3317262514720118
Energy: 1.5945655169976196
Energy: 1.486848137830513
Energy: 1.3667034665016569
Energy: 1.6481298211728381
Energy: 1.5873908384659234
Energy: 1.3529021248697215
Energy: 1.4672378544659375
Energy: 1.429672489304942
Energy: 1.4248073695311039
Energy: 1.3191424448504188
Energy: 1.3548356269851591
Energy: 1.2823222615730434
Energy: 1.48808843545254
Energy: 1.3896606409062742
Energy: 1.351385316184237
Energy: 1.4090875016332143
Energy: 1.4838986621992267
Energy: 1.720704953805664
Energy: 1.4501742673545457
Energy: 1.492179430388803
Energy: 1.6207274768658746
Energy: 1.4080404091117384
Energy: 1.529478948973893
Energy: 1.318456164871131
Energy: 1.2449021340846724
Energy: 1.220853836100253
Energy: 1.3195162171791177
Energy: 1.2456665840256642
Energy: 1.2418459386714213
Energy: 1.2404363686490836
Energy: 1.4356879632462531
Energy: 1.4250354552084572
Energy: 1.26384475408188
Energy: 1.3397190050651255
Energy: 1.3700941104963231
Energy: 1.4965467086153719
Energy: 1.155099036821884
Energy: 1.2347791621370612
Energy: 1.4624719156599284
Energy: 1.113020410255685
Energy: 1.2647974631652024
Energy: 1.3953948838351014
Energy: 1.1469915261858425
Energy: 1.1472030570081948
Energy: 1.328725557080617
Energy: 1.1299834415874237
Energy: 1.20975552240579
Energy: 1.4512532051628737
Energy: 1.1822679087306411
Energy: 1.262291643863292
Energy: 1.3943888336217647
Energy: 1.0929608170842038
Energy: 1.432413803413101
Energy: 1.4185371740652868
Energy: 1.47708913812404
Energy: 1.4550683738344319
Energy: 1.4335624170637935
Energy: 1.453557840477315
Energy: 1.415386514922058
Energy: 1.445238533681289
Energy: 1.1343327482096293
Energy: 1.1588360248577807
Energy: 1.4680924262992618
Energy: 1.2233778062110339
Energy: 1.2635430713640299
Energy: 1.7521657348470885
Energy: 1.4890690662217096
Energy: 1.5625594226501271
Energy: 1.6634880076661611
Energy: 1.4765771715974572
Energy: 1.5908907000912358

minimum gb energy = 1.0929608170842038 eV
minimum distance =  2.48930766875106 Angstroms
sigma value = 57


