Model name: model_name=EAM_Dynamo_WuTrinkle_2009_CuAg__MO_270337113239_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.492127545177937
cohesive_energy=3.2787006807142314
mass=63.546
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=[1.5988697414274238e-19, 2.3622171856369197e-19, 2.8901343865399195e-19, 3.28244335714116e-19, 3.5890358778233996e-19, 3.8387991932976594e-19, 4.04703409041864e-19, 4.222712758336739e-19, 4.37421458084778e-19, 4.5085250480759995e-19, 4.62921701391522e-19, 4.737524154373619e-19, 4.83383099184336e-19, 4.918457961651239e-19, 4.991805607955759e-19, 5.05441867081248e-19, 5.1068579120433e-19, 5.14973215876914e-19, 5.18389056460602e-19, 5.21024637023532e-19, 5.229664751039399e-19, 5.242786577671859e-19, 5.250284764318979e-19, 5.252639963970959e-19, 5.250076481356559e-19, 5.241921402289499e-19, 5.227261486088399e-19, 5.20489510027776e-19, 5.17333222058796e-19, 5.13052206092748e-19, 5.07382102985022e-19, 4.99986455642478e-19, 4.90448698140276e-19, 4.78272155721876e-19, 4.6287684044577e-19, 4.435770207126059e-19, 4.19467466724174e-19, 3.89295276352686e-19, 3.5130286183064396e-19, 3.0311099085655796e-19, 2.4164027993988e-19, 1.6302788121603597e-19, 6.2229341552877e-20, -6.80974736925654e-20, -2.3843592667188e-19, -4.6209978477828e-19, -7.580506482574919e-19, -1.159320592772694e-18, -1.72400614524936e-18, -2.5533408363067797e-18, -3.82902591583026e-18, -5.9108942340498596e-18, -9.6145818718023e-18]
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: -0.0422236321099957 eV

========================================
theta = 0.0
========================================

Energy: 0.013549998350181853
Energy: 0.013999587558801454
Energy: 0.013954002855507224
Energy: 0.015556004015121533
Energy: 0.29896007620852383
Energy: 0.01409154001583365
Energy: 0.013999587559436243
Energy: 0.06899700434507906
Energy: 0.06897339687362895
Energy: 0.06906927359118788
Energy: 0.06876685899121424
Energy: 0.06884428160993027
Energy: 0.013954002855507224
Energy: 0.06897339687362895
Energy: 0.06889718824382586
Energy: 0.013960790153947272
Energy: 0.06875275353211725
Energy: 0.06893712903954789
Energy: 0.015556004015121533
Energy: 0.06906927359085181
Energy: 0.013960790153611208
Energy: 0.013830180919528411
Energy: 0.06875013214405429
Energy: 0.013944666616529287
Energy: 0.29896007620852383
Energy: 0.06876685899188638
Energy: 0.06875275353211725
Energy: 0.06875013214439035
Energy: 0.0688420058017011
Energy: 0.06881726378746265
Energy: 0.014091540015497584
Energy: 0.06884428160993027
Energy: 0.06893712903954789
Energy: 0.013944666616529287
Energy: 0.06881726378746265
Energy: 0.014002332462964062

minimum gb energy = 0.013549998350181853 eV
minimum distance =  2.46437534960865 Angstroms
sigma value = 1


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

Energy: 0.8311463199665527
Energy: 0.5416479251285441
Energy: 0.5565003798271111
Energy: 0.5070711236568355
Energy: 0.7801634043206761
Energy: 0.5559767574618519
Energy: 0.781291281104849
Energy: 0.5207098149792946
Energy: 0.523075288417874
Energy: 0.5150235418440576
Energy: 0.5199097059516937
Energy: 0.5230931603218533
Energy: 0.7118998778239289
Energy: 0.528254035823611
Energy: 0.5266289538156624
Energy: 0.5271357878851475
Energy: 0.5264833951236477
Energy: 0.5265439775511819
Energy: 0.8320175315851375
Energy: 0.5197541453359129
Energy: 0.5220331622478043
Energy: 0.5183354871435041
Energy: 0.5230957805891399
Energy: 0.522347282267733
Energy: 0.7618416540801931
Energy: 0.523056319691114
Energy: 0.5213023733110591
Energy: 0.5227828745172665
Energy: 0.5231695846473353
Energy: 0.5199968166000366
Energy: 0.7449367522421525
Energy: 0.528860133142803
Energy: 0.5250331497294514
Energy: 0.5209148328141487
Energy: 0.5295684183038915
Energy: 0.5254434828839805
Energy: 0.7465365821726326
Energy: 0.5279832625116625
Energy: 0.527247476639237
Energy: 0.5205681261396538
Energy: 0.5214830059116051
Energy: 0.5266014844728562
Energy: 0.7158185023060327
Energy: 0.5262308700043494
Energy: 0.5306715809519044
Energy: 0.49695118491085144
Energy: 0.5261232843018047
Energy: 0.5269114057708801
Energy: 0.606807021140015
Energy: 0.5292293073119608
Energy: 0.5264977957663246
Energy: 0.5305577894796256
Energy: 0.5211762358747977
Energy: 0.5302633860243412
Energy: 0.6043700069594153
Energy: 0.5223893824169099
Energy: 0.5213546428362635
Energy: 0.525285861999804
Energy: 0.5240727052403145
Energy: 0.5216527849224623
Energy: 0.6001960187002796
Energy: 0.515394193447626
Energy: 0.5157706576574371
Energy: 0.54284443877286
Energy: 0.5147308115306558
Energy: 0.5232432980092243
Energy: 0.5444988529889779
Energy: 0.5245766235651396
Energy: 0.5250623146650568
Energy: 0.5266219368501133
Energy: 0.5259076395351475
Energy: 0.5185411177917592
Energy: 0.54294877714542
Energy: 0.5147729388111906
Energy: 0.5232638485024462
Energy: 0.5268740022772339
Energy: 0.5239824654766972
Energy: 0.523978389687928
Energy: 0.5830405838663669
Energy: 0.5174386293212353
Energy: 0.5220973227776895
Energy: 0.528519560614511
Energy: 0.5176453708167537
Energy: 0.5259397897266634
Energy: 0.5628745051948963
Energy: 0.5214108455985418
Energy: 0.5206126473817035
Energy: 0.5310871695205868
Energy: 0.5143915164835248
Energy: 0.5212391359195377
Energy: 0.5634454397283969
Energy: 0.5293110887879091
Energy: 0.5154564115591364
Energy: 0.5363577511120675
Energy: 0.5284568241373412
Energy: 0.5235824037362836
Energy: 0.6933029840890915
Energy: 0.5256192750493133
Energy: 0.5255966476734313
Energy: 0.5246836006926698
Energy: 0.5256522247573832
Energy: 0.5248203060747769
Energy: 0.6733914910076262
Energy: 0.5290730907255584
Energy: 0.5276802591178171
Energy: 0.527242525847239
Energy: 0.5165048084751033
Energy: 0.5275333306282274
Energy: 0.6749069959827431
Energy: 0.5300615012169937
Energy: 0.5274845310875073
Energy: 0.5217302476241172
Energy: 0.5280683061883875
Energy: 0.5269596368604625
Energy: 0.7105017637769067
Energy: 0.52982736477315
Energy: 0.5274848323735503
Energy: 0.521687498348776
Energy: 0.5279535334864501
Energy: 0.5269758877771127
Energy: 0.7785457967430457
Energy: 0.5215144943331691
Energy: 0.5160334081271808
Energy: 0.5149148525445062
Energy: 0.5215357250403433
Energy: 0.5163196562777969
Energy: 0.7782901467742168
Energy: 0.5300555865677722
Energy: 0.5303542219731957
Energy: 0.5251546822633826
Energy: 0.5312280814178448
Energy: 0.527468736870616
Energy: 0.7818883808622075
Energy: 0.5210287091221075
Energy: 0.5222933140436533
Energy: 0.5185210125057553
Energy: 0.5195472030760252
Energy: 0.5223265173688073

minimum gb energy = 0.49695118491085144 eV
minimum distance =  2.29180271112258 Angstroms
sigma value = 33


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

Energy: 0.9952640957010171
Energy: 0.6050334781749804
Energy: 0.552301715164928
Energy: 0.5511649737910469
Energy: 0.5575696607740503
Energy: 0.6053032847230514
Energy: 0.5628578552982644
Energy: 0.5350508247489395
Energy: 0.5315625500669359
Energy: 0.5450737837208519
Energy: 0.5484551697963704
Energy: 0.534579786545594
Energy: 0.5895656692126943
Energy: 0.5379882083397676
Energy: 0.550543206640397
Energy: 0.5830367562284215
Energy: 0.5499060469889859
Energy: 0.551497384900568
Energy: 0.8056459911488657
Energy: 0.6104075678080965
Energy: 0.5496385825360418
Energy: 0.5743836509361501
Energy: 0.6002368041861956
Energy: 0.5743013805895831
Energy: 0.5233583678790179
Energy: 0.5443726210842709
Energy: 0.5442985751650691
Energy: 0.5493945272227058
Energy: 0.5423906114183517
Energy: 0.5437495930467086
Energy: 0.7768771374039548
Energy: 0.5489830219443242
Energy: 0.5448790219359866
Energy: 0.5848149098752158
Energy: 0.6358996588495052
Energy: 0.5350170317800887
Energy: 0.7756360256051923
Energy: 0.627971065472579
Energy: 0.5873039845496942
Energy: 0.5841884169733962
Energy: 0.5836883824695515
Energy: 0.5843490147719882
Energy: 0.674271098251727
Energy: 0.5841040987999855
Energy: 0.5861684507247851
Energy: 0.5485649274830254
Energy: 0.5836691116063143
Energy: 0.5854315244624573
Energy: 0.6467167574484467
Energy: 0.5842569342987117
Energy: 0.590853420425398
Energy: 0.5945311786352503
Energy: 0.5846504831643392
Energy: 0.5913458082155576
Energy: 0.6444291915637721
Energy: 0.5893595671384172
Energy: 0.5880626656668245
Energy: 0.5965225420050914
Energy: 0.5874187464628616
Energy: 0.586588621376864
Energy: 0.6093834090165982
Energy: 0.5436375691306623
Energy: 0.5433132850047221
Energy: 0.6045035957757012
Energy: 0.5172525898757153
Energy: 0.516921338014961
Energy: 0.5893882498172216
Energy: 0.5667394521868069
Energy: 0.5746073881096481
Energy: 0.5855519179000733
Energy: 0.54019038436057
Energy: 0.5804470033911645
Energy: 0.5853816000993375
Energy: 0.6411036420839159
Energy: 0.5854180172315065
Energy: 0.5821994546066838
Energy: 0.5936376511299899
Energy: 0.5903443823287926
Energy: 0.6506323857022143
Energy: 0.5743015122097271
Energy: 0.5739409929260634
Energy: 0.5935466226000603
Energy: 0.5747035871792342
Energy: 0.5680578973314474
Energy: 0.597530008929102
Energy: 0.5842928223350202
Energy: 0.586162538095779
Energy: 0.592691312961224
Energy: 0.5850812791388236
Energy: 0.5906439471089898
Energy: 0.5939707454718491
Energy: 0.6253868647541428
Energy: 0.62714093279137
Energy: 0.6337824380293359
Energy: 0.593518016607149
Energy: 0.5891342383888166
Energy: 0.6857726699263433
Energy: 0.624663165393399
Energy: 0.6252652281156472
Energy: 0.6187136502617888
Energy: 0.6250897351825058
Energy: 0.6264143350763025
Energy: 0.7070448524895739
Energy: 0.5963495059001793
Energy: 0.5972960562805925
Energy: 0.5837015736964306
Energy: 0.5993408385624402
Energy: 0.5849843715815058
Energy: 0.7097781366664042
Energy: 0.6334530543052239
Energy: 0.6322452616850677
Energy: 0.5838898910056991
Energy: 0.6343662143953823
Energy: 0.6315532763315438
Energy: 0.6197889569955357
Energy: 0.6326190847272505
Energy: 0.6276260082478067
Energy: 0.6276585020059565
Energy: 0.6331012652452304
Energy: 0.6247637085403711
Energy: 0.8520275475048903
Energy: 0.5773953606447031
Energy: 0.5168615888365414
Energy: 0.5171939764482335
Energy: 0.5786340134591169
Energy: 0.5168644289534372
Energy: 0.5402189118306308
Energy: 0.6292497138675816
Energy: 0.6174033371206031
Energy: 0.5399793796325878
Energy: 0.62893510682913
Energy: 0.608139127059025
Energy: 0.68330270609074
Energy: 0.6296370912104957
Energy: 0.630008252325046
Energy: 0.6298012046108078
Energy: 0.6302988509815618
Energy: 0.6272145854714648
Energy: 0.5851273892994985
Energy: 0.6538331952517296
Energy: 0.6612026155258605
Energy: 0.5738347918226175
Energy: 0.6344620428237217
Energy: 0.5945551790697254
Energy: 0.6872516551637218
Energy: 0.6347014285345846
Energy: 0.634345842147433
Energy: 0.6293552803145951
Energy: 0.634531018004957
Energy: 0.6306327961298638
Energy: 0.6020565139039187
Energy: 0.6323172477989905
Energy: 0.6338038870190764
Energy: 0.5930718811759472
Energy: 0.6324326267958326
Energy: 0.6265685585827422
Energy: 0.764552229763943
Energy: 0.5737183281245186
Energy: 0.5774817070728593
Energy: 0.5772626873250959
Energy: 0.5746268663647729
Energy: 0.5795549353649188
Energy: 0.589240824438478
Energy: 0.5835351924906625
Energy: 0.5851318322474008
Energy: 0.5900616418309099
Energy: 0.5837287105956547
Energy: 0.5872564588098361
Energy: 0.6350868312436725
Energy: 0.584095437502815
Energy: 0.5853342405895913
Energy: 0.5990220778159622
Energy: 0.5835521593834514
Energy: 0.5898081536023241
Energy: 0.6458903483166804
Energy: 0.5886733629963793
Energy: 0.587095503977328
Energy: 0.5936957112836707
Energy: 0.6394988814816237
Energy: 0.5896347142765758
Energy: 0.697320745518051
Energy: 0.5168853790084725
Energy: 0.5170656953288176
Energy: 0.5854878878473992
Energy: 0.5381100192788153
Energy: 0.5432050221463506
Energy: 0.5909417478053596
Energy: 0.5412037346451637
Energy: 0.528692093992757
Energy: 0.5910788842762634
Energy: 0.5638776445372927
Energy: 0.5842768806485721
Energy: 0.5915161396985413
Energy: 0.5890620667618112
Energy: 0.5876146128190781
Energy: 0.591755870320196
Energy: 0.6411930808360916
Energy: 0.5883099306983297
Energy: 0.5916887149964384
Energy: 0.574170283902159
Energy: 0.5737941701024449
Energy: 0.5913390725698889
Energy: 0.5743757969251126
Energy: 0.5692187724657265
Energy: 0.594210861865315
Energy: 0.5930084264191884
Energy: 0.5922524126448563
Energy: 0.5838299006121176
Energy: 0.590328414747247
Energy: 0.6327437077752713
Energy: 0.6156603787038492
Energy: 0.5938236509661375
Energy: 0.5941379865390489
Energy: 0.5943656220823192
Energy: 0.6315198807917276
Energy: 0.5940078145351705
Energy: 0.5854433748900278
Energy: 0.5371336296806097
Energy: 0.5375903919091789
Energy: 0.5436894695867586
Energy: 0.537186051193708
Energy: 0.5946699337974886
Energy: 0.6178693593419541
Energy: 0.5972645371169355
Energy: 0.5483011903600629
Energy: 0.584148558091596
Energy: 0.546509620476568
Energy: 0.5874720601392308
Energy: 0.7059140010660653
Energy: 0.5534638923686431
Energy: 0.5500163516158186
Energy: 0.5836780883708378
Energy: 0.5509050304781055
Energy: 0.5853509453386199
Energy: 0.5284386537410318
Energy: 0.5527044616366403
Energy: 0.5476356158201341
Energy: 0.5447264890814665
Energy: 0.55304890794902
Energy: 0.5486907497409053
Energy: 0.6021083267648994
Energy: 0.5415377574064335
Energy: 0.5172217227393358
Energy: 0.5169737104316228
Energy: 0.5300174989460428
Energy: 0.5663308675895515

minimum gb energy = 0.5168615888365414 eV
minimum distance =  2.18702367081904 Angstroms
sigma value = 51


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

Energy: 0.8606154692317178
Energy: 0.5399229645559822
Energy: 0.5398222730724108
Energy: 0.5384417292946044
Energy: 0.5292654258452582
Energy: 0.5657884478779446
Energy: 0.7034771206069976
Energy: 0.5538601597892205
Energy: 0.5453685499817158
Energy: 0.5371121610247596
Energy: 0.5537513523850125
Energy: 0.5598160750009764
Energy: 0.7725662108629433
Energy: 0.5564765402312958
Energy: 0.5565649210556199
Energy: 0.5384905674695432
Energy: 0.5547295043293106
Energy: 0.5518577311749747
Energy: 0.7708487661208293
Energy: 0.5374491270171003
Energy: 0.5379025505347858
Energy: 0.5544778352612263
Energy: 0.5382096773668633
Energy: 0.5456974674286408
Energy: 0.6561389831778991
Energy: 0.5635387106378005
Energy: 0.5621632493559716
Energy: 0.5367713044500868
Energy: 0.5562320856941763
Energy: 0.5617318354699821
Energy: 0.6559598607765377
Energy: 0.5567064774955433
Energy: 0.5619584608599993
Energy: 0.5577317542872102
Energy: 0.5567772535885177
Energy: 0.5629164124613008
Energy: 0.6581734183569645
Energy: 0.5323524816645143
Energy: 0.5318435796810072
Energy: 0.5581993385848215
Energy: 0.5315921439349133
Energy: 0.5557288734538692
Energy: 0.6424206359315671
Energy: 0.5367463473144031
Energy: 0.5367683266329946
Energy: 0.5483098860917878
Energy: 0.536685342839463
Energy: 0.536882242131169
Energy: 0.5543394827952031
Energy: 0.5372470225147562
Energy: 0.5409892787070384
Energy: 0.5547057454948489
Energy: 0.5410699550158686
Energy: 0.5551343495388636
Energy: 0.5554440028003348
Energy: 0.5365699399717697
Energy: 0.5510641369501017
Energy: 0.5555498378092518
Energy: 0.5365174941715606
Energy: 0.5592083783391142
Energy: 0.6087691134290308
Energy: 0.5382257530703093
Energy: 0.5378957150519803
Energy: 0.5752169157219899
Energy: 0.5328111649379532
Energy: 0.5377648645316088
Energy: 0.5786616378159429
Energy: 0.536537499317571
Energy: 0.5372181083294343
Energy: 0.5435628055422321
Energy: 0.5366004194534406
Energy: 0.5552870685611274
Energy: 0.5768774920878502
Energy: 0.5452595902031231
Energy: 0.5492736191471272
Energy: 0.5547045010897073
Energy: 0.5627396184865379
Energy: 0.5557693698447619
Energy: 0.5783754184154197
Energy: 0.5460299403911046
Energy: 0.5458738677972405
Energy: 0.5358000008021507
Energy: 0.5455372631784023
Energy: 0.5455388092003962
Energy: 0.7024798805730715
Energy: 0.5380264398673242
Energy: 0.5380884623187159
Energy: 0.5462163625386276
Energy: 0.5439955308438045
Energy: 0.5380631863485213
Energy: 0.7028607248812567
Energy: 0.5566765205834601
Energy: 0.5561667157560093
Energy: 0.5481013684577059
Energy: 0.5565358995405553
Energy: 0.547642814850234
Energy: 0.7047080510809203
Energy: 0.5570638522481933
Energy: 0.5563367310311869
Energy: 0.5381950964744351
Energy: 0.5565271599035923
Energy: 0.5559064837599222
Energy: 0.8363384013748321
Energy: 0.5434176653413864
Energy: 0.5522273635385273
Energy: 0.5361808702332272
Energy: 0.5430944775833885
Energy: 0.5451562836793995

minimum gb energy = 0.5292654258452582 eV
minimum distance =  2.2606303001239 Angstroms
sigma value = 19


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

Energy: 0.726728862263516
Energy: 0.5265145477054054
Energy: 0.5264330976710705
Energy: 0.5862020103425594
Energy: 0.5121234438428875
Energy: 0.5255928346191372
Energy: 0.7307517225389663
Energy: 0.5122570495657885
Energy: 0.5120328128788909
Energy: 0.530270100221463
Energy: 0.512206785818735
Energy: 0.5122455508979138
Energy: 0.6169494915404563
Energy: 0.5122653595843588
Energy: 0.5123001888028309
Energy: 0.5317317466645635
Energy: 0.5124186084030569
Energy: 0.5122559268455203
Energy: 0.613717510890044
Energy: 0.5123729343951858
Energy: 0.5123449365107222
Energy: 0.5328641535398426
Energy: 0.5125008496008706
Energy: 0.5123124446737457
Energy: 0.6178093646246722
Energy: 0.5122644817794864
Energy: 0.5305150869622678
Energy: 0.530953040256555
Energy: 0.5132618032528762
Energy: 0.5303915775525921
Energy: 0.617848323476254
Energy: 0.4985895608696628
Energy: 0.52967895432033
Energy: 0.5306066973331971
Energy: 0.4985607544318589
Energy: 0.5303474161549404
Energy: 0.6194073453592296
Energy: 0.5307882773137262
Energy: 0.5297748498076527
Energy: 0.530528759832507
Energy: 0.5035162627656158
Energy: 0.5306530635441058
Energy: 0.5744019592488753
Energy: 0.49940535953580334
Energy: 0.4994594975556273
Energy: 0.5128284852561367
Energy: 0.4997346495267896
Energy: 0.4989995664882155
Energy: 0.5121323405870312
Energy: 0.5002782436971297
Energy: 0.4988751324536351
Energy: 0.5121497565182984
Energy: 0.5015387484651189
Energy: 0.49899531465023284
Energy: 0.5130195785290638
Energy: 0.5130296001748614
Energy: 0.5123423145094035
Energy: 0.5132748732617877
Energy: 0.5310263028393774
Energy: 0.5123232539780239
Energy: 0.5113465372281251
Energy: 0.5506205944453919
Energy: 0.5512134734444569
Energy: 0.5116386857061466
Energy: 0.5331556527593977
Energy: 0.5123504946689332
Energy: 0.6168943857861613
Energy: 0.5304071836559446
Energy: 0.5299962694458527
Energy: 0.5121318971672332
Energy: 0.5308107001058661
Energy: 0.5123426372243187
Energy: 0.49850561390988474
Energy: 0.5303170359634043
Energy: 0.5311596882186921
Energy: 0.5002106965193536
Energy: 0.5302875628665505
Energy: 0.5310579898214643
Energy: 0.6176672523497442
Energy: 0.5304370250702596
Energy: 0.5307949068071239
Energy: 0.5120877209688797
Energy: 0.5304494467183187
Energy: 0.5307124435830604
Energy: 0.729054644796834
Energy: 0.5123651329582204
Energy: 0.5121362639004278
Energy: 0.5007917015388383
Energy: 0.51210061006113
Energy: 0.4989617154265899
Energy: 0.7269694113319289
Energy: 0.5137471351279412
Energy: 0.4994593121680849
Energy: 0.4998501885448181
Energy: 0.5123928969220912
Energy: 0.49944595407479603
Energy: 0.617896279604474
Energy: 0.5122289449301785
Energy: 0.5120734003996087
Energy: 0.5303401731473604
Energy: 0.5122224587596306
Energy: 0.5122125681112828
Energy: 0.6156646463331088
Energy: 0.512183119038851
Energy: 0.5122943977701941
Energy: 0.5327469843400401
Energy: 0.5125028496595405
Energy: 0.5122574330057497
Energy: 0.6131047567121295
Energy: 0.51235714372599
Energy: 0.5123538632115839
Energy: 0.532421274055205
Energy: 0.5122889032004719
Energy: 0.5122473340844791
Energy: 0.6177169414185184
Energy: 0.49846965262166565
Energy: 0.5304980011339351
Energy: 0.5302706092657444
Energy: 0.49838300960379595
Energy: 0.5292823087666152
Energy: 0.6146952821028467
Energy: 0.5304903809163999
Energy: 0.5307016556274937
Energy: 0.5312690709035917
Energy: 0.5123656475713484
Energy: 0.5305165668187267
Energy: 0.6173682474848605
Energy: 0.5303613230007324
Energy: 0.5300798625962203
Energy: 0.5301403972198679
Energy: 0.5038771183859272
Energy: 0.5300916593604044
Energy: 0.5764480472951417
Energy: 0.5001775980145466
Energy: 0.4991351101066665
Energy: 0.5759498533718043
Energy: 0.49945197561400456
Energy: 0.5000842038685309
Energy: 0.5121912613763933
Energy: 0.5138225423640973
Energy: 0.5122330157174628
Energy: 0.5122340020933445
Energy: 0.522654644246453
Energy: 0.5121826041836344
Energy: 0.5123003015235842
Energy: 0.5130533599051359
Energy: 0.5122838054346893
Energy: 0.5123817116050791
Energy: 0.5314331161796796
Energy: 0.5122723401615267
Energy: 0.5765888258948444
Energy: 0.533171455389912
Energy: 0.5339161876278895
Energy: 0.5765520945718456
Energy: 0.5328329365025438
Energy: 0.5123542253685728
Energy: 0.6176268141625595
Energy: 0.5303334593500966
Energy: 0.5310228569213944
Energy: 0.5128989372554286
Energy: 0.5307846773100323
Energy: 0.5308269670093004
Energy: 0.49842091634374147
Energy: 0.5303568323787942
Energy: 0.5309693620747322
Energy: 0.49846353698161316
Energy: 0.5305363838401314
Energy: 0.5292593851418386
Energy: 0.5764263474376887
Energy: 0.5309139784837275
Energy: 0.5314564900806383
Energy: 0.5040624921349934
Energy: 0.5304681620767232
Energy: 0.529988180328403
Energy: 0.7277246024440142
Energy: 0.512286581313118
Energy: 0.49889695858921523
Energy: 0.4994835640844143
Energy: 0.5122126412856476
Energy: 0.4991311728136347

minimum gb energy = 0.49838300960379595 eV
minimum distance =  2.32003229052241 Angstroms
sigma value = 27


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

Energy: 0.6198974070258709
Energy: 0.5459329268760149
Energy: 0.5456430228971417
Energy: 0.5219542974392062
Energy: 0.8943405636057652
Energy: 0.5473065285481853
Energy: 0.5390745665127478
Energy: 0.5169597466397274
Energy: 0.5175423724739154
Energy: 0.4899120061992276
Energy: 0.5172691964528958
Energy: 0.4642308087244851
Energy: 0.5561544742494494
Energy: 0.5183817610578279
Energy: 0.5246270115727559
Energy: 0.5077420478680542
Energy: 0.518392237293655
Energy: 0.486112279290359
Energy: 0.48607167285676084
Energy: 0.5179807737556968
Energy: 0.48527892164992437
Energy: 0.4826051457109948
Energy: 0.4961227670882878
Energy: 0.48453736390402286
Energy: 0.6027445556104578
Energy: 0.4775489595131392
Energy: 0.4811263238831166
Energy: 0.518221396425505
Energy: 0.4790874237982214
Energy: 0.4857224626165456
Energy: 0.5167277623571408
Energy: 0.47815675308131583
Energy: 0.4776362100409381
Energy: 0.516739605591405
Energy: 0.48012382515679214
Energy: 0.47770869910284924
Energy: 0.5189295273581
Energy: 0.48174477768346136
Energy: 0.4857234225515884
Energy: 0.5191000270057816
Energy: 0.4891058780290705
Energy: 0.4860454538186733
Energy: 0.5169524929453212
Energy: 0.4780208160064915
Energy: 0.4781586978132476
Energy: 0.5170943765548885
Energy: 0.47849847835081566
Energy: 0.4782758258183338
Energy: 0.5549508236220659
Energy: 0.48062551709787515
Energy: 0.4850383862659491
Energy: 0.517240339639444
Energy: 0.4920266575549635
Energy: 0.4843282469387809
Energy: 0.4879906424787813
Energy: 0.5016033868173916
Energy: 0.5019443251996986
Energy: 0.5109448926845456
Energy: 0.5022166768764366
Energy: 0.5058762941013606
Energy: 0.5552280361316787
Energy: 0.5116100736145469
Energy: 0.5119963806485068
Energy: 0.4856129415197462
Energy: 0.5110246519135906
Energy: 0.5093844841931301
Energy: 0.5390745641886859
Energy: 0.4851357583246547
Energy: 0.4844236876557981
Energy: 0.4898249791131695
Energy: 0.5173680500837329
Energy: 0.4639939526282497

minimum gb energy = 0.4639939526282497 eV
minimum distance =  2.33419316266587 Angstroms
sigma value = 9


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

Energy: 1.049688159807806
Energy: 0.4472663149892657
Energy: 0.444817224123808
Energy: 0.43331278037430054
Energy: 0.4727311860951159
Energy: 0.44035492449813024
Energy: 0.43544038450548284
Energy: 0.45086453388878617
Energy: 0.44979394833693714
Energy: 0.44239692838829836
Energy: 0.45134893818760985
Energy: 0.43891093285998395
Energy: 0.4749404400340226
Energy: 0.4533452542410138
Energy: 0.4516002281570919
Energy: 0.45053058525881823
Energy: 0.4512173262506921
Energy: 0.45327296123509325
Energy: 0.47682357903763806
Energy: 0.4293875803923604
Energy: 0.42569176084179994
Energy: 0.4502475205253904
Energy: 0.4573955689185182
Energy: 0.4255802907487449
Energy: 0.5015831393594602
Energy: 0.4378520847921472
Energy: 0.45910595310126723
Energy: 0.45744621197308716
Energy: 0.43781005765011527
Energy: 0.4470587246033255
Energy: 0.45748064351036577
Energy: 0.4395223255687672
Energy: 0.4595083834030795
Energy: 0.45727800370833327
Energy: 0.4407656476523178
Energy: 0.46154185814029025
Energy: 0.45870735295075843
Energy: 0.4267419812888878
Energy: 0.42597127307660276
Energy: 0.45937953946936705
Energy: 0.43891840595753845
Energy: 0.4431851184878634
Energy: 0.4655080722727065
Energy: 0.44466384397206615
Energy: 0.4501362742505361
Energy: 0.464913716211814
Energy: 0.44517112728947467
Energy: 0.4380242700697248
Energy: 0.5404761612543757
Energy: 0.447721984812992
Energy: 0.4629529268801911
Energy: 0.461866047859108
Energy: 0.4505300699155274
Energy: 0.4634111470611469
Energy: 0.4398362757196137
Energy: 0.4277171400645762
Energy: 0.44973346824600324
Energy: 0.4479628182620193
Energy: 0.45893348092814457
Energy: 0.4256967158231521
Energy: 0.4346541991449565
Energy: 0.4573289331048251
Energy: 0.46044651135139
Energy: 0.4445045074558399
Energy: 0.4572292947485338
Energy: 0.4634431627505502
Energy: 0.5498049353791054
Energy: 0.4578716040986125
Energy: 0.45786473483150586
Energy: 0.4372564506008576
Energy: 0.4575170725731714
Energy: 0.44692083030307617
Energy: 0.6369834475732035
Energy: 0.44911095541883705
Energy: 0.44177758705627607
Energy: 0.44736246841600913
Energy: 0.44867862040843104
Energy: 0.4275128287599999
Energy: 0.5480457089164302
Energy: 0.4587699238577789
Energy: 0.44644372822200845
Energy: 0.4367114795415749
Energy: 0.4587503555939958
Energy: 0.44746660865663956
Energy: 0.4543536559462504
Energy: 0.447378521850638
Energy: 0.44741034915794814
Energy: 0.45227517029678765
Energy: 0.4487944871410654
Energy: 0.4605525817420721
Energy: 0.45136581997494374
Energy: 0.4408782796200888
Energy: 0.45498679999264385
Energy: 0.4524362995877891
Energy: 0.45049167682902663
Energy: 0.4533352364632334
Energy: 0.4499243786177021
Energy: 0.4324758990972072
Energy: 0.4452752363415618
Energy: 0.44994987083773197
Energy: 0.4322869502907829
Energy: 0.4402351593135599
Energy: 0.4975048188064751
Energy: 0.4252353370088818
Energy: 0.4452896457518279
Energy: 0.4497043463417328
Energy: 0.44570212459932623
Energy: 0.44541115077993315
Energy: 0.4747376660350969
Energy: 0.43819149486897646
Energy: 0.44060806197290103
Energy: 0.45105096192334565
Energy: 0.4449400605595649
Energy: 0.44613058646145043
Energy: 0.47568588441807547
Energy: 0.4453362766525568
Energy: 0.44146623246704475
Energy: 0.44446672306044305
Energy: 0.44460395417192733
Energy: 0.4447181185687078
Energy: 0.47551482697934533
Energy: 0.45232126864757644
Energy: 0.4441879384041102
Energy: 0.4550828178554912
Energy: 0.4519033545321735
Energy: 0.44328927602215124
Energy: 0.5036457652150483
Energy: 0.44445474493949594
Energy: 0.4544355728472314
Energy: 0.43848349990712826
Energy: 0.4506839953257955
Energy: 0.45888661084836907
Energy: 0.5088893246359971
Energy: 0.45072749765029335
Energy: 0.4509944478739602
Energy: 0.43837694914336073
Energy: 0.4511331548556256
Energy: 0.4218837929461181
Energy: 0.47500555965188707
Energy: 0.4534358605769096
Energy: 0.4506590392128644
Energy: 0.45532695668251194
Energy: 0.4513943674521226
Energy: 0.4544115104600311
Energy: 0.6419966828104198
Energy: 0.45179275156157517
Energy: 0.4479556159181895
Energy: 0.44438150610466365
Energy: 0.45212185093830215
Energy: 0.44933079073188237
Energy: 0.4744641322907222
Energy: 0.43302217706132484
Energy: 0.44801754247207065
Energy: 0.4589792295832108
Energy: 0.43808899969498455
Energy: 0.4468768092263076
Energy: 0.4468371278155086
Energy: 0.4454272424952647
Energy: 0.42737047759679936
Energy: 0.44653657348230896
Energy: 0.4462885496211385
Energy: 0.4450916583247859
Energy: 0.4623393545709758
Energy: 0.42617762070122667
Energy: 0.4260006238104014
Energy: 0.4577390221298848
Energy: 0.43320056047209776
Energy: 0.46121326072084035
Energy: 0.45771688229760005
Energy: 0.4382873099823744
Energy: 0.463239732272089
Energy: 0.457562031972227
Energy: 0.4455330817224364
Energy: 0.4619067639605968
Energy: 0.4637851119017037
Energy: 0.44502229815416167
Energy: 0.4516940361347552
Energy: 0.45621268523340963
Energy: 0.445151745015085
Energy: 0.4503976651700303
Energy: 0.4345644936435297
Energy: 0.4427285706171735
Energy: 0.449211531864682
Energy: 0.4438964814616413
Energy: 0.45086697028811284
Energy: 0.46319822169142
Energy: 0.4383110609917085
Energy: 0.45688336924663253
Energy: 0.44244993648836856
Energy: 0.4402812470297891
Energy: 0.45723245263960977
Energy: 0.4257019252331735
Energy: 0.548204223780476
Energy: 0.461206453503284
Energy: 0.457359514258022
Energy: 0.4546369304472571
Energy: 0.46031748561661645
Energy: 0.42613458163171597
Energy: 0.4711800389723765
Energy: 0.45737888102485136
Energy: 0.4576368220357278
Energy: 0.4423404496351112
Energy: 0.4571227890323081
Energy: 0.4500431552326187
Energy: 0.47820531485525136
Energy: 0.4455595080126389
Energy: 0.4481615737525153
Energy: 0.44502941031051885
Energy: 0.4576421572863152
Energy: 0.44777594579282537
Energy: 0.4707904036730508
Energy: 0.4490645922831344
Energy: 0.4469340207673253
Energy: 0.4521812915743549
Energy: 0.4504199884737791
Energy: 0.425361680501911
Energy: 0.4514732944391072
Energy: 0.4503212333856032
Energy: 0.4522629046975516
Energy: 0.45228621423230314
Energy: 0.44899223669117366
Energy: 0.44875355876162554
Energy: 0.45014073124892545
Energy: 0.44098673425132495
Energy: 0.43963221894092297
Energy: 0.45000894378240597
Energy: 0.44310573892797117
Energy: 0.4546235869064905
Energy: 0.47155360827243226
Energy: 0.4316096849845178
Energy: 0.42557770908897924
Energy: 0.43961522027626965
Energy: 0.4446640252197027
Energy: 0.45549068656236197
Energy: 0.475548517344334
Energy: 0.44078060547278536
Energy: 0.43683809916216976
Energy: 0.4501702522382336
Energy: 0.44238564978149364
Energy: 0.4431380868178058
Energy: 0.474744348665928
Energy: 0.44637665921448694
Energy: 0.4454928005536694
Energy: 0.4441839629491211
Energy: 0.44721516976138365
Energy: 0.4415613305509487
Energy: 0.4749818571966865
Energy: 0.44616157701375125
Energy: 0.4483802586947717
Energy: 0.45269336738038773
Energy: 0.4455808135653092
Energy: 0.4466189108671871
Energy: 0.5115883415288288
Energy: 0.45113890677354984
Energy: 0.44300237303590473
Energy: 0.4441151579769036
Energy: 0.45059843681395184
Energy: 0.4217219117424253

minimum gb energy = 0.4217219117424253 eV
minimum distance =  2.2877428996614 Angstroms
sigma value = 57


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

Energy: 0.23122523782094923
Energy: 0.23945312583433426
Energy: 0.251393241051231
Energy: 0.23183704932829238
Energy: 0.2588145102377159
Energy: 0.242770188483166
Energy: 0.23203410606204583
Energy: 0.24382308025459268
Energy: 0.24767462445051194
Energy: 0.2549730783199658
Energy: 0.25744217880315
Energy: 0.24802614079118535
Energy: 0.2805174615637203
Energy: 0.24942497008572911
Energy: 0.24835120447004064
Energy: 0.25651672111377566
Energy: 0.25796321225138813
Energy: 0.2527576302250362
Energy: 0.28069260339566343
Energy: 0.2503480722873265
Energy: 0.247375997074392
Energy: 0.25829631549610527
Energy: 0.2608865268551977
Energy: 0.2535985534027863
Energy: 0.27754588307267863
Energy: 0.23459178258413368
Energy: 0.24349344562880065
Energy: 0.2656033244733043
Energy: 0.2325740487665532
Energy: 0.2501049598491928
Energy: 0.25745231949455044
Energy: 0.23687789366051107
Energy: 0.2346193246772651
Energy: 0.24443526516042863
Energy: 0.2357519718137587
Energy: 0.2470696123360775
Energy: 0.25374385794937804
Energy: 0.2438750004958114
Energy: 0.24838688953013452
Energy: 0.2542749314172293
Energy: 0.24184089826067592
Energy: 0.24920545103784517
Energy: 0.25780528380428885
Energy: 0.24674285639292182
Energy: 0.24881870514284776
Energy: 0.2578522997816027
Energy: 0.24394171166281162
Energy: 0.24907454918851443
Energy: 0.2771753384067866
Energy: 0.256031634078524
Energy: 0.25037697576591056
Energy: 0.2579769382087098
Energy: 0.2559573105253422
Energy: 0.2507312440702673
Energy: 0.2355181853351973
Energy: 0.259849487330041
Energy: 0.23412756984907265
Energy: 0.23566069109884047
Energy: 0.2558402417917489
Energy: 0.2425301604526008
Energy: 0.23209537402803615
Energy: 0.24475989161183037
Energy: 0.25063513529150605
Energy: 0.23227453027534292
Energy: 0.24237756445371542
Energy: 0.23418282802034066
Energy: 0.27855824828611897
Energy: 0.25910985499407396
Energy: 0.24838187581727125
Energy: 0.2552178251902276
Energy: 0.2563940933396891
Energy: 0.24780979967555322
Energy: 0.28098104238564775
Energy: 0.27792386675960135
Energy: 0.26011670677706605
Energy: 0.24489617601210267
Energy: 0.2809746670673834
Energy: 0.25936201445671375
Energy: 0.27785099719960915
Energy: 0.2581577680156596
Energy: 0.2501994643985914
Energy: 0.25646387483090144
Energy: 0.25587137893714984
Energy: 0.2483338532249887
Energy: 0.28070976084730315
Energy: 0.23572464436125648
Energy: 0.24050382222228778
Energy: 0.25733670621880245
Energy: 0.23280708142577047
Energy: 0.23289548751916986
Energy: 0.2557813077880097
Energy: 0.2461238857680802
Energy: 0.2479511304483544
Energy: 0.2564111471337119
Energy: 0.23323541324947578
Energy: 0.25142081974787583
Energy: 0.2574271335824566
Energy: 0.2511188970432695
Energy: 0.25342931116502704
Energy: 0.2578948434837416
Energy: 0.2570426198648063
Energy: 0.2504212860512324
Energy: 0.2806416315109001
Energy: 0.24644267658503893
Energy: 0.2500730325447462
Energy: 0.281007738964817
Energy: 0.24401500654075953
Energy: 0.24852293907939305
Energy: 0.23195613802785245
Energy: 0.24435147435210278
Energy: 0.2484801940247628
Energy: 0.23232751444319427
Energy: 0.24532943583661088
Energy: 0.2511294719664313

minimum gb energy = 0.23122523782094923 eV
minimum distance =  2.34636329062939 Angstroms
sigma value = 11