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

Energy: 1.4956145757624715
Energy: 1.8320875204089406
Energy: 1.3782476085961801
Energy: 1.4993189205417576
Energy: 1.8287181382111957
Energy: 1.4928891425135429
Energy: 1.4241654303317575
Energy: 1.4140903419033874
Energy: 1.3852911452404661
Energy: 1.4254087322816351
Energy: 1.4108348165197062
Energy: 1.4164003194224881
Energy: 1.6525565813770793
Energy: 1.338126398179781
Energy: 1.3041638907342814
Energy: 1.6238820387906243
Energy: 1.1184796100342136
Energy: 1.5954961429148244
Energy: 1.2403422291715855
Energy: 1.3184507024644776
Energy: 1.3674025711971793
Energy: 1.3846503808340849
Energy: 1.476819513932722
Energy: 1.3663323699835954
Energy: 1.3299373054575678
Energy: 1.530729561575402
Energy: 1.327844967173562
Energy: 1.318756533795972
Energy: 1.4485530113037017
Energy: 1.3518289042975362
Energy: 1.5414226357827612
Energy: 1.3777256979585255
Energy: 1.3781568629441336
Energy: 1.478965285534616
Energy: 1.3732362934896312
Energy: 1.3917435524034856
Energy: 1.195131890148575
Energy: 1.262106952861077
Energy: 1.1971557665688608
Energy: 1.1963156191564388
Energy: 1.1197363547401606
Energy: 1.2765276128463314
Energy: 1.3124621448112643
Energy: 1.2469770791017731
Energy: 1.338804598252376
Energy: 1.3024307202635663
Energy: 1.239851784590356
Energy: 1.2931669448057768
Energy: 1.7044016677010148
Energy: 1.3109985820431285
Energy: 1.363948917989477
Energy: 1.287862964423237
Energy: 1.308464303472092
Energy: 1.39985520979105
Energy: 1.7045271149819217
Energy: 1.381550293214979
Energy: 1.3642141453110823
Energy: 1.2870564740233057
Energy: 1.3776898693965998
Energy: 1.400135526751982
Energy: 1.4274526134276073
Energy: 1.3950643600618406
Energy: 1.3690615339320882
Energy: 1.425955746662731
Energy: 1.4106882899797113
Energy: 1.3683318506000763
Energy: 1.667558413467599
Energy: 1.4055460484853355
Energy: 1.304578306030472
Energy: 1.6695573549827651
Energy: 1.3079695141738463
Energy: 1.4061681615747195
Energy: 1.3295159953249556
Energy: 1.4579909788083192
Energy: 1.3959844277277187
Energy: 1.330976111433113
Energy: 1.4483660916438998
Energy: 1.3423243376498248
Energy: 1.4430529371845873
Energy: 1.413613713138353
Energy: 1.4096732656395827
Energy: 1.427866854069424
Energy: 1.413201347701292
Energy: 1.4316993416115853
Energy: 1.3662832202421415
Energy: 1.302897460457717
Energy: 1.4270050527222393
Energy: 1.3675309141637506
Energy: 1.305013815882547
Energy: 1.2961638162222155
Energy: 1.3338367318888544
Energy: 1.1459552156457522
Energy: 1.1881488708117758
Energy: 1.3344929209102956
Energy: 1.14753326497566
Energy: 1.2533065433607453
Energy: 1.1660852121325573
Energy: 1.388396393089443
Energy: 1.2794259650004964
Energy: 1.1665827679416645
Energy: 1.3893982399201168
Energy: 1.3018740277379819

minimum gb energy = 1.1184796100342136 eV
minimum distance =  2.47873650186758 Angstroms
sigma value = 9


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

Energy: 1.7269192828354667
Energy: 2.112234933131434
Energy: 1.5869040582068472
Energy: 1.7297332125629685
Energy: 2.0705649872699174
Energy: 1.59218150045721
Energy: 1.527770974892741
Energy: 1.4420257977431028
Energy: 1.4562128801340102
Energy: 1.6190195162914298
Energy: 1.4813404441496412
Energy: 1.4577808101972105
Energy: 1.505105443141821
Energy: 1.3107602709249682
Energy: 1.4734312105992928
Energy: 1.506292855846569
Energy: 1.3836814877689703
Energy: 1.463239775006684
Energy: 1.411116734605175
Energy: 1.3670939743697823
Energy: 1.3626087802503173
Energy: 1.383991995698977
Energy: 1.3388317755735542
Energy: 1.347822655065044
Energy: 1.2711527238339828
Energy: 1.2864258630313357
Energy: 1.2975399599504471
Energy: 1.2348608165820454
Energy: 1.2879899836146989
Energy: 1.2616726621194836
Energy: 1.427516520683267
Energy: 1.2393890386941793
Energy: 1.2125927372291812
Energy: 1.211452036386921
Energy: 1.2502240011591952
Energy: 1.2216833731533179
Energy: 1.4906415139574052
Energy: 1.3542419248987858
Energy: 1.6056021503550455
Energy: 1.490873699661341
Energy: 1.3595089176076585
Energy: 1.5931950460440574
Energy: 1.3566178118418102
Energy: 1.3602260590791515
Energy: 1.3499086264107656
Energy: 1.3562533746413774
Energy: 1.3763477481259119
Energy: 1.367075303513073
Energy: 1.5440458832837085
Energy: 1.4532111582492426
Energy: 1.4375408142317738
Energy: 1.5264050357112444
Energy: 1.4502262068386058
Energy: 1.4829982481254056
Energy: 1.5326772164666806
Energy: 1.3965725429698606
Energy: 1.399134567232303
Energy: 1.5677498861418429
Energy: 1.4107653560415083
Energy: 1.422640645560904
Energy: 1.2607687649301034
Energy: 1.3000827147016305
Energy: 1.248445258397482
Energy: 1.260322164123559
Energy: 1.2774497220146404
Energy: 1.2398954166720086
Energy: 1.204389772171911
Energy: 1.2968938773987708
Energy: 1.3130608504539099
Energy: 1.20431092579288
Energy: 1.23130670315907
Energy: 1.2490821974638662
Energy: 1.4503785127493471
Energy: 1.4514643026005027
Energy: 1.4381638406757138
Energy: 1.363658318807552
Energy: 1.3921004594991657
Energy: 1.3331787508664505
Energy: 1.4561913201012242
Energy: 1.426447197242799
Energy: 1.4268424202823293
Energy: 1.3968082358518812
Energy: 1.4358434074002828
Energy: 1.3489817149045769
Energy: 1.4260255459640427
Energy: 1.276766934294486
Energy: 1.2795156925423288
Energy: 1.5557656216497215
Energy: 1.3548267019820288
Energy: 1.4823782964657926
Energy: 1.536103031358983
Energy: 1.489405661615011
Energy: 1.4366659870980467
Energy: 1.5365293730746645
Energy: 1.6386344053452566
Energy: 1.6796880358418946
Energy: 1.36383430614114
Energy: 1.3902493602690047
Energy: 1.3494066734575134
Energy: 1.3785495366302132
Energy: 1.4100339173627874
Energy: 1.3089234247062156
Energy: 1.3093580581631117
Energy: 1.343737155233995
Energy: 1.3247257895555062
Energy: 1.3109561638362224
Energy: 1.3185642710279581
Energy: 1.3149602488674674
Energy: 1.269472075080318
Energy: 1.4075977149329013
Energy: 1.358682349446084
Energy: 1.2704123751412748
Energy: 1.3942056201514568
Energy: 1.3325335574167274
Energy: 1.3972582262649327
Energy: 1.2887932365368717
Energy: 1.295976594647192
Energy: 1.3980211017484208
Energy: 1.2873341802713338
Energy: 1.3476150159942193
Energy: 1.6360022941654861
Energy: 1.4992002771035564
Energy: 1.5074048164007354
Energy: 1.5287326056217805
Energy: 1.4817983678443158
Energy: 1.4157779322008246