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

Energy: 0.8660303084987974
Energy: 0.3693724256387394
Energy: 0.4408274158918526
Energy: 0.38132629571626914
Energy: 0.3780891904712833
Energy: 0.43611519285036465
Energy: 0.3840158385950532
Energy: 0.373233496125333
Energy: 0.3739627137126765
Energy: 0.37514323205974764
Energy: 0.3711090899317974
Energy: 0.3741813376192572
Energy: 0.37022448464081054
Energy: 0.372973655030054
Energy: 0.3728398772972578
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Energy: 0.36692991780682227
Energy: 0.3701993368289615
Energy: 0.37839182262015486
Energy: 0.37828231966279025
Energy: 0.37034806322225183
Energy: 0.36806705547255975
Energy: 0.3737227715587764
Energy: 0.3730861220294846
Energy: 0.4313068100271078
Energy: 0.40174322430068243
Energy: 0.3839065524577462
Energy: 0.40914014386694264
Energy: 0.3732703505818117
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Energy: 0.43996064001384816
Energy: 0.38463026213478124
Energy: 0.4065872878164219
Energy: 0.40829084072680194
Energy: 0.3831544245719498
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Energy: 0.43083311717917305
Energy: 0.42929554481974774
Energy: 0.4010862099506956
Energy: 0.4325533130957763
Energy: 0.4293919006570088
Energy: 0.6106032274334211
Energy: 0.40828983512356876
Energy: 0.3763357157057819
Energy: 0.46300077949317514
Energy: 0.4103264462575526
Energy: 0.3801152061572638
Energy: 0.6807978364001002
Energy: 0.4000743271276919
Energy: 0.4299285878173172
Energy: 0.37723399958637294
Energy: 0.4011154867502824
Energy: 0.4299505994981824
Energy: 0.5416198252061353
Energy: 0.3731106834860652
Energy: 0.4059474207172308
Energy: 0.36767100331595143
Energy: 0.3732362818188215
Energy: 0.40442017062440183
Energy: 0.49921419040494575
Energy: 0.45250124146053944
Energy: 0.3809835576022442
Energy: 0.45878346015065324
Energy: 0.4340736973838709
Energy: 0.37990301857523534
Energy: 0.5396785205091454
Energy: 0.4042230420834395
Energy: 0.40247768111374016
Energy: 0.3977896288475099
Energy: 0.43043062852317265
Energy: 0.39784091090428264
Energy: 0.5191912164841478
Energy: 0.37448903369117226
Energy: 0.3824301357891631
Energy: 0.5530353041590647
Energy: 0.37977745164152527
Energy: 0.43329403564162483
Energy: 0.36905883877634593
Energy: 0.40500556845451585
Energy: 0.4027639709065756
Energy: 0.36828459335277813
Energy: 0.4041033122800998
Energy: 0.4021248186159177
Energy: 0.3728862452147701
Energy: 0.370128485784407
Energy: 0.3668316647764416
Energy: 0.3734136865969062
Energy: 0.3694336931204178
Energy: 0.375724250442432
Energy: 0.4246543992041664
Energy: 0.3687289692883295
Energy: 0.3776318552948869
Energy: 0.4183903896209647
Energy: 0.36850938916276843
Energy: 0.3765078028658696
Energy: 0.4154993187602336
Energy: 0.36809427435535413
Energy: 0.37244076709396645
Energy: 0.36861123191782097
Energy: 0.37764853918887586
Energy: 0.3742577681815641

minimum gb energy = 0.3592814880541477 eV
minimum distance =  2.31623096045414 Angstroms
sigma value = 41


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

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Energy: 0.4127063292449537
Energy: 0.38893511305661504
Energy: 0.4453993303402675
Energy: 0.5093848566122892
Energy: 0.44432790248751136
Energy: 0.40895421209462596
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Energy: 0.38942307468952747
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Energy: 0.38886137804399
Energy: 0.39415206981339096
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Energy: 0.3908276405087525
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Energy: 0.39318261176514835
Energy: 0.38935205939254053
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Energy: 0.3926506646847061
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Energy: 0.4023446935274094
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Energy: 0.39241754844663906
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Energy: 0.3900687378862285
Energy: 0.40917090215319285
Energy: 0.41319962193044624
Energy: 0.41360150039046234
Energy: 0.3760718212934752
Energy: 0.4130666293170975
Energy: 0.38621668888898913
Energy: 0.43614253040604734
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Energy: 0.3889601307928376
Energy: 0.40103991876463047
Energy: 0.3925788234287892
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Energy: 0.39237225840135825
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Energy: 0.39686788800678846
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Energy: 0.37591789458473485
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Energy: 0.4009698155268403
Energy: 0.3991690186674937
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Energy: 0.37665803592044844
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Energy: 0.3930667811824815
Energy: 0.3909985272167751
Energy: 0.40029349314379914
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Energy: 0.39067216124098614
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Energy: 0.39326668432983225
Energy: 0.3899006711566428
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Energy: 0.38977599723661194
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Energy: 0.3929440540503595
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Energy: 0.38918054822787435
Energy: 0.6290850166105385
Energy: 0.3936624771806415
Energy: 0.42499127685186233
Energy: 0.6327775386411894
Energy: 0.3900017177311931
Energy: 0.40829276911210904
Energy: 0.43613849372887775
Energy: 0.3905252115661117
Energy: 0.38927082001491353
Energy: 0.4036103041926002
Energy: 0.39259375013891357
Energy: 0.38892437849602096
Energy: 0.4101273725650329
Energy: 0.4151819761840247
Energy: 0.3958957218460131
Energy: 0.376205003247589
Energy: 0.41447272015480213
Energy: 0.3775140962718226
Energy: 0.43645754781738294
Energy: 0.39339342620811546
Energy: 0.39047266641981476
Energy: 0.40145968034479323
Energy: 0.39304141328108005
Energy: 0.38961922783414227
Energy: 0.4364538536462226
Energy: 0.3921497598381382
Energy: 0.39284583411426255
Energy: 0.39718399576882035
Energy: 0.40509018589577395
Energy: 0.38842293891044377
Energy: 0.5826311196243154
Energy: 0.40160769138267316
Energy: 0.39668121406318957
Energy: 0.39387725989936684
Energy: 0.4040871939402682
Energy: 0.38991454576340184
Energy: 0.5828733068606963
Energy: 0.3863962133960072
Energy: 0.39106992486471265
Energy: 0.40130058817900727
Energy: 0.3887715917069561
Energy: 0.39135671031079516
Energy: 0.39375645247853713
Energy: 0.37630299262472894
Energy: 0.3758018831942248
Energy: 0.40322435798648865
Energy: 0.3754458234258688
Energy: 0.3768186567796729
Energy: 0.45489466009376917
Energy: 0.3928097942007483
Energy: 0.3913525465278521
Energy: 0.3928374465552136
Energy: 0.40012025489763675
Energy: 0.3914219053117269
Energy: 0.3941334734185893
Energy: 0.38929494692327016
Energy: 0.3891125699574298
Energy: 0.3942619216674671
Energy: 0.3924775735862739
Energy: 0.3900213502866411
Energy: 0.3931418288164003
Energy: 0.39210786063967307
Energy: 0.3890537440671745
Energy: 0.39403247662637964
Energy: 0.3922149739318726
Energy: 0.3913424926991783
Energy: 0.6094285779670812
Energy: 0.39239976136852667
Energy: 0.3763691858931829
Energy: 0.3810615293721823
Energy: 0.3984563660914094
Energy: 0.37828133452610474

minimum gb energy = 0.3754458234258688 eV
minimum distance =  2.30010992653137 Angstroms
sigma value = 33


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

Energy: 0.5254312871697556
Energy: 0.42168495465091693
Energy: 0.42134750383962677
Energy: 0.4189033759623531
Energy: 0.45724152695196696
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Energy: 0.4511453840006988
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Energy: 0.415856419842471
Energy: 0.42529344530392815
Energy: 0.4263854267247322
Energy: 0.4167491733309399
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Energy: 0.43578738729802435
Energy: 0.4175082747945811
Energy: 0.4200774446584122
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Energy: 0.419450661034253
Energy: 0.4069814374949533
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Energy: 0.42869603342497614
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Energy: 0.4315250069568968
Energy: 0.4520225808169919
Energy: 0.42190181524356485
Energy: 0.43173286243848136
Energy: 0.42917585469898817
Energy: 0.4158917709533836
Energy: 0.41805155568860286
Energy: 0.43286113748956334
Energy: 0.44008282337697013
Energy: 0.41814684924333945
Energy: 0.5207293885199231
Energy: 0.4063030647344299
Energy: 0.4059362974779
Energy: 0.415714728957322
Energy: 0.42274972376434045
Energy: 0.4048871934132476

minimum gb energy = 0.4046503865145983 eV
minimum distance =  2.30437373885059 Angstroms
sigma value = 67


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

Energy: 0.6140217175179127
Energy: 0.44633554360176436
Energy: 0.44704489337653885
Energy: 0.4562098328554506
Energy: 0.46375433024617624
Energy: 0.4465031454549826
Energy: 0.4882208041688851
Energy: 0.43686636538194235
Energy: 0.4364792169605769
Energy: 0.43647120330791866
Energy: 0.43912956277784393
Energy: 0.4361619889255535
Energy: 0.4576871920742994
Energy: 0.4252975797193227
Energy: 0.437581557747116
Energy: 0.43700467041480134
Energy: 0.422734654958483
Energy: 0.43704730877995296
Energy: 0.4580785663469631
Energy: 0.43629518290011715
Energy: 0.43658509672333573
Energy: 0.4357924862591308
Energy: 0.4365337186774757
Energy: 0.43682004757253173
Energy: 0.4590298376911858
Energy: 0.4379851356681942
Energy: 0.43819081951158695
Energy: 0.45926187491336856
Energy: 0.43684156047828737
Energy: 0.4384009326035419
Energy: 0.4600944820354535
Energy: 0.4413652452655901
Energy: 0.4408274907427668
Energy: 0.4603401070187715
Energy: 0.4412111364643272
Energy: 0.4417489545134821
Energy: 0.4879638075858808
Energy: 0.4369164994795569
Energy: 0.43635067456228466
Energy: 0.4217092352336157
Energy: 0.4383656045134948
Energy: 0.43622707692339835

minimum gb energy = 0.4217092352336157 eV
minimum distance =  2.3401179165617 Angstroms
sigma value = 3


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

Energy: 0.8297681296438617
Energy: 0.5706465480690468
Energy: 0.5026079070105737
Energy: 0.4901089428322485
Energy: 0.8052915607489093
Energy: 0.5202977538278141
Energy: 0.5248470551391924
Energy: 0.5046636704535516
Energy: 0.49659323925517324
Energy: 0.5057030722190264
Energy: 0.5208539175552837
Energy: 0.5040060667168612
Energy: 0.5411760227954948
Energy: 0.5178813577813431
Energy: 0.5183875213895712
Energy: 0.5081622526459948
Energy: 0.5190007636477795
Energy: 0.5449428512484493
Energy: 0.5352750695929428
Energy: 0.5030105782637239
Energy: 0.5006016016152873
Energy: 0.536713765019493
Energy: 0.5153896302429121
Energy: 0.5056749211023035
Energy: 0.5406687176620515
Energy: 0.49312340596869014
Energy: 0.5507477434817181
Energy: 0.5413162353317262
Energy: 0.5340922321406851
Energy: 0.5226684591643307
Energy: 0.5350708550490277
Energy: 0.534286565947543
Energy: 0.5341892475156221
Energy: 0.530930191716769
Energy: 0.5317785433617236
Energy: 0.5523254893352197
Energy: 0.534282363158584
Energy: 0.5060779204968904
Energy: 0.5025045524813476
Energy: 0.5346236746202152
Energy: 0.5053489751829118
Energy: 0.5380810445930879
Energy: 0.6421663959179028
Energy: 0.5670375627853929
Energy: 0.518844066298162
Energy: 0.5161466155088847
Energy: 0.5516045107311892
Energy: 0.5546855629594261
Energy: 0.5357731822777781
Energy: 0.537803543625337
Energy: 0.5396558204744093
Energy: 0.5412090587948037
Energy: 0.534700695974395
Energy: 0.5465013415633104
Energy: 0.5947180020790385
Energy: 0.5118756138489204
Energy: 0.5113267916911838
Energy: 0.5508775572863627
Energy: 0.5135048005537646
Energy: 0.5258525707118459
Energy: 0.5640269452097048
Energy: 0.5096827264185143
Energy: 0.5199857437621522
Energy: 0.5644899106165452
Energy: 0.5100100447381004
Energy: 0.5515933164881313
Energy: 0.5623003555514103
Energy: 0.5452021301370833
Energy: 0.5457017716676152
Energy: 0.5443970212610674
Energy: 0.544714630577635
Energy: 0.5475889951845759
Energy: 0.5244672464032246
Energy: 0.5512999324287775
Energy: 0.552051259479948
Energy: 0.5136477744766484
Energy: 0.5433329262103532
Energy: 0.537924556603094
Energy: 0.5570758935692014
Energy: 0.5349295744702333
Energy: 0.5382718476046615
Energy: 0.5430878035150679
Energy: 0.5326389925375341
Energy: 0.5438056302731634
Energy: 0.5484691458480363
Energy: 0.5749428681036156
Energy: 0.5736492374258108
Energy: 0.5109829595768601
Energy: 0.5879887515285168
Energy: 0.5385556453189309
Energy: 0.5711848147813069
Energy: 0.5528741205718232
Energy: 0.5525466332330093
Energy: 0.5552566269381594
Energy: 0.5511254686865517
Energy: 0.5628191739279711
Energy: 0.6145504531328262
Energy: 0.5191037768992446
Energy: 0.5192879425013811
Energy: 0.6140871454810867
Energy: 0.5185323286225275
Energy: 0.5206028300693674
Energy: 0.5340907151503139
Energy: 0.5312725566187635
Energy: 0.5335653234280423
Energy: 0.5442429991418178
Energy: 0.5112760896228076
Energy: 0.5351865643212614
Energy: 0.5939651159973567
Energy: 0.5354775132908072
Energy: 0.5326815526644535
Energy: 0.5281375610130472
Energy: 0.5607766199523717
Energy: 0.5427652427912933
Energy: 0.5704282148937062
Energy: 0.5282394351437663
Energy: 0.5336400375516112
Energy: 0.5369889114054981
Energy: 0.5316288910650702
Energy: 0.5076705160968495
Energy: 0.5439677855289892
Energy: 0.5363285620732796
Energy: 0.5371220470334156
Energy: 0.5415643775588329
Energy: 0.5374774909319401
Energy: 0.538576445582417
Energy: 0.5319315872289806
Energy: 0.5338182621787861
Energy: 0.5309152554308625
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Energy: 0.5352127946998565
Energy: 0.544641482104518
Energy: 0.5347982509362218
Energy: 0.5330042291300187
Energy: 0.5314036942295732
Energy: 0.5352552952102656
Energy: 0.5321612023328692
Energy: 0.5317108597404324
Energy: 0.5345644462025342
Energy: 0.5181346951553859
Energy: 0.5179328070703335
Energy: 0.5348644272086513
Energy: 0.5160026211041449
Energy: 0.5529793474978688
Energy: 0.5304618554470184
Energy: 0.5497772980717807
Energy: 0.5517819488537778
Energy: 0.5604627910730888
Energy: 0.5339893958956851
Energy: 0.5504921783985384
Energy: 0.5896982000845106
Energy: 0.5590801684641105
Energy: 0.5066002564376161
Energy: 0.4974852286819109
Energy: 0.5645299050769927
Energy: 0.5088492970835263
Energy: 0.48457600544124435
Energy: 0.5589649334968408
Energy: 0.530080528406556
Energy: 0.5035568691241409
Energy: 0.5653391697603218
Energy: 0.5037014372441507
Energy: 0.5310357525990298
Energy: 0.5462318587942466
Energy: 0.5537688045639252
Energy: 0.5645632184411593
Energy: 0.5380449992410388
Energy: 0.552619298451168
Energy: 0.543778364756676
Energy: 0.5207684174032129
Energy: 0.5185731326299983
Energy: 0.5443782857719173
Energy: 0.5214970898156144
Energy: 0.5433373802869543
Energy: 0.5364055090591211
Energy: 0.5379622543043642
Energy: 0.5461559215172485
Energy: 0.5373824714901401
Energy: 0.5401207631401034
Energy: 0.5434820700222819
Energy: 0.5368253309513946
Energy: 0.5379451095214418
Energy: 0.5368577678231795
Energy: 0.5357448829742981
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Energy: 0.5355330928265564
Energy: 0.5406031010095287
Energy: 0.5481699697759674
Energy: 0.5427803771751635
Energy: 0.5392001825234839
Energy: 0.5401428299406236
Energy: 0.5403653176345122
Energy: 0.5965750541456987
Energy: 0.5438951751515941
Energy: 0.5492794904540813
Energy: 0.5141802493460684
Energy: 0.5648329956555677
Energy: 0.5178317509176475
Energy: 0.5550715901179928
Energy: 0.5464887355532395
Energy: 0.5453648046195124
Energy: 0.515479805475899
Energy: 0.5439146826974719
Energy: 0.5474574225114176
Energy: 0.5449177104756353
Energy: 0.5345096513447685
Energy: 0.5181032754299619
Energy: 0.5433467461388752
Energy: 0.5232671135511945
Energy: 0.5467060391687429
Energy: 0.5640045561246125
Energy: 0.511531130230988
Energy: 0.5229969264300536
Energy: 0.5641170441192328
Energy: 0.5125832585004386
Energy: 0.5157011565209559
Energy: 0.5764515484257605
Energy: 0.538588555383826
Energy: 0.5396607398268509
Energy: 0.5537345306831246
Energy: 0.5359393561890546
Energy: 0.5423637121264249
Energy: 0.5265354614580983
Energy: 0.5849784153619556
Energy: 0.5325524743913876
Energy: 0.5026001736682313
Energy: 0.5370191682798089
Energy: 0.597478413685013
Energy: 0.5521717028525566
Energy: 0.5368137855448425
Energy: 0.5410574383706503
Energy: 0.5434741870620251
Energy: 0.5367124528947957
Energy: 0.5432296855314587
Energy: 0.5485168505650411
Energy: 0.5336833236360456
Energy: 0.5348597299773571
Energy: 0.5106517345544557
Energy: 0.5345411148035709
Energy: 0.5378851800359306
Energy: 0.6096311888208186
Energy: 0.5630435536348092
Energy: 0.5641143299650222
Energy: 0.5499459614556504
Energy: 0.5593114965764127
Energy: 0.5658694718949316
Energy: 0.6012032766712421
Energy: 0.5141347003425341
Energy: 0.5162306180908172
Energy: 0.5675548477497503
Energy: 0.524714920318119
Energy: 0.5568804901085253
Energy: 0.5973622837205544
Energy: 0.5182498706450853
Energy: 0.5167921596242918
Energy: 0.6097584947627732
Energy: 0.5170931963768615
Energy: 0.5315157489449002
Energy: 0.5730009127325407
Energy: 0.5537644224824595
Energy: 0.552649129884857
Energy: 0.5454222844298109
Energy: 0.5502181714391735
Energy: 0.5640011085304278
Energy: 0.7244473003726561
Energy: 0.4894955636557142
Energy: 0.537524914869198
Energy: 0.5438303179704564
Energy: 0.4888050148781665
Energy: 0.5383449980060141
Energy: 0.5345534360959053
Energy: 0.4907089592450588
Energy: 0.53050664056209
Energy: 0.5384673365842101
Energy: 0.4896646557463963
Energy: 0.5327185887777626
Energy: 0.5317116466392027
Energy: 0.5339939647229078
Energy: 0.532292236993152
Energy: 0.5382627971368358
Energy: 0.532301426812716
Energy: 0.5317975043170752
Energy: 0.5407828384458567
Energy: 0.5029490586537014
Energy: 0.5376238114394626
Energy: 0.5414884089242269
Energy: 0.5359529198437528
Energy: 0.5083553300036227
Energy: 0.5302303186432407
Energy: 0.5344661961054189
Energy: 0.5005808201403968
Energy: 0.5314973948324044
Energy: 0.5126210691278519
Energy: 0.49881819766189095
Energy: 0.543419773666349
Energy: 0.5349287000450273
Energy: 0.5139297052298275
Energy: 0.5035378101897071
Energy: 0.512956354231868
Energy: 0.5298236272216983
Energy: 0.5181375475418469
Energy: 0.5008716613241895
Energy: 0.5077590162124082
Energy: 0.4984846297851457
Energy: 0.49229868374822716
Energy: 0.5037978891640857

minimum gb energy = 0.48457600544124435 eV
minimum distance =  2.27497107084263 Angstroms
sigma value = 81


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

Energy: 1.0264801728087543
Energy: 0.5357105303092567
Energy: 0.49917464752732504
Energy: 0.49627951381565166
Energy: 0.5523110246508173
Energy: 0.5175408035021317
Energy: 0.4988942572999301
Energy: 0.5003092572940301
Energy: 0.5018220781851281
Energy: 0.4992257725944567
Energy: 0.49244258807496477
Energy: 0.5114139108106139
Energy: 0.5478435206324714
Energy: 0.5079872912509986
Energy: 0.5078562516061388
Energy: 0.4886264301273134
Energy: 0.5097357073168752
Energy: 0.504219255204889
Energy: 0.549676976497698
Energy: 0.5085064214597012
Energy: 0.5052060873375042
Energy: 0.5513148593324482
Energy: 0.5098092462301358
Energy: 0.4906067186135073
Energy: 0.5454566332774429
Energy: 0.4996292218996704
Energy: 0.5412025674539954
Energy: 0.4891159853934294
Energy: 0.5407489134698686
Energy: 0.490591360584345
Energy: 0.5492922220932877
Energy: 0.5367278331039035
Energy: 0.5367945318267295
Energy: 0.551516060376757
Energy: 0.4983860498475285
Energy: 0.5421734073545627
Energy: 0.543747764145908
Energy: 0.5431875348865408
Energy: 0.4940143628995443
Energy: 0.5666686153228652
Energy: 0.5008893957800471
Energy: 0.5401888365367097
Energy: 0.6000567124591251
Energy: 0.5740748953605918
Energy: 0.5841251426137625
Energy: 0.5045084397527426
Energy: 0.6266400751261882
Energy: 0.5063066455063658
Energy: 0.580684314902792
Energy: 0.5434067352880423
Energy: 0.5485784242234465
Energy: 0.5899206941637344
Energy: 0.5482883516615663
Energy: 0.5469134242678757
Energy: 0.5721569006482556
Energy: 0.5096190210205236
Energy: 0.5099378177019249
Energy: 0.5591108871752629
Energy: 0.5049719118427918
Energy: 0.5101881457899485
Energy: 0.5684206831408773
Energy: 0.5051185123035935
Energy: 0.5055241845997396
Energy: 0.5683566800728697
Energy: 0.5029271613133758
Energy: 0.5533618288031752
Energy: 0.5331317374657432
Energy: 0.5492606622157673
Energy: 0.5450977882064856
Energy: 0.5131846734621903
Energy: 0.5437872407997905
Energy: 0.5445053867447802
Energy: 0.5332579095179136
Energy: 0.5541271477634893
Energy: 0.552361958341949
Energy: 0.5099581655224795
Energy: 0.547831809146264
Energy: 0.5046083147631101
Energy: 0.52362196521128
Energy: 0.5475793220211197
Energy: 0.5484226468460757
Energy: 0.54133384611306
Energy: 0.5462301400046375
Energy: 0.5489339439385469
Energy: 0.6226020423541767
Energy: 0.5578169397723827
Energy: 0.5552847999301933
Energy: 0.5491946163818027
Energy: 0.5602306704096082
Energy: 0.5543884054682762
Energy: 0.5260021740105394
Energy: 0.5360012318329075
Energy: 0.5163548844121482
Energy: 0.5152662111866662
Energy: 0.5851522942197032
Energy: 0.518310396462577
Energy: 0.6229060482887132
Energy: 0.49695085884844664
Energy: 0.4981193349630179
Energy: 0.6225254345019525
Energy: 0.4965581813821173
Energy: 0.5060240001210312
Energy: 0.5060746156020455
Energy: 0.5186263629827884
Energy: 0.5209564586761875
Energy: 0.5105079709560505
Energy: 0.5582100378142059
Energy: 0.5230989809760658
Energy: 0.5892046122226744
Energy: 0.5268370105248589
Energy: 0.5281454296642656
Energy: 0.5189907058442979
Energy: 0.5269563572022541
Energy: 0.5300804600961498
Energy: 0.5893397320285463
Energy: 0.5263939121441037
Energy: 0.5278622894283416
Energy: 0.5186436848897653
Energy: 0.5260997588176971
Energy: 0.5298492346001638
Energy: 0.5067837921211297
Energy: 0.5167267648829788
Energy: 0.5162197504197327
Energy: 0.5068802765869663
Energy: 0.525080268856426
Energy: 0.5176039588852286
Energy: 0.5515183272501489
Energy: 0.5038010655326126
Energy: 0.5046006807506647
Energy: 0.5449965736400131
Energy: 0.5032403957390117
Energy: 0.5256378717225034
Energy: 0.5246531722060039
Energy: 0.5154992758368719
Energy: 0.5147503651872183
Energy: 0.5107597530418042
Energy: 0.5447149462486759
Energy: 0.5140604323761793
Energy: 0.5548749754349686
Energy: 0.5570488454766316
Energy: 0.5566740753206235
Energy: 0.5455257566134556
Energy: 0.5422960205229186
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Energy: 0.5191415047397869
Energy: 0.5541571357272573
Energy: 0.5524072867423172
Energy: 0.5699983548396058
Energy: 0.5524283224459361
Energy: 0.5518735638382584
Energy: 0.5994837444627553
Energy: 0.5822730657070466
Energy: 0.5836978832377668
Energy: 0.5043647844554937
Energy: 0.5809466133111614
Energy: 0.5778179091849649
Energy: 0.5992705884672092
Energy: 0.5731005179539002
Energy: 0.5471484221573083
Energy: 0.5034281605530401
Energy: 0.5762160836579424
Energy: 0.5444263741985671
Energy: 0.5565508680310882
Energy: 0.5063739010522189
Energy: 0.5507658046975977
Energy: 0.5557382133304231
Energy: 0.501480566511239
Energy: 0.5525426648093354
Energy: 0.569260693215251
Energy: 0.510043874212924
Energy: 0.510258087671594
Energy: 0.556878296980588
Energy: 0.509464093427425
Energy: 0.5142400499848648
Energy: 0.5817045884915699
Energy: 0.5434156842138312
Energy: 0.5441366716084295
Energy: 0.5659325100968764
Energy: 0.541314376032671
Energy: 0.5473164249325525
Energy: 0.533064913669778
Energy: 0.5881964520321716
Energy: 0.5401049469381073
Energy: 0.5075788367878806
Energy: 0.5612336352877212
Energy: 0.5030955774885011
Energy: 0.5488443486390754
Energy: 0.540298324539265
Energy: 0.543698874415917
Energy: 0.492252177971753
Energy: 0.5384179918057191
Energy: 0.542031870256377
Energy: 0.6115488779971708
Energy: 0.5343332347926704
Energy: 0.5346244117690447
Energy: 0.5494147728104669
Energy: 0.4912255328473947
Energy: 0.5395342379692191
Energy: 0.5479263953340493
Energy: 0.4974771661397137
Energy: 0.5417487059740534
Energy: 0.500965022846865
Energy: 0.537256623759685
Energy: 0.5063435574111719
Energy: 0.5526009461602099
Energy: 0.4984489426647496
Energy: 0.5658173525983274
Energy: 0.5559891818798749
Energy: 0.5030025411549087
Energy: 0.4954645988095475
Energy: 0.6069656593318032
Energy: 0.5045929856091886
Energy: 0.49734459021157285
Energy: 0.5831579097499873
Energy: 0.5051332552925347
Energy: 0.6059438732285308
Energy: 0.5480442091495341
Energy: 0.5011892479828488
Energy: 0.5012833743864069
Energy: 0.4906945712494855
Energy: 0.4922364047395474
Energy: 0.5124206892764263
Energy: 0.5756416342097387
Energy: 0.4810668029418462
Energy: 0.4904419647598492
Energy: 0.4856950488578978
Energy: 0.48600342252770923
Energy: 0.5172363850538063

minimum gb energy = 0.4810668029418462 eV
minimum distance =  2.2576988301619 Angstroms
sigma value = 43


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

Energy: 0.8704391803568582
Energy: 0.560559000685732
Energy: 0.4808851350159266
Energy: 0.4847779275340976
Energy: 0.5462260445228607
Energy: 0.484816878722139
Energy: 0.4690480780454292
Energy: 0.4773971233367868
Energy: 0.4782294277696333
Energy: 0.49989034118983683
Energy: 0.4803933999239649
Energy: 0.47503867236182634
Energy: 0.47302963853787905
Energy: 0.46356666339061403
Energy: 0.4636207879845875
Energy: 0.49797036069399353
Energy: 0.46337870087067906
Energy: 0.474571410961753
Energy: 0.4755088273412365
Energy: 0.463654059186074
Energy: 0.476076816637396
Energy: 0.47565295894911575
Energy: 0.46408598778687987
Energy: 0.47610895506362383
Energy: 0.4724938036895464
Energy: 0.4763388406028342
Energy: 0.4762928811093532
Energy: 0.47269450184955675
Energy: 0.4774516551878396
Energy: 0.47606552251834117
Energy: 0.4730026781849737
Energy: 0.4776799199664696
Energy: 0.47869077236824115
Energy: 0.4758346346052072
Energy: 0.4796387907533545
Energy: 0.4766632049208855
Energy: 0.4732299757270086
Energy: 0.47391610083658525
Energy: 0.47666803850329204
Energy: 0.47504943910874253
Energy: 0.47359743479389665
Energy: 0.4769882112928911
Energy: 0.5356421420445033
Energy: 0.47289941319405226
Energy: 0.4734422343626006
Energy: 0.4874456174592831
Energy: 0.473784744789617
Energy: 0.4738609111603554
Energy: 0.46896993649302465
Energy: 0.4752510663964328
Energy: 0.4755216408769914
Energy: 0.4725176377396159
Energy: 0.4994645312901967
Energy: 0.4771341440225262
Energy: 0.5815930226010106
Energy: 0.4780776188598851
Energy: 0.4782099733505475
Energy: 0.5338762011819024
Energy: 0.4771443130277168
Energy: 0.4774776410833554
Energy: 0.4793528640579715
Energy: 0.48101074404641964
Energy: 0.4900532941152876
Energy: 0.47157529795367736
Energy: 0.48085761621799467
Energy: 0.4934326658221475
Energy: 0.4866825139849686
Energy: 0.47445676028225614
Energy: 0.4745136301567263
Energy: 0.4797813813574947
Energy: 0.47450624834541505
Energy: 0.47458611052808397
Energy: 0.5567222207515039
Energy: 0.474545639702483
Energy: 0.48467369469092225
Energy: 0.4654318915031848
Energy: 0.5026235950510022
Energy: 0.48505104135289073
Energy: 0.47883569592364134
Energy: 0.4776686240004378
Energy: 0.47707300194980773
Energy: 0.4748929312289688
Energy: 0.4741030059900757
Energy: 0.47950693748623535
Energy: 0.4796642461047938
Energy: 0.4869173202429696
Energy: 0.4907314145963058
Energy: 0.47744370639055844
Energy: 0.47889257083336567
Energy: 0.49089071695532727
Energy: 0.47981106591804
Energy: 0.47573557971208263
Energy: 0.4917143079227315
Energy: 0.4796022790255261
Energy: 0.4807876830533043
Energy: 0.48358712402341086
Energy: 0.4776355666922655
Energy: 0.48686533425462586
Energy: 0.48891524353290283
Energy: 0.4781408715035758
Energy: 0.49010765306010884
Energy: 0.4901735674402495
Energy: 0.4779673419916666
Energy: 0.480118413964596
Energy: 0.48774623350712865
Energy: 0.48834486048372117
Energy: 0.48092483676059794
Energy: 0.48777674573091573
Energy: 0.47884783640722733
Energy: 0.48459088832790087
Energy: 0.48491961826128566
Energy: 0.4775186976802339
Energy: 0.4803398981002912
Energy: 0.47805862121292253
Energy: 0.546931042815922
Energy: 0.48557489024181005
Energy: 0.4906727821587715
Energy: 0.4795068969628065
Energy: 0.4849308944656005
Energy: 0.47712960564941304
Energy: 0.4782181548211628
Energy: 0.4806210964363172
Energy: 0.48410161397350093
Energy: 0.48665742588642613
Energy: 0.47743988297793294
Energy: 0.48029154693639714
Energy: 0.5357022343433737
Energy: 0.48471183367834564
Energy: 0.5153976243227946
Energy: 0.5361906778765549
Energy: 0.47022687009781594
Energy: 0.5416368658653653
Energy: 0.48084339795320313
Energy: 0.48356968294188163
Energy: 0.48066959557173555
Energy: 0.481109750325732
Energy: 0.48825283761618465
Energy: 0.48809459653223786
Energy: 0.5149502927338034
Energy: 0.48510078426371195
Energy: 0.4898815892501073
Energy: 0.5069725985218733
Energy: 0.5765777047375641
Energy: 0.48925758200791
Energy: 0.4813025135327173
Energy: 0.4799197185362442
Energy: 0.48472062799544186
Energy: 0.4811973557280872
Energy: 0.47949934701920194
Energy: 0.48488437646548505
Energy: 0.5016406261680934
Energy: 0.4894344471600926
Energy: 0.48968123687119686
Energy: 0.4918527997509679
Energy: 0.4781820481244727
Energy: 0.49241255941040624
Energy: 0.4996929633535501
Energy: 0.48882876572789163
Energy: 0.49111795799195146
Energy: 0.48286535185436896
Energy: 0.49122248612689995
Energy: 0.49189678853939733
Energy: 0.5023048795136377
Energy: 0.48279652224235553
Energy: 0.48106124589673743
Energy: 0.47449993524501316
Energy: 0.48066920606759866
Energy: 0.4765535577227125
Energy: 0.47438007168959573
Energy: 0.4759854073313498
Energy: 0.4758370282870249
Energy: 0.4743083444068618
Energy: 0.4867855524055398
Energy: 0.47510946717998326
Energy: 0.47580768142175667
Energy: 0.4774107127769204
Energy: 0.47926043453446615
Energy: 0.49929966423552036
Energy: 0.48164426773031177
Energy: 0.4771128462318086
Energy: 0.4695717833370391
Energy: 0.49659731651728567
Energy: 0.4874075635686372
Energy: 0.48821320201497437
Energy: 0.5029371848109475
Energy: 0.46714154736413116

minimum gb energy = 0.46337870087067906 eV
minimum distance =  2.28140655197975 Angstroms
sigma value = 57


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

Energy: 0.6673252345995526
Energy: 0.5000835142699079
Energy: 0.5017675732823369
Energy: 0.4653749070626836
Energy: 0.573806941325981
Energy: 0.48787824357722626
Energy: 0.465058153929834
Energy: 0.4935531067210053
Energy: 0.47245941017419896
Energy: 0.49122395955636794
Energy: 0.49011507948588096
Energy: 0.4713000613232296
Energy: 0.47129916715529613
Energy: 0.45389803428073006
Energy: 0.45341177425637397
Energy: 0.4807401513116686
Energy: 0.45360947575155786
Energy: 0.4532158289648936
Energy: 0.4841068779164275
Energy: 0.46620773793501064
Energy: 0.45312764324226695
Energy: 0.4848050494378014
Energy: 0.4688318345581824
Energy: 0.47325925617977405
Energy: 0.4814529173019346
Energy: 0.47017151029873344
Energy: 0.47055960347855763
Energy: 0.48246002991802966
Energy: 0.465892810250791
Energy: 0.47064201768438024
Energy: 0.4544204544783819
Energy: 0.46830950026609314
Energy: 0.46675565023214716
Energy: 0.465683269064599
Energy: 0.4707537798890771
Energy: 0.465905554773167
Energy: 0.49092310074729634
Energy: 0.48492027970888224
Energy: 0.4734934574621299
Energy: 0.4796605877149628
Energy: 0.4834217614446375
Energy: 0.4719283030570503
Energy: 0.4848411784155131
Energy: 0.47540901728563617
Energy: 0.486975226937391
Energy: 0.46995313946543615
Energy: 0.47493748347146636
Energy: 0.4894994604103701
Energy: 0.4905594122102216
Energy: 0.49217371592178066
Energy: 0.49011647598993163
Energy: 0.4902408740671334
Energy: 0.4865041813672858
Energy: 0.47191474584820303
Energy: 0.5790805547228873
Energy: 0.4890441498592265
Energy: 0.48862782744355315
Energy: 0.47599954017984647
Energy: 0.468039718693185
Energy: 0.48064575031141804
Energy: 0.4738594085133474
Energy: 0.46658512438269106
Energy: 0.4690659690308846
Energy: 0.4908719322421957
Energy: 0.47450472839080793
Energy: 0.48809627139697354
Energy: 0.46147345554428254
Energy: 0.4883424162262076
Energy: 0.48701293226010434
Energy: 0.4626160530971231
Energy: 0.48702399772742777
Energy: 0.4873952277801567
Energy: 0.4608461388056364
Energy: 0.48717623797404525
Energy: 0.5004731704623344
Energy: 0.466196857788247
Energy: 0.4870731428086135
Energy: 0.5015700974098956
Energy: 0.4772867953754424
Energy: 0.47545187999252825
Energy: 0.4749589780623492
Energy: 0.49042273626820954
Energy: 0.49136974443968773
Energy: 0.47011776235315644
Energy: 0.4761917090978999
Energy: 0.452068357126138
Energy: 0.4630050472231809
Energy: 0.4865735531745548
Energy: 0.4502934596527479
Energy: 0.4626227956261792
Energy: 0.48492109638641173
Energy: 0.47254712098722534
Energy: 0.47161241461719855
Energy: 0.4856276590366187
Energy: 0.4659959310750701
Energy: 0.47167945397576955
Energy: 0.4834020537254148
Energy: 0.46828015476298873
Energy: 0.4679977127639381
Energy: 0.4711404969660444
Energy: 0.4668748899015044
Energy: 0.46751132445009047
Energy: 0.4831327054817001
Energy: 0.469798547384877
Energy: 0.4693337900465808
Energy: 0.47053416404603043
Energy: 0.4823869922735858
Energy: 0.470185117495756
Energy: 0.4933037630920613
Energy: 0.4840803656654649
Energy: 0.4873613669934815
Energy: 0.46628940156909193
Energy: 0.4831181877790603
Energy: 0.4888359490776335
Energy: 0.49364742501272035
Energy: 0.4866105341876771
Energy: 0.48738601982936225
Energy: 0.4664621340962738
Energy: 0.48063155652573075
Energy: 0.48806323286434034
Energy: 0.49075833451359496
Energy: 0.4966782814765929
Energy: 0.47557948040716985
Energy: 0.49038421968888984
Energy: 0.4876326054987187
Energy: 0.46926524149046633
Energy: 0.57320396040284
Energy: 0.49013521853815234
Energy: 0.47029899661120955
Energy: 0.47706640794786215
Energy: 0.49130230938148206
Energy: 0.47007923991048917
Energy: 0.4770700499161742
Energy: 0.49453721149556096
Energy: 0.47666056597108863
Energy: 0.49001557783887406
Energy: 0.49114840071727256
Energy: 0.4751285258683253
Energy: 0.4610026019153831
Energy: 0.4876710553601808
Energy: 0.5004075703850817
Energy: 0.46563012647560825
Energy: 0.48795777324719186
Energy: 0.5015194456412817

minimum gb energy = 0.4502934596527479 eV
minimum distance =  2.26399321085314 Angstroms
sigma value = 17