minimum gb energy = 1.20431092579288 eV
minimum distance =  2.51618649357175 Angstroms
sigma value = 27


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

Energy: 1.0848077688088986
Energy: 1.929487690623912
Energy: 1.171954205540571
Energy: 1.0872721636007447
Energy: 2.004150053686226
Energy: 1.1349924816850117
Energy: 1.3985068405070193
Energy: 1.1969516260857103
Energy: 1.2151240964699972
Energy: 1.3997405560946592
Energy: 1.1957388043782484
Energy: 1.1815970290255942
Energy: 1.4465421814168096
Energy: 1.222291526338142
Energy: 1.2030804035980132
Energy: 1.4474019290619822
Energy: 1.091961514538983
Energy: 1.2010782449099948
Energy: 1.190832505993846
Energy: 1.2147891919540768
Energy: 1.2219145648940335
Energy: 1.1909300659022724
Energy: 1.3657466356583052
Energy: 1.221888481350229
Energy: 1.1088138135168712
Energy: 1.1622346081112052
Energy: 1.1625588662555282
Energy: 1.1097560398862023
Energy: 1.179003766101374
Energy: 1.1403527276445682
Energy: 1.301499686436239
Energy: 1.278311000820006
Energy: 1.1927102953124789
Energy: 1.1481322850065834
Energy: 1.3034383027508674
Energy: 1.1732854134844304
Energy: 1.204000813472113
Energy: 1.0913702850878064
Energy: 1.1380418054750232
Energy: 1.1781895022491151
Energy: 1.0917285734605977
Energy: 1.1716518352325338
Energy: 1.2256774426910788
Energy: 1.2561189640496513
Energy: 1.1807878904066902
Energy: 1.195597901510276
Energy: 1.2554601167154633
Energy: 1.217986162977849
Energy: 1.3676690331576098
Energy: 1.4779332062781314
Energy: 1.2215556182974452
Energy: 1.245713715866579
Energy: 1.5298187808383112
Energy: 1.2217503325779884
Energy: 1.3494410427544052
Energy: 1.223364648884096
Energy: 1.2217583557721305
Energy: 1.2448187345744128
Energy: 1.4464085428287476
Energy: 1.2214628869996116
Energy: 1.2052320747327003
Energy: 1.1290214125688074
Energy: 1.1269429337005092
Energy: 1.1774633746940144
Energy: 1.1105363913332085
Energy: 1.1400130441624334
Energy: 1.2994382318877111
Energy: 1.187692004723018
Energy: 1.1714657745524657
Energy: 1.2707625456444622
Energy: 1.147648363928477
Energy: 1.1711384014034028
Energy: 1.0850931742807557
Energy: 1.20140349029279
Energy: 1.1676855144231872
Energy: 1.0859334773836782
Energy: 1.1971442171267768
Energy: 1.1335577335916704
Energy: 1.256671586463058
Energy: 1.1993306678340765
Energy: 1.1962805102066714
Energy: 1.2568118119646825
Energy: 1.1975185762188574
Energy: 1.1163277895901769
Energy: 1.524218065532019
Energy: 1.2238496951239446
Energy: 1.2216889708741319
Energy: 1.5242376464811218
Energy: 1.244957933397475
Energy: 1.2216480397407812
Energy: 1.4417022621138083
Energy: 1.224256722769989
Energy: 1.2235382943300404
Energy: 1.4416731754551755
Energy: 1.2247328929238566
Energy: 1.2215706296716642
Energy: 1.25875461090271
Energy: 1.2381600837099274
Energy: 1.189641207447496
Energy: 1.1111571871530241
Energy: 1.195657250431393
Energy: 1.1816938065709728
Energy: 1.1470036255689386
Energy: 1.275497106594349
Energy: 1.277766958372261
Energy: 1.1478725485547796
Energy: 1.2712369956807803
Energy: 1.1714969628024965
Energy: 1.2174104819901475
Energy: 1.0878110953257705
Energy: 1.1155215704908175
Energy: 1.2185198713884933
Energy: 1.0866938247708022
Energy: 1.1518705217261458
Energy: 1.225195022024861
Energy: 1.0874983113331949
Energy: 1.115739498649004
Energy: 1.1953157265911265
Energy: 1.0868085760018351
Energy: 1.1518223188686056
Energy: 1.349849181669429
Energy: 1.299724703190199
Energy: 1.2994814753974842
Energy: 1.3654335760439982
Energy: 1.256529759500305
Energy: 1.2222649366247
Energy: 1.253835882614522
Energy: 1.4717743942127792
Energy: 1.4783418594249171
Energy: 1.090050212883496
Energy: 1.4414662835964624
Energy: 1.2217973151211605
Energy: 1.3295621060825424
Energy: 1.180206649088534
Energy: 1.1808982500920338
Energy: 1.3689673316923963
Energy: 1.1792903594586361
Energy: 1.1830185074070436
Energy: 1.3039377378478303
Energy: 1.1556270400337216
Energy: 1.173040736114999
Energy: 1.2737338377121794
Energy: 1.1887305649961186
Energy: 1.1905979811918068
Energy: 1.256486631551623
Energy: 1.2232743161497508
Energy: 1.1783484719389374
Energy: 1.2567834066724883
Energy: 1.2190806294880503
Energy: 1.1163485844506946

minimum gb energy = 1.0848077688088986 eV
minimum distance =  2.52257048341363 Angstroms
sigma value = 19