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

Energy: 0.7713949136711366
Energy: 0.5258906200141448
Energy: 0.5530974926689863
Energy: 0.4695935202663165
Energy: 0.48297362588833886
Energy: 0.4698892467282379
Energy: 0.45534979011521887
Energy: 0.5011029426761318
Energy: 0.5025471851779172
Energy: 0.5051863426840154
Energy: 0.4995384670553047
Energy: 0.46339495581670453
Energy: 0.6194029091267201
Energy: 0.43617365192820884
Energy: 0.43631911237231147
Energy: 0.4961902562019848
Energy: 0.4360060133263036
Energy: 0.43706563557420663
Energy: 0.5067183935503915
Energy: 0.43611943830869665
Energy: 0.4527928708572553
Energy: 0.5070190800952707
Energy: 0.4458712726175981
Energy: 0.49604559868879283
Energy: 0.44886069988933125
Energy: 0.4359270712070971
Energy: 0.4362140730851441
Energy: 0.4495980123648306
Energy: 0.4364440726584326
Energy: 0.43613884653298546
Energy: 0.445067639113683
Energy: 0.43442553140695966
Energy: 0.4341191069101293
Energy: 0.4214635420850674
Energy: 0.44669201062804575
Energy: 0.42051534502127424
Energy: 0.44370355135901735
Energy: 0.4489137214113732
Energy: 0.4436310289919134
Energy: 0.44333614309423763
Energy: 0.4456005539328154
Energy: 0.4330844953111889
Energy: 0.4359441960575666
Energy: 0.42547385530960763
Energy: 0.42623860136191366
Energy: 0.4253717371946673
Energy: 0.4248929916032059
Energy: 0.43713151040730464
Energy: 0.4444583417548555
Energy: 0.4230322554262144
Energy: 0.4227158065177676
Energy: 0.44540633268286894
Energy: 0.4246029593706747
Energy: 0.4367995444276019
Energy: 0.4451343455096838
Energy: 0.43469811517355383
Energy: 0.43071500476737723
Energy: 0.4446943652227285
Energy: 0.43490732366689316
Energy: 0.43080993947989177
Energy: 0.4554723222202557
Energy: 0.43498408796675075
Energy: 0.4360200941702322
Energy: 0.43676117101600936
Energy: 0.5040905367640145
Energy: 0.43651215994418535
Energy: 0.4495883175703029
Energy: 0.5037683376284409
Energy: 0.5035476894755114
Energy: 0.4351133491400244
Energy: 0.5072637096974018
Energy: 0.5033029689640773
Energy: 0.5032908407532583
Energy: 0.49540423879445056
Energy: 0.5021050761410387
Energy: 0.43191867668086786
Energy: 0.49912435331654886
Energy: 0.502307904115551
Energy: 0.5102102731782173
Energy: 0.49895631940708934
Energy: 0.5023200022943916
Energy: 0.5099285688374404
Energy: 0.5049218248964643
Energy: 0.45183000069082074
Energy: 0.4836010521170853
Energy: 0.5040766135669629
Energy: 0.49441902275464944
Energy: 0.49634729118196413
Energy: 0.49074421724422623
Energy: 0.49404990401848076
Energy: 0.49060561345031733
Energy: 0.5090724110474119
Energy: 0.4567786758115736
Energy: 0.49911983975320046
Energy: 0.5084042099438927
Energy: 0.5024107448813542
Energy: 0.4981182772965387
Energy: 0.5025766837706888
Energy: 0.551276801157659
Energy: 0.4442502095989912
Energy: 0.5027473233357674
Energy: 0.5512219718537031

minimum gb energy = 0.42051534502127424 eV
minimum distance =  2.29123701565375 Angstroms
sigma value = 17


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

Energy: 0.8154119566819251
Energy: 0.5275800441938244
Energy: 0.4473172457742847
Energy: 0.43139542680796855
Energy: 0.6906992466540292
Energy: 0.4464034924818141
Energy: 0.4561955853648624
Energy: 0.4851605266612174
Energy: 0.41199793762935677
Energy: 0.49793367672058386
Energy: 0.483593120262629
Energy: 0.4477412213649182
Energy: 0.5883352475574121
Energy: 0.3970418308983014
Energy: 0.42517212033534674
Energy: 0.49721531049741774
Energy: 0.39713887869639136
Energy: 0.42538423138700526
Energy: 0.49434714142113945
Energy: 0.4257700768920122
Energy: 0.44016255376092234
Energy: 0.49492259103751834
Energy: 0.4004294257873145
Energy: 0.442695443138552
Energy: 0.4348039724433285
Energy: 0.4144791399247308
Energy: 0.41383395968112535
Energy: 0.43548722646252974
Energy: 0.42407126894307223
Energy: 0.4133673093738887
Energy: 0.4341878387596315
Energy: 0.40955697012785164
Energy: 0.3960126854335235
Energy: 0.3981978644530338
Energy: 0.4286261290040895
Energy: 0.39708711902977445
Energy: 0.40297286265887156
Energy: 0.4336005334210907
Energy: 0.4286853209712906
Energy: 0.39266157386444894
Energy: 0.431413476813015
Energy: 0.394577839407522
Energy: 0.4040850022005382
Energy: 0.393892958922319
Energy: 0.3920773821717437
Energy: 0.3935749731612065
Energy: 0.38705199361843906
Energy: 0.39244604336903427
Energy: 0.4055296012117303
Energy: 0.39563073434682744
Energy: 0.3946197624638718
Energy: 0.4067202787449461
Energy: 0.3988161755701931
Energy: 0.4034786424159176
Energy: 0.40287405908509205
Energy: 0.3897427308784505
Energy: 0.389889981565722
Energy: 0.4029192676632562
Energy: 0.38919100934921436
Energy: 0.39088746860936224
Energy: 0.41120027737427417
Energy: 0.406273600465811
Energy: 0.3896531104212919
Energy: 0.3889096006105326
Energy: 0.4030671591706445
Energy: 0.38980608330987887
Energy: 0.4058908205859097
Energy: 0.4088407548622006
Energy: 0.40335573864967295
Energy: 0.40641046384243246
Energy: 0.40631486901686364
Energy: 0.4033061205025197
Energy: 0.41159735678309406
Energy: 0.3949444342651514
Energy: 0.3984782385491789
Energy: 0.39149407640325146
Energy: 0.41923972647475266
Energy: 0.39867058187566773
Energy: 0.42967342848746515
Energy: 0.3936069042531725
Energy: 0.39407928351669347
Energy: 0.43063629421307725
Energy: 0.39260378003586693
Energy: 0.4287737923750063
Energy: 0.428563330836375
Energy: 0.39533169362980225
Energy: 0.3970697248614569
Energy: 0.42861240632289654
Energy: 0.39575033411296234
Energy: 0.41111792122071805
Energy: 0.49556520873237053
Energy: 0.4269509028734865
Energy: 0.41343316787176465
Energy: 0.424506423469959
Energy: 0.4317454868080507
Energy: 0.41523278749980974
Energy: 0.40450648257136296
Energy: 0.4995717463321735
Energy: 0.4920824247922722
Energy: 0.400630586358537
Energy: 0.49688132350697983
Energy: 0.41261948283640487
Energy: 0.43681691097472036
Energy: 0.4894057991966233
Energy: 0.4842410538868759
Energy: 0.4322759610364405
Energy: 0.4873412500305467
Energy: 0.4180634283570377
Energy: 0.5468789258692643
Energy: 0.4925514805819993
Energy: 0.44839378606053404
Energy: 0.4838075207190695
Energy: 0.43158447559317176
Energy: 0.41289063310656027
Energy: 0.5952247761899486
Energy: 0.4225265529152431
Energy: 0.4226982650763749
Energy: 0.45781203379103125
Energy: 0.4139409267003365
Energy: 0.4895335022201118
Energy: 0.5891199469054912
Energy: 0.4704403998933799
Energy: 0.483766193095097
Energy: 0.4930310849242311
Energy: 0.4850074890489003
Energy: 0.48316246716434796
Energy: 0.4096072790451418
Energy: 0.48804513635230207
Energy: 0.5358636618526909
Energy: 0.4397753301609044
Energy: 0.48683693502094383
Energy: 0.42139291929379946
Energy: 0.41149783036409465
Energy: 0.48729515517879246
Energy: 0.483777043012507
Energy: 0.4122496356422565
Energy: 0.4861224418672024
Energy: 0.45776246226381506
Energy: 0.5864589805007412
Energy: 0.41893911044755233
Energy: 0.483489617487738
Energy: 0.4934404666913194
Energy: 0.40084396604813666
Energy: 0.473594360646912
Energy: 0.5003748026718143
Energy: 0.39846958118076115
Energy: 0.4256947550488232
Energy: 0.5002759392393922
Energy: 0.39836933969265775
Energy: 0.4253177739994212
Energy: 0.4362536126602683
Energy: 0.41375957151481235
Energy: 0.4113053118922004
Energy: 0.4337304788664755
Energy: 0.4248163645253811
Energy: 0.42699924867597666
Energy: 0.39740497381934276
Energy: 0.4149299264783792
Energy: 0.4190553239634565
Energy: 0.3968681579800128
Energy: 0.4143797721691585
Energy: 0.3981787260584957
Energy: 0.402071081767493
Energy: 0.43291886392189305
Energy: 0.42871084811756677
Energy: 0.40226009185558964
Energy: 0.43173646974230534
Energy: 0.42855285871248877
Energy: 0.4065252084145685
Energy: 0.3938930319631259
Energy: 0.39401487298222715
Energy: 0.3919452671737069
Energy: 0.4284662429837115
Energy: 0.39391623032790973
Energy: 0.4100078334625027
Energy: 0.39258143409437424
Energy: 0.3912382466063928
Energy: 0.41084045434897676
Energy: 0.38702426212118485
Energy: 0.3908608258475347
Energy: 0.40667938702075423
Energy: 0.39201903977904434
Energy: 0.3913511741212067
Energy: 0.4070335822241419
Energy: 0.3921202819543744
Energy: 0.39078384301354524
Energy: 0.40421301883956895
Energy: 0.392380852874998
Energy: 0.3923145196626021
Energy: 0.4138605136499425
Energy: 0.3904035118486556
Energy: 0.3924035448888589
Energy: 0.4099173442540694
Energy: 0.40682969571852834
Energy: 0.41050769400177495
Energy: 0.4093403900109956
Energy: 0.40625356418553965
Energy: 0.40337960508619347
Energy: 0.4324863038520674
Energy: 0.39120493617277613
Energy: 0.3933821674202142
Energy: 0.39573177716906593
Energy: 0.3914262156956615
Energy: 0.39417385264128946
Energy: 0.43301594213696853
Energy: 0.3944324059516281
Energy: 0.3942293263826882
Energy: 0.43364605852285776
Energy: 0.39540213850159484
Energy: 0.39465240845444743
Energy: 0.43383463370003394
Energy: 0.39201486620545634
Energy: 0.41085099995844343
Energy: 0.4347404902299003
Energy: 0.3921021113744264
Energy: 0.425997137188372
Energy: 0.5574129572699829
Energy: 0.41060617467552063
Energy: 0.41054090434736806
Energy: 0.42765134675506644
Energy: 0.4312790422712092
Energy: 0.4135057083087998
Energy: 0.4079186485387331
Energy: 0.4961316107372278
Energy: 0.4925132380326411
Energy: 0.41927681178131376
Energy: 0.4942616977388613
Energy: 0.427469542731568
Energy: 0.42253252731728524
Energy: 0.47262377688108287
Energy: 0.42084750889378625
Energy: 0.4129811503516638
Energy: 0.47128016921197147
Energy: 0.4214603507950509
Energy: 0.4286168262267642
Energy: 0.4859296018151526
Energy: 0.488837913784375
Energy: 0.4321871642144055
Energy: 0.49417019976008475
Energy: 0.4335227006280076
Energy: 0.5510812791107271
Energy: 0.41226982188250555
Energy: 0.4763496813576264
Energy: 0.48646084140361606
Energy: 0.41480066530107507
Energy: 0.4852742355153048
Energy: 0.590468753535713
Energy: 0.4515731270882973
Energy: 0.41659011046891714
Energy: 0.48475632055209644
Energy: 0.4359913996935165
Energy: 0.4568127830104119
Energy: 0.41211628241143344
Energy: 0.48671112450391296
Energy: 0.48353009641816946
Energy: 0.41306279184124306
Energy: 0.4853429649878595
Energy: 0.4580514529869201

minimum gb energy = 0.38702426212118485 eV
minimum distance =  2.2931543645948 Angstroms
sigma value = 57


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

Energy: 0.3764980648648236
Energy: 0.5033177817675408
Energy: 0.4259339451315168
Energy: 0.38406560682108926
Energy: 0.6225254037382594
Energy: 0.4267039415688156
Energy: 0.5433110152574496
Energy: 0.3921255569325683
Energy: 0.3932391630198767
Energy: 0.4798620141059509
Energy: 0.3920091133465432
Energy: 0.394744598087411
Energy: 0.5564464102877804
Energy: 0.37772072986040317
Energy: 0.38840175753178063
Energy: 0.4796097884994091
Energy: 0.3769140830168428
Energy: 0.41360011405715075
Energy: 0.47594146021831824
Energy: 0.37805267753117267
Energy: 0.42370500153143426
Energy: 0.4103262926107745
Energy: 0.3798527456097106
Energy: 0.42606600610759443
Energy: 0.4135537974894976
Energy: 0.3923398199597436
Energy: 0.3942394048312802
Energy: 0.413540777425055
Energy: 0.4081355191372233
Energy: 0.39713190014683303
Energy: 0.3695107436164417
Energy: 0.39776839145731835
Energy: 0.3783775121689829
Energy: 0.36441455892112484
Energy: 0.4273071495341808
Energy: 0.3771795166888755
Energy: 0.3965934982555624
Energy: 0.42116828739417883
Energy: 0.42355764660242723
Energy: 0.37372015404452763
Energy: 0.4189840229839021
Energy: 0.3737739585369422
Energy: 0.501874483463867
Energy: 0.36814021826218424
Energy: 0.3717620416498736
Energy: 0.3944481550958406
Energy: 0.3618399403859527
Energy: 0.3783847191063447
Energy: 0.3874553622087724
Energy: 0.37564155557405887
Energy: 0.383326506035376
Energy: 0.38865079156541604
Energy: 0.37298795400546725
Energy: 0.3944895594427856
Energy: 0.39499594782383646
Energy: 0.36643497618803095
Energy: 0.366118465002512
Energy: 0.3956744673187403
Energy: 0.36565763349519487
Energy: 0.36643875996571473
Energy: 0.37595676569508635
Energy: 0.38286355152970314
Energy: 0.36950426185936147
Energy: 0.36488483189037874
Energy: 0.38059616928327666
Energy: 0.3702752040383368
Energy: 0.3883120481368504
Energy: 0.3782566353343922
Energy: 0.38069421861940733
Energy: 0.3721265843468177
Energy: 0.377123433465882
Energy: 0.36162025268662695
Energy: 0.37354678603319846
Energy: 0.3941577383991797
Energy: 0.36492923102120867
Energy: 0.3645683795599982
Energy: 0.3977376675909036
Energy: 0.3639235154599232
Energy: 0.37263982335278856
Energy: 0.3619367952537792
Energy: 0.3741962520868029
Energy: 0.37380365407726845
Energy: 0.3759051139043988
Energy: 0.3803288672937706
Energy: 0.38513780399992986
Energy: 0.36103784617795076
Energy: 0.3616744093696588
Energy: 0.3859481680037672
Energy: 0.3827155305275177
Energy: 0.3722414870583529
Energy: 0.39631746129597
Energy: 0.39419385079802916
Energy: 0.36470500453962135
Energy: 0.3654529693900488
Energy: 0.3916831772892077
Energy: 0.3635531821956066
Energy: 0.3733576658060365
Energy: 0.39205952651137005
Energy: 0.395351276854096
Energy: 0.3888070533309841
Energy: 0.39178811039429223
Energy: 0.3776060206424397
Energy: 0.3744371799261682
Energy: 0.3750002431452467
Energy: 0.37536875629744737
Energy: 0.3750629843547612
Energy: 0.3754083437013893
Energy: 0.3766940335461169
Energy: 0.41608640492115856
Energy: 0.3744832747718807
Energy: 0.393467682166683
Energy: 0.41702457550854166
Energy: 0.37534084641622306
Energy: 0.42385744436117667
Energy: 0.5214594362043646
Energy: 0.37779374064043497
Energy: 0.3777946436249536
Energy: 0.4076572475448247
Energy: 0.39411086926053596
Energy: 0.39357819408221095
Energy: 0.5208797846054081
Energy: 0.4101429853276629
Energy: 0.3929694185774303
Energy: 0.4076063225187498
Energy: 0.40896773747375276
Energy: 0.3935156684213382
Energy: 0.372934639235672
Energy: 0.48242194458308024
Energy: 0.4062812495787467
Energy: 0.37076272372202274
Energy: 0.48190129123219094
Energy: 0.39192269247537037
Energy: 0.38941317378103035
Energy: 0.43972963261356096
Energy: 0.4448332281885877
Energy: 0.3814435603075708
Energy: 0.48038768436489765
Energy: 0.4479101000769163
Energy: 0.5189061638045951
Energy: 0.4154469976846207
Energy: 0.3981665852233627
Energy: 0.3937085660971708
Energy: 0.4158570562295531
Energy: 0.39550139928790595
Energy: 0.558800673312529
Energy: 0.3924071072048977
Energy: 0.39293279344721344
Energy: 0.46313892134005114
Energy: 0.3921862029741447
Energy: 0.4524177693576281
Energy: 0.5563820663564992
Energy: 0.43688795628233446
Energy: 0.43840781475209617
Energy: 0.476981746807378
Energy: 0.4529764251900636
Energy: 0.3931806809526014
Energy: 0.3754701274854305
Energy: 0.46939990346601407
Energy: 0.4247454698014198
Energy: 0.3777900027405104
Energy: 0.46733714428958223
Energy: 0.4072475193146689

minimum gb energy = 0.36103784617795076 eV
minimum distance =  2.32300255688135 Angstroms
sigma value = 43


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

Energy: 0.3209847923174751
Energy: 0.4056682025035426
Energy: 0.377329686372204
Energy: 0.32331135652797566
Energy: 0.4504983637512784
Energy: 0.3552298566359482
Energy: 0.4519350478815483
Energy: 0.33246011753445537
Energy: 0.3333798403344083
Energy: 0.39101962658544964
Energy: 0.35328589176917874
Energy: 0.33093013876896377
Energy: 0.47143990797816643
Energy: 0.314451116000618
Energy: 0.3257104398908883
Energy: 0.3937721637835424
Energy: 0.31398143728625055
Energy: 0.326004485070186
Energy: 0.41274255317333947
Energy: 0.32547284040350694
Energy: 0.32788548612637397
Energy: 0.35462517618434297
Energy: 0.384489353134244
Energy: 0.36547388530351776
Energy: 0.4086273968475698
Energy: 0.3328490017127981
Energy: 0.33361101928628367
Energy: 0.3478301498773806
Energy: 0.37060785073509533
Energy: 0.33036017981450105
Energy: 0.3116061892473881
Energy: 0.3658554767982532
Energy: 0.32291839762697544
Energy: 0.31972318158415036
Energy: 0.3654704841373787
Energy: 0.3273388302179918
Energy: 0.4352994274101174
Energy: 0.36600794869506426
Energy: 0.3655828690228246
Energy: 0.3148718181853531
Energy: 0.36927456397577224
Energy: 0.31513668962202007
Energy: 0.43147530112986915
Energy: 0.30385383630532714
Energy: 0.30901787867877806
Energy: 0.31566361852655617
Energy: 0.3032622107020883
Energy: 0.30904442557598244
Energy: 0.34053635432963036
Energy: 0.3083120160447494
Energy: 0.34493606052016373
Energy: 0.34155898851852406
Energy: 0.3182023270668277
Energy: 0.33946413420763377
Energy: 0.33029192165117965
Energy: 0.3042892125846275
Energy: 0.3047491350821346
Energy: 0.33973152835800474
Energy: 0.30454287374580513
Energy: 0.30460367303047436
Energy: 0.3093172322083929
Energy: 0.32397266557434534
Energy: 0.3043196868417089
Energy: 0.3123931036710691
Energy: 0.3240287038472962
Energy: 0.301386577631471
Energy: 0.34227308666099376
Energy: 0.3238499720691223
Energy: 0.32380182798403256
Energy: 0.30821053594263353
Energy: 0.3282312347814266
Energy: 0.30815505275024896
Energy: 0.4140791130168448
Energy: 0.3213669759564257
Energy: 0.32499017643549
Energy: 0.32507386917958186
Energy: 0.3212901710068581
Energy: 0.3250357397355717
Energy: 0.3146631262524479
Energy: 0.3162553653132975
Energy: 0.3148458446106611
Energy: 0.3152697132528974
Energy: 0.31194565792105733
Energy: 0.31459921971485577
Energy: 0.3144989218231799
Energy: 0.2990892482598174
Energy: 0.29852786834642675
Energy: 0.3143533826169628
Energy: 0.2997073575308995
Energy: 0.2984866512019126
Energy: 0.311132071011531
Energy: 0.31049014300750916
Energy: 0.2998218764308802
Energy: 0.2994261043568574
Energy: 0.31039954647457874
Energy: 0.30048688925253575
Energy: 0.3164268236723058
Energy: 0.31020817968199643
Energy: 0.3104129019875053
Energy: 0.3007691143307414
Energy: 0.3164620057181481
Energy: 0.3011059565459582
Energy: 0.31059469158699465
Energy: 0.30112117950387685
Energy: 0.3008839450622323
Energy: 0.31066438223045145
Energy: 0.31944831258202977
Energy: 0.300493882263098
Energy: 0.3104292846755579
Energy: 0.3089626627098584
Energy: 0.31055384342766323
Energy: 0.3116943753499032
Energy: 0.34454250346441256
Energy: 0.3104902305070014
Energy: 0.31341768725185865
Energy: 0.30397889091858754
Energy: 0.3042419056805218
Energy: 0.36673730921661973
Energy: 0.32124877106328015
Energy: 0.30356400753702273
Energy: 0.3256263702049425
Energy: 0.31442800779143054
Energy: 0.31474530776499304
Energy: 0.312523847923762
Energy: 0.32063039520918357
Energy: 0.3042471166904069
Energy: 0.31139419151874786
Energy: 0.3146905629332336
Energy: 0.3123118832942587
Energy: 0.29961327639270113
Energy: 0.31458935833467105
Energy: 0.29913201321472993
Energy: 0.32364353237853166
Energy: 0.3007393926587709
Energy: 0.30048131229679087
Energy: 0.32354959812310463
Energy: 0.3012973854495073
Energy: 0.30073524808402397
Energy: 0.3236087347393297
Energy: 0.33442440478120405
Energy: 0.3236046860942311
Energy: 0.3246144298997798
Energy: 0.31822259931828006
Energy: 0.32375882888629776
Energy: 0.4209710170653694
Energy: 0.3142179774564398
Energy: 0.3197906923788584
Energy: 0.3340447591416646
Energy: 0.3135726366568282
Energy: 0.3188844815824857
Energy: 0.3891264604664481
Energy: 0.33961428787208253
Energy: 0.339382807041401
Energy: 0.30953417100909664
Energy: 0.34429941875862247
Energy: 0.3099855498924739
Energy: 0.31071644974451545
Energy: 0.3392520933670222
Energy: 0.31438969762216906
Energy: 0.3041502039667067
Energy: 0.3398611916307077
Energy: 0.30640087010881495
Energy: 0.35654201729098756
Energy: 0.3164198777145689
Energy: 0.3167873175504545
Energy: 0.33086702235746485
Energy: 0.3147292824022084
Energy: 0.31575436564221543
Energy: 0.36726943892701963
Energy: 0.3168671962337414
Energy: 0.3657692894489723
Energy: 0.3680533954435418
Energy: 0.31562541084329787
Energy: 0.3657177809387731
Energy: 0.44612174537799026
Energy: 0.309123235775713
Energy: 0.3173190791996871
Energy: 0.35435377808103535
Energy: 0.30863233848933813
Energy: 0.31758064696583094
Energy: 0.4450612758998093
Energy: 0.35305160348291664
Energy: 0.3531918733312798
Energy: 0.3531216001986181
Energy: 0.35336100581537744
Energy: 0.33230463373066965
Energy: 0.31561732829979455
Energy: 0.4112895955101253
Energy: 0.3357414610385357
Energy: 0.31400657508647106
Energy: 0.4112761671661044
Energy: 0.32591550595002206
Energy: 0.4101469062736116
Energy: 0.36338760406019943
Energy: 0.3556567847046626
Energy: 0.3555790681799123
Energy: 0.38292918202226295
Energy: 0.3567846138346399
Energy: 0.44632434810045585
Energy: 0.3396168055189341
Energy: 0.3416434113337176
Energy: 0.35416568459607006
Energy: 0.34863243714403885
Energy: 0.3838681775516073
Energy: 0.47307316875584937
Energy: 0.3242489293170155
Energy: 0.343834142543497
Energy: 0.3843002324903566
Energy: 0.33833139169432297
Energy: 0.35790929388897896
Energy: 0.45193504881621904
Energy: 0.3663087372619221
Energy: 0.35564488715948744
Energy: 0.39137228930175383
Energy: 0.3827411743630946
Energy: 0.33184816518088167

minimum gb energy = 0.2984866512019126 eV
minimum distance =  2.32987351124419 Angstroms
sigma value = 81


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

Energy: 0.19282239888025796
Energy: 0.2116471030118203
Energy: 0.032340128604455794
Energy: 0.033190463057552834
Energy: 0.3187078392845175
Energy: 0.19294030615657823
Energy: 0.2112327088267528
Energy: 0.3411442558488395
Energy: 0.3406480823604252
Energy: 0.36887356063349774
Energy: 0.3423539224451689
Energy: 0.3400896169661664
Energy: 0.35291290627450045
Energy: 0.03210707112549809
Energy: 0.03234603880046998
Energy: 0.36781151173818677
Energy: 0.03200809287155779
Energy: 0.05183186830645719
Energy: 0.3550961630573282
Energy: 0.03213717385872828
Energy: 0.03209854500363913
Energy: 0.36167628867263074
Energy: 0.03211728379867741
Energy: 0.05104399399668181
Energy: 0.05080816947435003
Energy: 0.374608255640077
Energy: 0.3752617334546535
Energy: 0.05126493341503185
Energy: 0.3742310416365251
Energy: 0.3755383024542658
Energy: 0.03242309279029236
Energy: 0.3562057707115665
Energy: 0.03242692580147155
Energy: 0.033609054667155254
Energy: 0.356288054500117
Energy: 0.03208620654383834
Energy: 0.3722678403709832
Energy: 0.3397540965998087
Energy: 0.3395586574484192
Energy: 0.37842448354105296
Energy: 0.3599329616307686
Energy: 0.356329129479885
Energy: 0.3717715996747136
Energy: 0.032132360662580586
Energy: 0.032181950479053256
Energy: 0.3775386994617432
Energy: 0.03203321885696931
Energy: 0.032519958188765005
Energy: 0.3373562377361718
Energy: 0.03229928032819953
Energy: 0.05199742206561361
Energy: 0.3513775543448284
Energy: 0.03217383450566705
Energy: 0.05175457313076294
Energy: 0.1929387888817305
Energy: 0.3590166014439476
Energy: 0.35941747406071756
Energy: 0.03230586473969877
Energy: 0.35728041004371053
Energy: 0.3565957225648498

minimum gb energy = 0.03200809287155779 eV
minimum distance =  2.37543522667498 Angstroms
sigma value = 3


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

Energy: 0.3810407729837373
Energy: 0.3909756857422792
Energy: 0.37532743525791423
Energy: 0.3561669127900947
Energy: 0.3712111641848481
Energy: 0.35681787422973665
Energy: 0.37527359325060333
Energy: 0.37411597995214146
Energy: 0.3746206989622882
Energy: 0.37386325800110554
Energy: 0.37750981329596744
Energy: 0.3756331233181073
Energy: 0.38427081188210366
Energy: 0.3570110496101566
Energy: 0.3570688930067676
Energy: 0.37178281818302916
Energy: 0.35567342986619954
Energy: 0.36873686836012565
Energy: 0.3629465476077246
Energy: 0.3571212934687598
Energy: 0.35699734605743405
Energy: 0.36316114705881447
Energy: 0.3242999103322285
Energy: 0.3695791831181233
Energy: 0.33064781013949335
Energy: 0.3756194049604664
Energy: 0.3748881631985861
Energy: 0.33072880164337276
Energy: 0.37774410487379
Energy: 0.37491130292193287
Energy: 0.3551631111097568
Energy: 0.373794738332476
Energy: 0.36342576637464247
Energy: 0.3112275145874297
Energy: 0.3738886865193318
Energy: 0.34471452181758194
Energy: 0.3636860447021716
Energy: 0.33435790189650705
Energy: 0.3643478560188492
Energy: 0.36355700104018246
Energy: 0.3364259269091444
Energy: 0.36455077770214944
Energy: 0.3594018929445434
Energy: 0.3495605296901306
Energy: 0.3497020926488974
Energy: 0.3593376020468478
Energy: 0.3344371673733794
Energy: 0.3391017893060036
Energy: 0.36916566831065545
Energy: 0.35019805378930163
Energy: 0.3674946863929291
Energy: 0.3675606259810088
Energy: 0.3111106452887283
Energy: 0.37022543581014794
Energy: 0.34212623750683174
Energy: 0.3367202052203409
Energy: 0.33394040228879956
Energy: 0.3419006595990631
Energy: 0.33820492499430427
Energy: 0.3424364452267086
Energy: 0.3510266960078153
Energy: 0.35367376454480237
Energy: 0.3540415569914043
Energy: 0.29922098783941864
Energy: 0.3546454348170079
Energy: 0.3385122130285163
Energy: 0.3174087307173627
Energy: 0.3564410289091702
Energy: 0.3573626336184266
Energy: 0.3141423860884808
Energy: 0.3555932474624614
Energy: 0.3133662472525191
Energy: 0.31402163504292224
Energy: 0.33172416601513394
Energy: 0.34164405811642545
Energy: 0.314053653581936
Energy: 0.3317654939048583
Energy: 0.3287350010929618
Energy: 0.34937028862256847
Energy: 0.32780382027879346
Energy: 0.3437448091594232
Energy: 0.3440881982928116
Energy: 0.32590994935962214
Energy: 0.34328280379143666
Energy: 0.34953204320807085
Energy: 0.30435369485604125
Energy: 0.29898209071884196
Energy: 0.3496204414555785
Energy: 0.3024816205803283
Energy: 0.29925634932915623
Energy: 0.34531800703459836
Energy: 0.33663046637402666
Energy: 0.3360077015685494
Energy: 0.3338397886531888
Energy: 0.34293231565186316
Energy: 0.33620630211370167
Energy: 0.2959809593696561
Energy: 0.3358744752181903
Energy: 0.33496836359147
Energy: 0.29670192420086255
Energy: 0.33739179422701304
Energy: 0.29148584164160674
Energy: 0.29198243806126895
Energy: 0.3319599962617217
Energy: 0.3330059287710522
Energy: 0.2919156758009288
Energy: 0.3321773128239183
Energy: 0.3330755700795624
Energy: 0.340354513222345
Energy: 0.3164279212395642
Energy: 0.3320727648837492
Energy: 0.3138906789496762
Energy: 0.3162564248910834
Energy: 0.3335237482800306
Energy: 0.34275738163648894
Energy: 0.2972989053583798
Energy: 0.29161988090301827
Energy: 0.3435516976927684
Energy: 0.2949187702202497
Energy: 0.2918562673084859
Energy: 0.3428036818675842
Energy: 0.33731870724561486
Energy: 0.3360255878907757
Energy: 0.3431041533784011
Energy: 0.3453061145139595
Energy: 0.33478839458521614
Energy: 0.3029363270010117
Energy: 0.3374419286823035
Energy: 0.3343163292315639
Energy: 0.30355525608867445
Energy: 0.3348951336885971
Energy: 0.29906902858376117
Energy: 0.29895329131054793
Energy: 0.3435120186568568
Energy: 0.3436059738429676
Energy: 0.2989429013621909
Energy: 0.34400173410711216
Energy: 0.3440098514575294
Energy: 0.3471138721910363
Energy: 0.3142102019839024
Energy: 0.3420810087126004
Energy: 0.3355073098145859
Energy: 0.3141557438214874
Energy: 0.33540305979106605
Energy: 0.36054756875477184
Energy: 0.3140678408287325
Energy: 0.3134643573313691
Energy: 0.36040603781195735
Energy: 0.31723517639834886
Energy: 0.31364200243289675
Energy: 0.3566021131367931
Energy: 0.34463535968358283
Energy: 0.34479124112060283
Energy: 0.35734933473965586
Energy: 0.331942590543933
Energy: 0.3555734400418884
Energy: 0.33778797106000036
Energy: 0.34458911125072134
Energy: 0.3484766145016216
Energy: 0.3376077510294501
Energy: 0.35856765420877357
Energy: 0.34278773402327706
Energy: 0.3205370524319751
Energy: 0.37313703662778847
Energy: 0.37313172806672623
Energy: 0.3205182932718902
Energy: 0.376601299673927
Energy: 0.36982349209396553
Energy: 0.35372747876194977
Energy: 0.35976586461158816
Energy: 0.3599893980878083
Energy: 0.30474543459109354
Energy: 0.36004991285331595
Energy: 0.34125548695491603
Energy: 0.33696701144789326
Energy: 0.36176526318071967
Energy: 0.3618047621701794
Energy: 0.3365820323392265
Energy: 0.3635023199941781
Energy: 0.36748305676709103
Energy: 0.36090486428405427
Energy: 0.35359575578460356
Energy: 0.3538111637380412
Energy: 0.3607095977809671
Energy: 0.3361847190635821
Energy: 0.35394658738887297
Energy: 0.38744147380561605
Energy: 0.3545857030005171
Energy: 0.37255070502384885
Energy: 0.37372453686682405
Energy: 0.33835881167637794
Energy: 0.37474885636503164
Energy: 0.33772606470966693
Energy: 0.3640237236575637
Energy: 0.36198541171656967
Energy: 0.337615620272695
Energy: 0.36297254739766505
Energy: 0.35636084142128394

minimum gb energy = 0.29148584164160674 eV
minimum distance =  2.27106989403166 Angstroms
sigma value = 67


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

Energy: 0.4586904515758275
Energy: 0.46049034320144877
Energy: 0.4519419369452195
Energy: 0.44053744986108484
Energy: 0.527906528815816
Energy: 0.45752428550455515
Energy: 0.4539873912798511
Energy: 0.45585196436888376
Energy: 0.45982067224272943
Energy: 0.45239808681251326
Energy: 0.454068795754737
Energy: 0.4586882910479685
Energy: 0.46674228486723707
Energy: 0.44566714808232577
Energy: 0.44734820672566916
Energy: 0.4529511028841692
Energy: 0.43752646635844034
Energy: 0.4517699001528431
Energy: 0.42966156740293765
Energy: 0.45200089169264535
Energy: 0.44657313562255635
Energy: 0.4297374217701335
Energy: 0.44188730989216596
Energy: 0.45378686369902277
Energy: 0.4262807477357803
Energy: 0.45719430306911735
Energy: 0.4538965270333895
Energy: 0.42615708858303025
Energy: 0.45388816421505634
Energy: 0.44756431779300515
Energy: 0.4308922706614273
Energy: 0.44603276816242693
Energy: 0.4356456812892786
Energy: 0.3958562613529962
Energy: 0.44596878811037866
Energy: 0.4350071318013161
Energy: 0.43291401282976416
Energy: 0.42980400375787536
Energy: 0.4336244087848695
Energy: 0.4330737928552584
Energy: 0.42735883475378633
Energy: 0.4270454450900252
Energy: 0.43180237513023556
Energy: 0.4285504720421728
Energy: 0.4257278191919921
Energy: 0.4323749479783827
Energy: 0.37760827285225934
Energy: 0.42792332626237733
Energy: 0.43521271157058566
Energy: 0.44770699353223964
Energy: 0.44212195659796955
Energy: 0.43677191539929655
Energy: 0.3957255975371441
Energy: 0.44113780057841007
Energy: 0.43733299363959255
Energy: 0.39898170622929574
Energy: 0.4001001007526985
Energy: 0.43782919121058766
Energy: 0.3967871315761953
Energy: 0.39618448601428585
Energy: 0.43511096446516834
Energy: 0.4260074299668369
Energy: 0.4257304384353678
Energy: 0.37747502750873585
Energy: 0.4260388290034768
Energy: 0.4264509051407497
Energy: 0.3803837438263211
Energy: 0.42327278955633313
Energy: 0.42340203071509314
Energy: 0.3812672275452998
Energy: 0.4065015633640457
Energy: 0.3765546306000458
Energy: 0.38207662299268524
Energy: 0.42044355266210465
Energy: 0.41887702197677323
Energy: 0.38277101404916297
Energy: 0.3792158122920456
Energy: 0.3765250799719391
Energy: 0.4299542783161964
Energy: 0.42033870275356106
Energy: 0.41851157172544645
Energy: 0.3778390934102752
Energy: 0.42937502460566696
Energy: 0.41780509145366496
Energy: 0.42537007479594147
Energy: 0.3803082573666635
Energy: 0.3817234911170734
Energy: 0.4258977550992613
Energy: 0.3789285391037858
Energy: 0.3856550304569774
Energy: 0.42623418972542354
Energy: 0.4268975746067196
Energy: 0.4242712232310137
Energy: 0.42430362691345413
Energy: 0.40983406410436624
Energy: 0.4233887407487704
Energy: 0.39870945156809406
Energy: 0.4206471090464565
Energy: 0.41810679701469644
Energy: 0.3992665153895557
Energy: 0.3741276072381956
Energy: 0.3950619911050146
Energy: 0.40020439352555837
Energy: 0.4399329659820437
Energy: 0.4418858903657128
Energy: 0.39950991223997984
Energy: 0.43748101445298426
Energy: 0.42426329879540753
Energy: 0.42470305721599694
Energy: 0.4353965366090741
Energy: 0.43495179853430566
Energy: 0.3829159909533127
Energy: 0.43567798196417695
Energy: 0.42937774764670883
Energy: 0.4319372454189158
Energy: 0.43452156710419704
Energy: 0.43400403457435643
Energy: 0.43245994218549816
Energy: 0.4302212438165463
Energy: 0.4352086478017929
Energy: 0.426972682348023
Energy: 0.443294476808019
Energy: 0.457079145590999
Energy: 0.4278948786824044
Energy: 0.4344534330166022
Energy: 0.4548122383164432
Energy: 0.4659824998759018
Energy: 0.4341276512012348
Energy: 0.45546169365822375
Energy: 0.45154732913385764
Energy: 0.4259813870969425
Energy: 0.4555551912952467
Energy: 0.45440027310251474
Energy: 0.43000080307805805
Energy: 0.4338731621154707
Energy: 0.45470749867066224
Energy: 0.42784625455754965
Energy: 0.431311379839385

minimum gb energy = 0.3741276072381956 eV
minimum distance =  2.26259671963726 Angstroms
sigma value = 33