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

Energy: 1.659838021340116
Energy: 2.1686515760464764
Energy: 1.6861867782422333
Energy: 1.6623245361591996
Energy: 2.166533435735444
Energy: 1.7444966101217176
Energy: 1.4813995329441598
Energy: 1.3352121660668408
Energy: 1.3320079302576069
Energy: 1.4001443210455338
Energy: 1.3621832128080416
Energy: 1.3103896645011988
Energy: 1.2819831365965435
Energy: 1.274577340977517
Energy: 1.3221654501487672
Energy: 1.2783238848789764
Energy: 1.265076031783614
Energy: 1.307564109622866
Energy: 1.349084220297739
Energy: 1.3215703578783327
Energy: 1.33934073790758
Energy: 1.3531402176446885
Energy: 1.3198889582376727
Energy: 1.3394269009052613
Energy: 1.1608098682037198
Energy: 1.3281286948486253
Energy: 1.327456976908284
Energy: 1.1630471907573452
Energy: 1.3417320656505198
Energy: 1.3360749193199912
Energy: 1.328801200733604
Energy: 1.3607012761125736
Energy: 1.270685971431889
Energy: 1.328912668413213
Energy: 1.3617672371099887
Energy: 1.2526382741608253
Energy: 1.5909758117663653
Energy: 1.6980405855343421
Energy: 1.6532007410808782
Energy: 1.590916744705675
Energy: 1.7718686542488566
Energy: 1.6141599763992074
Energy: 1.4386926138237106
Energy: 1.296632066904171
Energy: 1.3506892991803268
Energy: 1.397548041712126
Energy: 1.3660152905736558
Energy: 1.3578429839192034
Energy: 1.1414424164381267
Energy: 1.2170143620433238
Energy: 1.2448757734296771
Energy: 1.1419988967881092
Energy: 1.2171330351659961
Energy: 1.163289300151855
Energy: 1.4689593117785391
Energy: 1.237557664179767
Energy: 1.22227981340478
Energy: 1.4779973593919729
Energy: 1.279170185817332
Energy: 1.248938578114367
Energy: 1.4232741039039767
Energy: 1.403358317751213
Energy: 1.4761120425853793
Energy: 1.4284065230475806
Energy: 1.3753001834173229
Energy: 1.4024514909304546
Energy: 1.3844614660376398
Energy: 1.321974830596144
Energy: 1.288569948780317
Energy: 1.3712877693976724
Energy: 1.3854648385700852
Energy: 1.2835038985890712
Energy: 1.583930436094576
Energy: 1.3080095646917715
Energy: 1.534049400173843
Energy: 1.5391743587954139
Energy: 1.3230100168206071
Energy: 1.5079408858617667
Energy: 1.4743584665550131
Energy: 1.3148350483687063
Energy: 1.3275090180926552
Energy: 1.4911781736004317
Energy: 1.313751396766717
Energy: 1.3503797253083467
Energy: 1.1603983306683978
Energy: 1.106099432337101
Energy: 1.168759729056679
Energy: 1.1876544787000607
Energy: 1.079386370841742
Energy: 1.2564152162823157
Energy: 1.2117836158903177
Energy: 1.178879486032175
Energy: 1.214411984561897
Energy: 1.2357424958450165
Energy: 1.201368498893521
Energy: 1.2107120189049123
Energy: 1.3890011273609935
Energy: 1.526970929498325
Energy: 1.5521494338168798
Energy: 1.3854008973840988
Energy: 1.5276108925607301
Energy: 1.5760760954734268
Energy: 1.480532296860652
Energy: 1.3735607118790583
Energy: 1.4133329533079617
Energy: 1.4083651177153258
Energy: 1.3818890680184073
Energy: 1.3169463640704946
Energy: 1.284546353535639
Energy: 1.3443419222951098
Energy: 1.450158113848946
Energy: 1.3285722182358797
Energy: 1.357113273320698
Energy: 1.4070513230504347
Energy: 1.374647625035448
Energy: 1.447322004454011
Energy: 1.4474527710486516
Energy: 1.3816282957541324
Energy: 1.4140100166692846
Energy: 1.4236375294183856
Energy: 1.1009521342601223
Energy: 1.2141842799451499
Energy: 1.2099380156803763
Energy: 1.1014419934430675
Energy: 1.223569119159776
Energy: 1.2100053765478356
Energy: 1.1152896652877378
Energy: 1.2088735607299739
Energy: 1.24703638290644
Energy: 1.1756352446792417
Energy: 1.2225937051161448
Energy: 1.21646785863699
Energy: 1.4559359028143053
Energy: 1.5703561507202264
Energy: 1.5765839268322865
Energy: 1.5414239335078692
Energy: 1.6254633229052373
Energy: 1.566646330798881
Energy: 1.3113643099951169
Energy: 1.4359821481540738
Energy: 1.5085544442264402
Energy: 1.305696371711622
Energy: 1.4754239637727955
Energy: 1.4542864547795302
Energy: 1.4675818209931677
Energy: 1.3503838226215696
Energy: 1.3385985444103898
Energy: 1.3435096493536778
Energy: 1.3643126820621394
Energy: 1.403390116655067
Energy: 1.2463713667009513
Energy: 1.3180615080721338
Energy: 1.3556415466706857
Energy: 1.2472666070016682
Energy: 1.3142577568930824
Energy: 1.373584910259243
Energy: 1.2517328352328958
Energy: 1.181064960636329
Energy: 1.1897769190933292
Energy: 1.2181129155622692
Energy: 1.1254989439251841
Energy: 1.229847376249952
Energy: 1.2576798476008102
Energy: 1.1383918188166902
Energy: 1.1971403028881025
Energy: 1.2567727494850778
Energy: 1.1789729422427266
Energy: 1.2339899243251662
Energy: 1.778875294943865
Energy: 1.3644606158130872
Energy: 1.441593700378514
Energy: 1.5397063248071663
Energy: 1.3968447780781774
Energy: 1.5907612885500375