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

Energy: 0.5278712241930237
Energy: 0.5236564772863135
Energy: 0.5253316154833874
Energy: 0.5107779708341917
Energy: 0.5143439908316998
Energy: 0.5046544113576548
Energy: 0.49137250038350944
Energy: 0.4712728755543511
Energy: 0.46932764610017375
Energy: 0.46923256805984465
Energy: 0.4713417066609283
Energy: 0.469566505585646
Energy: 0.5261925602101563
Energy: 0.48332336661345526
Energy: 0.497358325776441
Energy: 0.5036358432646252
Energy: 0.46792083434021187
Energy: 0.49703351022579784
Energy: 0.46993724445416696
Energy: 0.4977364395234083
Energy: 0.4975472741725616
Energy: 0.4699367355315794
Energy: 0.4973732139064843
Energy: 0.4970782530487733
Energy: 0.46929651741604034
Energy: 0.47093445191165156
Energy: 0.47019290827629934
Energy: 0.46906524263787125
Energy: 0.5062935311761916
Energy: 0.4671417979144905
Energy: 0.4924472452749323
Energy: 0.5009555152283992
Energy: 0.43347324462592973
Energy: 0.43500341175166407
Energy: 0.5007748921612888
Energy: 0.4803162011824663
Energy: 0.46912668007950126
Energy: 0.4688901598249317
Energy: 0.4701922031848933
Energy: 0.4692501827026911
Energy: 0.4685891088376857
Energy: 0.4691414695996129
Energy: 0.4700751081523397
Energy: 0.4385814355804913
Energy: 0.4834904754655897
Energy: 0.470058739656005
Energy: 0.4358325020609105
Energy: 0.46910822198180196
Energy: 0.48040321134301556
Energy: 0.48747280445734664
Energy: 0.4854104895741778
Energy: 0.4386892303168179
Energy: 0.43558010907062245
Energy: 0.4830210603205985
Energy: 0.48050537290853557
Energy: 0.43601658475756
Energy: 0.4336005099164785
Energy: 0.4813278679044757
Energy: 0.43358492938711163
Energy: 0.4331408740352647
Energy: 0.48201194388033025
Energy: 0.4751494064288696
Energy: 0.47316695319360136
Energy: 0.4353959204770329
Energy: 0.45766646940502864
Energy: 0.4722414820264166
Energy: 0.4328088128410807
Energy: 0.43488113602960643
Energy: 0.47447248841205175
Energy: 0.4328337017462704
Energy: 0.4477836757816237
Energy: 0.4330644554058773
Energy: 0.43343703232468167
Energy: 0.483996923120483
Energy: 0.48488728342225373
Energy: 0.4331380462579755
Energy: 0.468890754463781
Energy: 0.4330191680679647
Energy: 0.4850711992163372
Energy: 0.48097267560209395
Energy: 0.48169130603196303
Energy: 0.42513071333551655
Energy: 0.48509384282228857
Energy: 0.4729858198355249
Energy: 0.48870526150031146
Energy: 0.47180520221797595
Energy: 0.4722649846775728
Energy: 0.48924177201960006
Energy: 0.46985060419481145
Energy: 0.47075352902600975
Energy: 0.4648050058296598
Energy: 0.4929108822868865
Energy: 0.49851624666289357
Energy: 0.4654161987711754
Energy: 0.44137952204177916
Energy: 0.4719009662211506
Energy: 0.5236994293445039
Energy: 0.4476332032685446
Energy: 0.4915161562346389
Energy: 0.5044463059069688
Energy: 0.44424479592074956
Energy: 0.48932121083057317
Energy: 0.5266003570691757
Energy: 0.4692688775049544
Energy: 0.4677528780808309
Energy: 0.4674413120190486
Energy: 0.46947879179168955
Energy: 0.5006884857047755
Energy: 0.49553713093471913
Energy: 0.5036384101182036
Energy: 0.5068657173029295
Energy: 0.4446393017413001
Energy: 0.5034741561604481
Energy: 0.48727309102684846
Energy: 0.49126633795331087
Energy: 0.47079046286598425
Energy: 0.47157881933585805
Energy: 0.4915913879771996
Energy: 0.5062041778393441
Energy: 0.4658072375897102
Energy: 0.5256833600730334
Energy: 0.4905480762083926
Energy: 0.506240709251669
Energy: 0.5095879901385713
Energy: 0.4962689985306249
Energy: 0.4360115946555454
Energy: 0.5046359118625294
Energy: 0.4833623698736027
Energy: 0.49759509560876386
Energy: 0.5050387636607445
Energy: 0.4846869804976566
Energy: 0.4961164844718738
Energy: 0.46935734471529017
Energy: 0.4711435617286278
Energy: 0.46429248224793723
Energy: 0.46931215064181125
Energy: 0.47107546133914396
Energy: 0.46946078500504934
Energy: 0.49326089465479583
Energy: 0.5002056144854748
Energy: 0.4344812299647155
Energy: 0.43323376057815527
Energy: 0.49953745759698454
Energy: 0.47748354089460854
Energy: 0.4687821200023204
Energy: 0.46928879047925137
Energy: 0.47032773028217834
Energy: 0.4690836929345396
Energy: 0.4689805835381135
Energy: 0.4986924511403046
Energy: 0.4724626259774068
Energy: 0.4381684473905635
Energy: 0.4835298775681987
Energy: 0.4730257828900812
Energy: 0.4354572949042531
Energy: 0.469336556190105
Energy: 0.4800249540400317
Energy: 0.46592459600411995
Energy: 0.4861417755737271
Energy: 0.4818816896091938
Energy: 0.46809705270728735
Energy: 0.4836638190643512
Energy: 0.48041473089147035
Energy: 0.43642823120720614
Energy: 0.43351924517631857
Energy: 0.4810948508672286
Energy: 0.4340651984563577
Energy: 0.43316407051599354
Energy: 0.4819914854821097
Energy: 0.45915922817589144
Energy: 0.4744318077503552
Energy: 0.43598313405681943
Energy: 0.45661028438015655
Energy: 0.47351400348270933
Energy: 0.43261009045749427
Energy: 0.4355736389446559
Energy: 0.4747304608682914
Energy: 0.4326378825997645
Energy: 0.4423310046112876
Energy: 0.4330358483598631
Energy: 0.4357749387440548
Energy: 0.4828946194101329
Energy: 0.4617864236756174
Energy: 0.4364745071179765
Energy: 0.43874197080800864
Energy: 0.43322438861362444
Energy: 0.48573519387431163
Energy: 0.4859071712913899
Energy: 0.48599027029827685
Energy: 0.4255397747950528
Energy: 0.4830258415056353
Energy: 0.4715696624071229
Energy: 0.4880483634119337
Energy: 0.4723673290022595
Energy: 0.4727165953432945
Energy: 0.4874142431392064
Energy: 0.4703729784251984
Energy: 0.4700835218875757
Energy: 0.4640950205382264
Energy: 0.49530933270558447
Energy: 0.47336201492780705
Energy: 0.46452204956954296
Energy: 0.4415416202757391
Energy: 0.4722426922942693
Energy: 0.5518865330554302
Energy: 0.44106487118921606
Energy: 0.4915279976433373
Energy: 0.5049834233488822
Energy: 0.42621572790345574
Energy: 0.48885530207558675
Energy: 0.5274043383605663
Energy: 0.47018743961219517
Energy: 0.4662213905515073
Energy: 0.47104055104472325
Energy: 0.4714644511936701
Energy: 0.46743642148591763
Energy: 0.4956724180988674
Energy: 0.5038175640485808
Energy: 0.5067613020033128
Energy: 0.442928393090061
Energy: 0.5037009676235948
Energy: 0.48828782030133056

minimum gb energy = 0.42513071333551655 eV
minimum distance =  2.2826981773202 Angstroms
sigma value = 41


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

Energy: 0.6005536493580192
Energy: 0.5797720678021736
Energy: 0.5795422345405469
Energy: 0.5128170610694356
Energy: 0.5345714205062051
Energy: 0.5794916228130519
Energy: 0.5491978472898288
Energy: 0.5377520001824514
Energy: 0.5383671613681825
Energy: 0.5356793888727722
Energy: 0.5371681597368008
Energy: 0.5213230376804644
Energy: 0.606934432497576
Energy: 0.5104860802900307
Energy: 0.5099552640415537
Energy: 0.537545449339807
Energy: 0.52843203828991
Energy: 0.520644005508331
Energy: 0.5376638835498149
Energy: 0.5107792259628824
Energy: 0.5099373396942171
Energy: 0.537827539514531
Energy: 0.5118125594247087
Energy: 0.5323601340912496
Energy: 0.5277625332932218
Energy: 0.5378665014718185
Energy: 0.5228942065383533
Energy: 0.5279747474834159
Energy: 0.5375642856563286
Energy: 0.51153541341115
Energy: 0.5361099905925721
Energy: 0.5390639154902683
Energy: 0.5223678421204982
Energy: 0.5288970428560036
Energy: 0.5385226788101336
Energy: 0.5103992140201671
Energy: 0.5278191977678425
Energy: 0.52821390943239
Energy: 0.5355809754199101
Energy: 0.5280840811776235
Energy: 0.5311513219398866
Energy: 0.5150603675126431
Energy: 0.5296500045335868
Energy: 0.5294614571971579
Energy: 0.5112994839189902
Energy: 0.5302695210484385
Energy: 0.5296352823567732
Energy: 0.5140568469264392
Energy: 0.554719700709822
Energy: 0.5120087305890703
Energy: 0.5111257381801403
Energy: 0.5571997118414914
Energy: 0.5411384141692965
Energy: 0.5110961780524096
Energy: 0.540789141939751
Energy: 0.5296129707498465
Energy: 0.5346439796924284
Energy: 0.5306973418293623
Energy: 0.5272711195948716
Energy: 0.5112401046959287
Energy: 0.5409803161447055
Energy: 0.5351594799360154
Energy: 0.5133924288034698
Energy: 0.5227491321843281
Energy: 0.5025550260260248
Energy: 0.5141641670264782
Energy: 0.6132691900663322
Energy: 0.5094721832679814
Energy: 0.5025207534754459
Energy: 0.6221146253932546
Energy: 0.5068610248340151
Energy: 0.5035329803838615
Energy: 0.6074381074982325
Energy: 0.5301774509551292
Energy: 0.5363085731650229
Energy: 0.5362529588266083
Energy: 0.5295182118275328
Energy: 0.5217636392324776
Energy: 0.5032539300316404
Energy: 0.5371007875779421
Energy: 0.5033679889925015
Energy: 0.5041711770140633
Energy: 0.5369710954832814
Energy: 0.5099437262988874

minimum gb energy = 0.5025207534754459 eV
minimum distance =  2.27099006745679 Angstroms
sigma value = 11


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

Energy: 0.9045618039269929
Energy: 0.7595266645788826
Energy: 0.6091883272958808
Energy: 0.6098259237353334
Energy: 0.6099959990142007
Energy: 0.5936786660203891
Energy: 0.6638538517140571
Energy: 0.5942625157301468
Energy: 0.6008781596986305
Energy: 0.6160124133697301
Energy: 0.5938865809952635
Energy: 0.5919087087704897
Energy: 0.695957470521413
Energy: 0.5965009360460128
Energy: 0.6003581642181781
Energy: 0.5997796360810451
Energy: 0.6004090893738094
Energy: 0.6041415753282855
Energy: 0.6232848841877168
Energy: 0.6058107834564534
Energy: 0.6071076306968346
Energy: 0.5936924828426028
Energy: 0.5927792057829464
Energy: 0.60565593353115
Energy: 0.6093457205326228
Energy: 0.5979290603062747
Energy: 0.5944158829373992
Energy: 0.5998142610965539
Energy: 0.5966626180423005
Energy: 0.6099761879583001
Energy: 0.6237826924536088
Energy: 0.5944928852094591
Energy: 0.6011245009748459
Energy: 0.6015000875359666
Energy: 0.6098708598542457
Energy: 0.5997834306879353
Energy: 0.610815705188909
Energy: 0.6017930270053182
Energy: 0.6018057461709404
Energy: 0.6114319339738458
Energy: 0.6046272256749491
Energy: 0.6018549212560558
Energy: 0.6048744265756844
Energy: 0.6020509775042993
Energy: 0.6094322999676188
Energy: 0.5965296826549641
Energy: 0.6209799233233808
Energy: 0.6018774337814246
Energy: 0.5970131583944522
Energy: 0.6037073611254758
Energy: 0.6071771609864942
Energy: 0.5889596588823226
Energy: 0.5980795335360892
Energy: 0.6043602190856682
Energy: 0.5945234216538956
Energy: 0.6034901368043436
Energy: 0.6069602168661732
Energy: 0.5961803655616199
Energy: 0.5991392734103078
Energy: 0.6056416113616109
Energy: 0.6061792951233177
Energy: 0.608702618342704
Energy: 0.6134971263600693
Energy: 0.59567510089788
Energy: 0.5954935375593956
Energy: 0.6014627771279852
Energy: 0.5945340181220355
Energy: 0.6020912035547046
Energy: 0.5994154614742953
Energy: 0.5946228940132117
Energy: 0.5951176109178051
Energy: 0.6007794730464787
Energy: 0.5936857954845006
Energy: 0.5995987105542173
Energy: 0.6049607016651527
Energy: 0.59385059724558
Energy: 0.5988783686527439
Energy: 0.6211765600043928
Energy: 0.6015007557620179
Energy: 0.6039643256782349
Energy: 0.6015860157658337
Energy: 0.6014626284441377
Energy: 0.6986893844380203
Energy: 0.5961969687506231
Energy: 0.5902836830703247
Energy: 0.5951534938761487
Energy: 0.6047445478072011
Energy: 0.5962317011683992
Energy: 0.5945556355538751
Energy: 0.6052324604471947
Energy: 0.5912478071464954
Energy: 0.6052766892984053
Energy: 0.6058560585115292
Energy: 0.5922388789236318
Energy: 0.5958067207573227
Energy: 0.6024383904225717
Energy: 0.5900544862219175
Energy: 0.5935351978574885
Energy: 0.6069379258607082
Energy: 0.5905850101924383
Energy: 0.5937974996076572
Energy: 0.6071952067981015
Energy: 0.6118512395394069
Energy: 0.6263959185158012
Energy: 0.6188405473850268
Energy: 0.5934796124663099
Energy: 0.640021201067424
Energy: 0.595847116785124
Energy: 0.5987231421682302
Energy: 0.592463646182194
Energy: 0.5952911942490556
Energy: 0.5990284142577835
Energy: 0.5939436442218038
Energy: 0.6056591495565575
Energy: 0.604818815841821
Energy: 0.594665294326969
Energy: 0.6011118686163609
Energy: 0.5954673068842078
Energy: 0.6030099486248041
Energy: 0.602517631135057
Energy: 0.6423840406279404
Energy: 0.6078432908013923
Energy: 0.6025985721753282
Energy: 0.5938651530658978
Energy: 0.5949172677051776
Energy: 0.6022574923326488
Energy: 0.6164643417852511
Energy: 0.5983427130765936
Energy: 0.6017047207936237
Energy: 0.6028598440292792
Energy: 0.5945312027521249
Energy: 0.6048776385133734
Energy: 0.6019967110398831
Energy: 0.6006148976204253
Energy: 0.6028099084861255
Energy: 0.5926368542894351
Energy: 0.5957638947220314
Energy: 0.6017084587691456
Energy: 0.6408579395192513
Energy: 0.5993599450160543
Energy: 0.6011485161618967
Energy: 0.5923674632154511
Energy: 0.59615294027699
Energy: 0.6068018235568776
Energy: 0.6390898581469959
Energy: 0.6011373521500986
Energy: 0.60885276441602
Energy: 0.6397546826037193
Energy: 0.6108362238539846
Energy: 0.6062242606508103
Energy: 0.6336014725438557
Energy: 0.60101335084489
Energy: 0.6070273306092143
Energy: 0.5946508915266353
Energy: 0.5951150609059656
Energy: 0.6057029801960501
Energy: 0.6321105242977988
Energy: 0.5936728992098822
Energy: 0.59040556021527
Energy: 0.5942492095116801
Energy: 0.5911458491426084
Energy: 0.6063937470045359
Energy: 0.6227282266027709
Energy: 0.6067393500712277
Energy: 0.6060187816411474
Energy: 0.5939295327443759
Energy: 0.597381738840766
Energy: 0.6049402416774591
Energy: 0.6314118881633004
Energy: 0.5979795613293349
Energy: 0.5954674602705936
Energy: 0.6015017421861345
Energy: 0.6073093337553762
Energy: 0.5991739955683034
Energy: 0.6950464732384596
Energy: 0.5934548474175503
Energy: 0.6203914950544978
Energy: 0.5991301402001623
Energy: 0.5934251180325804
Energy: 0.606172073947137
Energy: 0.6104978752657996
Energy: 0.5954410163875841
Energy: 0.6011030154064511
Energy: 0.5931290168848304
Energy: 0.5950776611673584
Energy: 0.6020126763772766

minimum gb energy = 0.5889596588823226 eV
minimum distance =  2.26073543795093 Angstroms
sigma value = 57


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

Energy: 0.8242969039726561
Energy: 0.6647383607213478
Energy: 0.6664886472713147
Energy: 0.6658375467264317
Energy: 0.8810654436032415
Energy: 0.6652310307726625
Energy: 0.5949870310247899
Energy: 0.6133338951442213
Energy: 0.6080422601731279
Energy: 0.6145280311758153
Energy: 0.612625919488155
Energy: 0.6072025199374179
Energy: 0.6355670862187667
Energy: 0.6195024355300145
Energy: 0.618373307711196
Energy: 0.6364887532362068
Energy: 0.6197216444687487
Energy: 0.612936554269509
Energy: 0.6084143285944912
Energy: 0.6113050814680632
Energy: 0.606089081974906
Energy: 0.608950559719937
Energy: 0.6081507604344644
Energy: 0.6064682687001828
Energy: 0.6128082756288894
Energy: 0.6105451260302871
Energy: 0.6125048354069064
Energy: 0.6094542572873051
Energy: 0.6092185670655895
Energy: 0.6066011407599394
Energy: 0.6106447382941644
Energy: 0.6142284206128916
Energy: 0.6126301041210598
Energy: 0.6129204189969358
Energy: 0.6360482894995328
Energy: 0.6127047565012724
Energy: 0.6342577789405937
Energy: 0.6174684514952709
Energy: 0.6208176699991482
Energy: 0.634807132318129
Energy: 0.615041799394157
Energy: 0.6461285519463871
Energy: 0.6632512627164001
Energy: 0.6110076197820103
Energy: 0.6125394556342553
Energy: 0.6112266768459145
Energy: 0.6165357727369615
Energy: 0.6055654442094233
Energy: 0.5949844111683263
Energy: 0.6100062649736845
Energy: 0.6179362345988236
Energy: 0.598563548025098
Energy: 0.6089180903938175
Energy: 0.619195748676183
Energy: 0.5958924123564376
Energy: 0.6103008679085126
Energy: 0.6180669598049475
Energy: 0.5980966000705544
Energy: 0.6088364734107504
Energy: 0.6197762735139646
Energy: 0.6349523211872319
Energy: 0.6114772064187797
Energy: 0.6140416906698745
Energy: 0.6111482336745242
Energy: 0.6160193923635806
Energy: 0.6063278817621258
Energy: 0.628150759493526
Energy: 0.620669709766955
Energy: 0.6190072801800139
Energy: 0.6286407222326811
Energy: 0.6211671989459072
Energy: 0.610464697625269
Energy: 0.6146331955668923
Energy: 0.6124305532823047
Energy: 0.6245396533888367
Energy: 0.6151514005326926
Energy: 0.6145563549799492
Energy: 0.6058976414180303
Energy: 0.6092514439867511
Energy: 0.6379204660355445
Energy: 0.6105215055090312
Energy: 0.6129221562399056
Energy: 0.6394649496042417
Energy: 0.6109744910875133
Energy: 0.6136941843381454
Energy: 0.6166600995021114
Energy: 0.6079413077366503
Energy: 0.6176664940651416
Energy: 0.6163101787569529
Energy: 0.6060472870069591
Energy: 0.6433067654468527
Energy: 0.6169197555471649
Energy: 0.6175367852226368
Energy: 0.6473693735456916
Energy: 0.6165286966164263
Energy: 0.6129414195160999
Energy: 0.594946017597121
Energy: 0.613498353809287
Energy: 0.6147414303468349
Energy: 0.5955994829001258
Energy: 0.6125722859065506
Energy: 0.6122669718222452

minimum gb energy = 0.594946017597121 eV
minimum distance =  2.27753708255097 Angstroms
sigma value = 9