minimum gb energy = 1.079386370841742 eV
minimum distance =  2.48815822506673 Angstroms
sigma value = 101


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

Energy: 1.5396829162851766
Energy: 2.0216878288054994
Energy: 1.8763326157852291
Energy: 1.54174019222812
Energy: 2.0719962901153477
Energy: 1.4565815576007561
Energy: 1.3811191704174557
Energy: 1.4316677338368728
Energy: 1.3306684157587263
Energy: 1.4500308879864907
Energy: 1.4264777049712016
Energy: 1.2836134715412222
Energy: 1.3067050341733117
Energy: 1.3666087394496418
Energy: 1.355156168132225
Energy: 1.317913768317676
Energy: 1.2841449659890392
Energy: 1.349886782634268
Energy: 1.3067161226368862
Energy: 1.299876891202194
Energy: 1.35773428502385
Energy: 1.3336554386298234
Energy: 1.3599417983854583
Energy: 1.3963845571871893
Energy: 1.0527040562144216
Energy: 1.388860096796784
Energy: 1.4015975699070518
Energy: 1.0550025669911964
Energy: 1.3380034006161607
Energy: 1.2253442143330056
Energy: 1.264173960886822
Energy: 1.3896006567393138
Energy: 1.291460570761887
Energy: 1.175384711515646
Energy: 1.3654400250920584
Energy: 1.1834096229403404
Energy: 1.7636858582495438
Energy: 1.7351339842177025
Energy: 1.693865317376883
Energy: 1.692414513082933
Energy: 1.7380593719623272
Energy: 1.6042506504989915
Energy: 1.2193309181216396
Energy: 1.3961822801039394
Energy: 1.3711718829010602
Energy: 1.3169827057858192
Energy: 1.40924680314433
Energy: 1.3112361363983243
Energy: 1.040663873980751
Energy: 1.2743649839388553
Energy: 1.2392381907223726
Energy: 1.041705093407799
Energy: 1.2415315167099867
Energy: 1.1336733487682997
Energy: 1.36674384157461
Energy: 1.2698928265261171
Energy: 1.224213605072896
Energy: 1.1971849846916536
Energy: 1.3300550475138102
Energy: 1.260428853987432
Energy: 1.617676854351869
Energy: 1.5073670075520005
Energy: 1.4729488738514538
Energy: 1.618668109609028
Energy: 1.6078844946349906
Energy: 1.4442203179310045
Energy: 1.4406697803941382
Energy: 1.2496378472426661
Energy: 1.2502436474493406
Energy: 1.4420529217383578
Energy: 1.4114034353910787
Energy: 1.3789744020566526
Energy: 1.2968313292092606
Energy: 1.5405507118446244
Energy: 1.4629219524878037
Energy: 1.2977093206112047
Energy: 1.5393690782523037
Energy: 1.6853888684649194
Energy: 1.5951339553456336
Energy: 1.432562333741247
Energy: 1.3500181805054334
Energy: 1.5278614936067616
Energy: 1.3583658521596236
Energy: 1.2690439746831037
Energy: 1.1700102883392876
Energy: 1.126779999192106
Energy: 1.138723720886429
Energy: 1.1714329607753904
Energy: 1.0399763874675643
Energy: 1.2134091116169536
Energy: 1.2714490748424943
Energy: 1.1855561495220226
Energy: 1.154305576084914
Energy: 1.272125238943022
Energy: 1.3399306677645408
Energy: 1.2902262085242349
Energy: 1.545301374065245
Energy: 1.5377207118680165
Energy: 1.7659426313007613
Energy: 1.5465586392680921
Energy: 1.536944913961553
Energy: 1.4424063294569103
Energy: 1.548349930691829
Energy: 1.4234552316945193
Energy: 1.3599101438123022
Energy: 1.3102128527914967
Energy: 1.4785576392700295
Energy: 1.3931388410851346
Energy: 1.3137918466406389
Energy: 1.3694565976764979
Energy: 1.352334975773918
Energy: 1.305917734957066
Energy: 1.277185565926736
Energy: 1.3544602495845353
Energy: 1.317545829959498
Energy: 1.3215980660716162
Energy: 1.3297471384083155
Energy: 1.318048155387847
Energy: 1.2803393067578672
Energy: 1.319121949988472
Energy: 1.056059331510479
Energy: 1.386146048392368
Energy: 1.3836478357409394
Energy: 1.0555431760210718
Energy: 1.3427756827719703
Energy: 1.2395246436734229
Energy: 1.175050075682009
Energy: 1.3252761517352671
Energy: 1.2562656661293372
Energy: 1.175394921070054
Energy: 1.3244753717298137
Energy: 1.1775149522325863
Energy: 1.3352985954417211
Energy: 1.719667313090258
Energy: 1.6574228054579945
Energy: 1.3356834129643211
Energy: 1.7128437502657188
Energy: 1.6600617725921065
Energy: 1.2810355246402674
Energy: 1.7453421502430124
Energy: 1.655279346534384
Energy: 1.3210373993759545
Energy: 1.5154095425418215
Energy: 1.3256625335888461
Energy: 1.038013480847292
Energy: 1.2403071439850997
Energy: 1.1994259784990633
Energy: 1.0378738511944434
Energy: 1.24092540762548
Energy: 1.1468452260469786
Energy: 1.037648963119956
Energy: 1.2717571170588389
Energy: 1.221593078085077
Energy: 1.0380984627075698
Energy: 1.2686442613308273
Energy: 1.1958526425965954
Energy: 1.3562109187996516
Energy: 1.4528762802305009
Energy: 1.4664571786030374
Energy: 1.3546973924072367
Energy: 1.5528203241928664
Energy: 1.4593042659263757
Energy: 1.3420482087587167
Energy: 1.469392653197399
Energy: 1.471226371661622
Energy: 1.3428603154544418
Energy: 1.4271358791868993
Energy: 1.4075576705558543
Energy: 1.3532257100381209
Energy: 1.3884666250764632
Energy: 1.4138112049921225
Energy: 1.3491041165146305
Energy: 1.3819161967563123
Energy: 1.4459858324369563
Energy: 1.4396386681719446
Energy: 1.553058214555386
Energy: 1.5741414579127233
Energy: 1.2975551752237526
Energy: 1.4195127371650407
Energy: 1.5588153381177
Energy: 1.1894778924091383
Energy: 1.0894704535764668
Energy: 1.1541205169258264
Energy: 1.1907558411958428
Energy: 1.0379420776774342
Energy: 1.220363246291532
Energy: 1.2717752865914627
Energy: 1.1148801171462286
Energy: 1.1605391825626963
Energy: 1.2720427325669106
Energy: 1.1209456240407454
Energy: 1.2412873566355218
Energy: 1.4546525725772974
Energy: 1.3850536864003637
Energy: 1.4644785154123308
Energy: 1.5916169595929317
Energy: 1.358038151288249
Energy: 1.4429228286430233

minimum gb energy = 1.037648963119956 eV
minimum distance =  2.49660663064999 Angstroms
sigma value = 33


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

Energy: 0.01474292572598721
Energy: 0.8439200536331687
Energy: 0.015327233761745503
Energy: 0.016570177984665525
Energy: 0.845806268755353
Energy: 0.01515682136481627
Energy: 0.705478049917669
Energy: 0.10769508668945921
Energy: 0.10651053763685202
Energy: 0.10886881457378514
Energy: 0.7343631179846265
Energy: 0.10609910948449598
Energy: 1.4530318811569445
Energy: 0.84508828560991
Energy: 0.8438411014454953
Energy: 0.8449943899994001
Energy: 1.1254110866756903
Energy: 0.8433613746184455
Energy: 0.01547781181316025
Energy: 0.10769508668982113
Energy: 0.10651053763721392
Energy: 0.10886881457342325
Energy: 0.7343631179850098
Energy: 0.1060991094841128

minimum gb energy = 0.01474292572598721 eV
minimum distance =  2.71787436515079 Angstroms
sigma value = 1