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

Energy: 1.010215978630174
Energy: 0.670944238581972
Energy: 0.6423549908349897
Energy: 0.6413627091747205
Energy: 0.9490382207469718
Energy: 0.6407479207030453
Energy: 0.7136834425850641
Energy: 0.6382843199358518
Energy: 0.6403807332971648
Energy: 0.6363279299202497
Energy: 0.6517218562611328
Energy: 0.6394744634399392
Energy: 0.6444394067574394
Energy: 0.6415651645238316
Energy: 0.6397927889122625
Energy: 0.6305777033919175
Energy: 0.6467745307468444
Energy: 0.6382210490660942
Energy: 0.6342206307028969
Energy: 0.6484233645388098
Energy: 0.6448305904209145
Energy: 0.6347743710806157
Energy: 0.6355634508578067
Energy: 0.6438427307161612
Energy: 0.6621746542442736
Energy: 0.6210505242575315
Energy: 0.623042858132889
Energy: 0.619503325606351
Energy: 0.6185383293561879
Energy: 0.6195652116243267
Energy: 0.6392776832308491
Energy: 0.6366851195709418
Energy: 0.6362540945341393
Energy: 0.6421135210567771
Energy: 0.6387371638495483
Energy: 0.6360442980094596
Energy: 0.6298923250945498
Energy: 0.6357235025877863
Energy: 0.6445505612633321
Energy: 0.616907639324859
Energy: 0.6378526766868381
Energy: 0.6403007961940395
Energy: 0.6558655846100996
Energy: 0.6399403835287896
Energy: 0.6379993760786993
Energy: 0.6336114983860298
Energy: 0.6413629415367655
Energy: 0.640078714128327
Energy: 0.6697087144797513
Energy: 0.6204143946500859
Energy: 0.6233227584857778
Energy: 0.6506193956589181
Energy: 0.6187422353130752
Energy: 0.6391995500047889
Energy: 0.6714472913433058
Energy: 0.6199044083095985
Energy: 0.6237300425518019
Energy: 0.6500905506804967
Energy: 0.6311057435879404
Energy: 0.6192171548550666
Energy: 0.6613252952230303
Energy: 0.6278809859541008
Energy: 0.6276328420444955
Energy: 0.6334425950863138
Energy: 0.6466670332581947
Energy: 0.6307910193704586
Energy: 0.6590172481970074
Energy: 0.6418057828012231
Energy: 0.6408958444637392
Energy: 0.6504581950938756
Energy: 0.6358081254122099
Energy: 0.6392836240429951
Energy: 0.6697151205732356
Energy: 0.6367241183119351
Energy: 0.6376595712831044
Energy: 0.6448510480691056
Energy: 0.6354587628235917
Energy: 0.6348869940629689
Energy: 0.6701123586487452
Energy: 0.6397624770068661
Energy: 0.6426215207865186
Energy: 0.641999723573839
Energy: 0.6366154556714418
Energy: 0.643600952320126
Energy: 0.6549753660016626
Energy: 0.6266919504077981
Energy: 0.6286341373154114
Energy: 0.644872537586625
Energy: 0.6439999768259365
Energy: 0.6220596214717186
Energy: 0.6445289104812206
Energy: 0.6437129086195713
Energy: 0.6169823353321532
Energy: 0.6444503754076519
Energy: 0.649562669944189
Energy: 0.6234854729345364
Energy: 0.6506313217631283
Energy: 0.6448844555223633
Energy: 0.6443484696860168
Energy: 0.6503189037243736
Energy: 0.6347988633919301
Energy: 0.6426795560488578
Energy: 0.7160216299226811
Energy: 0.63734380020747
Energy: 0.622802825630656
Energy: 0.6217406150622318
Energy: 0.6358469339281388
Energy: 0.6210539927635687
Energy: 0.6544927658736538
Energy: 0.6447350557776055
Energy: 0.6410181528432545
Energy: 0.6550548639574778
Energy: 0.6499361521278615
Energy: 0.6385416312756138
Energy: 0.6449120472612987
Energy: 0.6450727987845869
Energy: 0.641656591359487
Energy: 0.618228734684734
Energy: 0.6514867171398724
Energy: 0.6386939998437474
Energy: 0.6483963093183028
Energy: 0.6372221593525476
Energy: 0.6387924086805933
Energy: 0.636604487566038
Energy: 0.6475131628258775
Energy: 0.6408436530487779

minimum gb energy = 0.616907639324859 eV
minimum distance =  2.23894775728652 Angstroms
sigma value = 27


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

Energy: 0.9715692315961824
Energy: 0.6258657024710909
Energy: 0.613071860399821
Energy: 0.6145878337610775
Energy: 0.6444460348358589
Energy: 0.612714312567113
Energy: 0.6412790905675918
Energy: 0.6254565773939833
Energy: 0.6216738312170412
Energy: 0.6321365002598963
Energy: 0.6407343933357786
Energy: 0.6215170025616442
Energy: 0.6288161505813515
Energy: 0.6276794813899064
Energy: 0.6285667015867645
Energy: 0.6229816503736263
Energy: 0.6328561140518488
Energy: 0.6545691527827087
Energy: 0.6304714114781872
Energy: 0.6189157407994303
Energy: 0.6257586741847122
Energy: 0.6264144978765608
Energy: 0.618961935698307
Energy: 0.6275354055299389
Energy: 0.6358002764598705
Energy: 0.6210912386415046
Energy: 0.6185459040927005
Energy: 0.6304653809624791
Energy: 0.6184961979616888
Energy: 0.6210197383286566
Energy: 0.6397353551229698
Energy: 0.6260646680274942
Energy: 0.6252770657439315
Energy: 0.6339302905872366
Energy: 0.6266515691398886
Energy: 0.6254356085454998
Energy: 0.6301825375892555
Energy: 0.6423788625665859
Energy: 0.6400370750342823
Energy: 0.6191481877908191
Energy: 0.6152487617805622
Energy: 0.6231779568822203
Energy: 0.6519030426507789
Energy: 0.6337955543286787
Energy: 0.6327814259829981
Energy: 0.6305445119071773
Energy: 0.6433889573684567
Energy: 0.6315141844506603
Energy: 0.6342103656529063
Energy: 0.6184370945789764
Energy: 0.6187581509268788
Energy: 0.631904490702231
Energy: 0.6192315840287806
Energy: 0.6153200230161201
Energy: 0.6422942820684745
Energy: 0.6365932084381216
Energy: 0.6361702460428394
Energy: 0.6327500772440732
Energy: 0.6361579936338609
Energy: 0.6331159645133406
Energy: 0.6491716352129017
Energy: 0.6322335141690862
Energy: 0.6306389338640213
Energy: 0.6366276743329878
Energy: 0.6173482109089938
Energy: 0.6333422983617009
Energy: 0.6485141310820536
Energy: 0.6346982698452781
Energy: 0.6332313424757047
Energy: 0.6406516706324784
Energy: 0.640673665772606
Energy: 0.6325126352146386
Energy: 0.6862511853125844
Energy: 0.6351654778236798
Energy: 0.634988764405549
Energy: 0.6391030793783994
Energy: 0.6353319771813718
Energy: 0.6296765292829124
Energy: 0.6857459601101384
Energy: 0.6320757349416651
Energy: 0.631525241078957
Energy: 0.6427105036656486
Energy: 0.6317857631669689
Energy: 0.6322391455849865
Energy: 0.6481355410178464
Energy: 0.6333931793971932
Energy: 0.6316050681843158
Energy: 0.6381531874378987
Energy: 0.6376495185358936
Energy: 0.6320915852352679
Energy: 0.6363466512987284
Energy: 0.6255249769271665
Energy: 0.6285450314530245
Energy: 0.6263438874977519
Energy: 0.6361126427737136
Energy: 0.626224946858173
Energy: 0.6384050516605443
Energy: 0.6411468834260482
Energy: 0.6268547411562964
Energy: 0.6407595945645731
Energy: 0.6407962650462616
Energy: 0.6320501132605628
Energy: 0.644238522469788
Energy: 0.6305667884483167
Energy: 0.6268716196637336
Energy: 0.6364704467042247
Energy: 0.6309595373009288
Energy: 0.6269162615180983
Energy: 0.6338500764141262
Energy: 0.6256716755749483
Energy: 0.6234087136343717
Energy: 0.6332253101280632
Energy: 0.6219855356555329
Energy: 0.6241117101498183
Energy: 0.6315636809632101
Energy: 0.6259568352924281
Energy: 0.623298253967111
Energy: 0.618322517592432
Energy: 0.6219033349534222
Energy: 0.6187971852985937
Energy: 0.7124286581954427
Energy: 0.6185614615702304
Energy: 0.6167990103985846
Energy: 0.6340637975960216
Energy: 0.6304330129425455
Energy: 0.6255093868350392
Energy: 0.6339639482730551
Energy: 0.6185045172393385
Energy: 0.6182205463822307
Energy: 0.6336330400731053
Energy: 0.6343277384669205
Energy: 0.6208515152973137
Energy: 0.6441870485684078
Energy: 0.6282097568685535
Energy: 0.6255422585530697
Energy: 0.63269209895522
Energy: 0.6276651208180826
Energy: 0.6259107899211551
Energy: 0.6270532603483776
Energy: 0.6279570784421455
Energy: 0.6270064460635476
Energy: 0.6233282078794528
Energy: 0.6296616646007366
Energy: 0.6263603524874116
Energy: 0.6918403920711553
Energy: 0.6312548550810732
Energy: 0.6327301137273202
Energy: 0.6291081706481599
Energy: 0.6477342550113041
Energy: 0.6203685093520552

minimum gb energy = 0.612714312567113 eV
minimum distance =  2.24293683005509 Angstroms
sigma value = 19


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

Energy: 0.6437989131459796
Energy: 0.6508773227783939
Energy: 0.6213511849882906
Energy: 0.6119048758116431
Energy: 0.636205138480283
Energy: 0.6204778439401313
Energy: 0.6292575418342518
Energy: 0.6058825724376246
Energy: 0.6027258183291772
Energy: 0.6059641969482141
Energy: 0.6104198123182182
Energy: 0.6035553511331914
Energy: 0.6288755829334449
Energy: 0.6080044065538244
Energy: 0.6057356366664944
Energy: 0.6112361208612581
Energy: 0.6103224659246317
Energy: 0.6063792232298088
Energy: 0.6269535533867535
Energy: 0.6056866633847079
Energy: 0.6047040923282578
Energy: 0.6051322635768577
Energy: 0.6208513500721813
Energy: 0.6044854979456801
Energy: 0.6212221994429922
Energy: 0.6072735139625826
Energy: 0.605716239200932
Energy: 0.6086664047471204
Energy: 0.6113683997359901
Energy: 0.6076725854374008
Energy: 0.6311129014856992
Energy: 0.6280292341179196
Energy: 0.6061546721573743
Energy: 0.6205610532365142
Energy: 0.607280276271345
Energy: 0.60586175556772
Energy: 0.6308303401254562
Energy: 0.6083737611955654
Energy: 0.6061296600924663
Energy: 0.6038583928936254
Energy: 0.61031303700522
Energy: 0.6040051039146943
Energy: 0.6262506130996075
Energy: 0.6103766627225443
Energy: 0.6035023326486004
Energy: 0.6061906950810328
Energy: 0.6123903374764492
Energy: 0.6023428110694615
Energy: 0.6161900439885073
Energy: 0.6031068118756251
Energy: 0.6092383725794321
Energy: 0.6033067862452667
Energy: 0.5996032867183714
Energy: 0.6089364158622836
Energy: 0.6260240596372547
Energy: 0.6115273641503048
Energy: 0.6105306047313046
Energy: 0.60680758078647
Energy: 0.6116341243308187
Energy: 0.6105556415643755
Energy: 0.628544702815892
Energy: 0.5991030123332783
Energy: 0.5998495880054328
Energy: 0.614658969763677
Energy: 0.6018019662686288
Energy: 0.5988838027239202
Energy: 0.6299782746354847
Energy: 0.5991695522365158
Energy: 0.5984835983197456
Energy: 0.5924231989431787
Energy: 0.601343533981513
Energy: 0.598347921698451
Energy: 0.6327013428262563
Energy: 0.6034850062948617
Energy: 0.604469810352944
Energy: 0.6180552240024633
Energy: 0.6051222696103161
Energy: 0.6049457329029079
Energy: 0.6514631390271616
Energy: 0.6173360512151934
Energy: 0.6102309769053258
Energy: 0.6030195333838737
Energy: 0.6178530210246415
Energy: 0.607912318245902
Energy: 0.6294384548652334
Energy: 0.59987904265607
Energy: 0.6000679853510028
Energy: 0.5907813290999653
Energy: 0.6019328359949215
Energy: 0.6007012542134729
Energy: 0.6301594481048298
Energy: 0.5985378754840135
Energy: 0.5976451031634861
Energy: 0.5948453625726003
Energy: 0.6018977811150755
Energy: 0.5970325306662874
Energy: 0.6204557376759046
Energy: 0.6045305783613741
Energy: 0.6092936590203305
Energy: 0.6029862593963885
Energy: 0.6120319263886429
Energy: 0.6106850891651053
Energy: 0.6433277782175904
Energy: 0.5964705592883365
Energy: 0.5967336179303343
Energy: 0.6018050953788554
Energy: 0.5975934773888854
Energy: 0.5970825397582987
Energy: 0.6362662358117508
Energy: 0.6008806476890122
Energy: 0.5995762235493447
Energy: 0.6137310625147953
Energy: 0.6008604006933052
Energy: 0.610741448655196
Energy: 0.6191469437590803
Energy: 0.6002181137119792
Energy: 0.5999158268270998
Energy: 0.601857543789478
Energy: 0.6008872661003929
Energy: 0.6139192616009398
Energy: 0.6028200445071936
Energy: 0.6052260262273965
Energy: 0.5970986327165735
Energy: 0.6043490829229511
Energy: 0.6070209600202588
Energy: 0.5982673312601624
Energy: 0.6011586822972936
Energy: 0.5946706913964739
Energy: 0.5951925843542579
Energy: 0.6022415946307853
Energy: 0.59254994830036
Energy: 0.5986278121561348
Energy: 0.6207102519874551
Energy: 0.6217653530864123
Energy: 0.6083962967549821
Energy: 0.6155935482831054
Energy: 0.597841934120232
Energy: 0.5994982821681596
Energy: 0.6349715304322392
Energy: 0.600285099713288
Energy: 0.5998380232669951
Energy: 0.6164804392193372
Energy: 0.6028957052944461
Energy: 0.6010447944664076
Energy: 0.6341500945453484
Energy: 0.5903682282844472
Energy: 0.5977687685802603
Energy: 0.6134952235382909
Energy: 0.5927829451770179
Energy: 0.5995067105440121
Energy: 0.6234830733405039
Energy: 0.6069281706995939
Energy: 0.6015989908858128
Energy: 0.6088914775912877
Energy: 0.605105086151644
Energy: 0.6034121944294522
Energy: 0.6294309918539739
Energy: 0.6095840733262957
Energy: 0.6084555450599609
Energy: 0.6144690669230999
Energy: 0.603203157520439
Energy: 0.6084737277031349
Energy: 0.6287888613558636
Energy: 0.606176168947892
Energy: 0.6057123140981906
Energy: 0.6011129141526175
Energy: 0.6094506662658349
Energy: 0.6055538964007668
Energy: 0.6430686735611151
Energy: 0.6358942335643067
Energy: 0.6362962847044077
Energy: 0.601641396782337
Energy: 0.6359161135553745
Energy: 0.6125964327958242

minimum gb energy = 0.5903682282844472 eV
minimum distance =  2.24819875026234 Angstroms
sigma value = 101


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

Energy: 0.9083598339788899
Energy: 0.6016890879213675
Energy: 0.5909121972540794
Energy: 0.5655241974966421
Energy: 0.578741296411371
Energy: 0.5653283480832042
Energy: 0.6429055240669567
Energy: 0.5889038668481197
Energy: 0.5879377765892838
Energy: 0.5817841954796555
Energy: 0.5826884122641269
Energy: 0.5871028216615648
Energy: 0.625473696791369
Energy: 0.5807489557984761
Energy: 0.5850257224029329
Energy: 0.5787514839645197
Energy: 0.5808396963930977
Energy: 0.5800997370564734
Energy: 0.6148767359406824
Energy: 0.5846113297339455
Energy: 0.5895408341136333
Energy: 0.5797855077518428
Energy: 0.5817058277216972
Energy: 0.5898702198372019
Energy: 0.5891281874475746
Energy: 0.579175850922868
Energy: 0.5800537380956517
Energy: 0.5891610999872022
Energy: 0.5802065361783101
Energy: 0.5886702100083891
Energy: 0.5937380899908651
Energy: 0.5862425665203456
Energy: 0.5863379480806685
Energy: 0.5806847966486008
Energy: 0.5857644569879529
Energy: 0.5866131351008166
Energy: 0.6112731992874036
Energy: 0.5792474851949618
Energy: 0.5842318260854792
Energy: 0.5992907473048376
Energy: 0.5792091403301937
Energy: 0.5787889482012197
Energy: 0.5809019983367668
Energy: 0.5821659999956086
Energy: 0.5848152562519013
Energy: 0.5945188214539318
Energy: 0.5800195077152542
Energy: 0.5865797441125628
Energy: 0.5801059887607136
Energy: 0.5786395442709705
Energy: 0.5832016720621037
Energy: 0.5795234267465422
Energy: 0.5771615832771244
Energy: 0.5810028117928033
Energy: 0.5892618937825037
Energy: 0.5951117468433129
Energy: 0.5932989567641027
Energy: 0.5812758226113106
Energy: 0.5965872384367136
Energy: 0.5825734538403601
Energy: 0.6186088339142114
Energy: 0.5826784007465049
Energy: 0.5802231651631456
Energy: 0.5804905437780189
Energy: 0.5730726464591085
Energy: 0.5629692834644356
Energy: 0.6239618127512655
Energy: 0.5807562044528892
Energy: 0.5892678194671794
Energy: 0.5830642793914943
Energy: 0.582095067655357
Energy: 0.5897217247811729
Energy: 0.5936688885626566
Energy: 0.5801275463935215
Energy: 0.5797728158007659
Energy: 0.5775240329348422
Energy: 0.5827095395762536
Energy: 0.5874321761813284
Energy: 0.6019326856416682
Energy: 0.5910864806171006
Energy: 0.5887062780385983
Energy: 0.5793241355050317
Energy: 0.5822572350155583
Energy: 0.5873533038955905
Energy: 0.6218821695288809
Energy: 0.5807460694742658
Energy: 0.5817155080009029
Energy: 0.5832300428656668
Energy: 0.5786114255937799
Energy: 0.5830937029902223
Energy: 0.6223252492627671
Energy: 0.5853636751205848
Energy: 0.5896271087904453
Energy: 0.5825992472733559
Energy: 0.5812308578760103
Energy: 0.5886716594673986
Energy: 0.5941280082960015
Energy: 0.6299782114694824
Energy: 0.5905789142331151
Energy: 0.5660608772840251
Energy: 0.6198781385705341
Energy: 0.5800108523043234
Energy: 0.6443786746304351
Energy: 0.5791825849911213
Energy: 0.5791634398257175
Energy: 0.5898099729478669
Energy: 0.5792807426030445
Energy: 0.5893734841557393
Energy: 0.622352724838607
Energy: 0.5828417947660827
Energy: 0.5838980597859027
Energy: 0.5775101760100121
Energy: 0.5823398014252914
Energy: 0.5858155826073272
Energy: 0.613592104988541
Energy: 0.5843218442317898
Energy: 0.5847646744425157
Energy: 0.5793329700472053
Energy: 0.5837798472941441
Energy: 0.5858596841838031
Energy: 0.5906448771587036
Energy: 0.5791470391656026
Energy: 0.5793803355796968
Energy: 0.5903727614015414
Energy: 0.5793863544087374
Energy: 0.5877239019533707
Energy: 0.6026845250994047
Energy: 0.5893317758238875
Energy: 0.5880512146355583
Energy: 0.5907284083660929
Energy: 0.579776680006397
Energy: 0.5834828029837942
Energy: 0.6011957071329336
Energy: 0.5847992983834492
Energy: 0.5860466475703077
Energy: 0.5937834093091681
Energy: 0.5804307861809102
Energy: 0.5899062044068869
Energy: 0.6103111880325974
Energy: 0.5827221604778042
Energy: 0.5832464780712951
Energy: 0.5925927399890027
Energy: 0.5821217456587966
Energy: 0.589527308510032
Energy: 0.5868034331531905
Energy: 0.5889485359374855
Energy: 0.5867949384908296
Energy: 0.5812823904310488
Energy: 0.5784398421666047
Energy: 0.5852593125675658
Energy: 0.5807848314834924
Energy: 0.5905540283891271
Energy: 0.5880940553412008
Energy: 0.5789959805950946
Energy: 0.5918992307454319
Energy: 0.5869187521668658
Energy: 0.5955170956934618
Energy: 0.5736091736310311
Energy: 0.5738729397186022
Energy: 0.5719525930999463
Energy: 0.5723723834003831
Energy: 0.5807372790975628
Energy: 0.6223757663711551
Energy: 0.5725804540184464
Energy: 0.5807739088054642
Energy: 0.5829330732255127
Energy: 0.5706770291203069
Energy: 0.5866473805576953
Energy: 0.5967025111524225
Energy: 0.5799373907644024
Energy: 0.5891207506500128
Energy: 0.5772358928703459
Energy: 0.5830575622719255
Energy: 0.5845795605369019
Energy: 0.5953477465288256
Energy: 0.5758781204900048
Energy: 0.5905853188653696
Energy: 0.5779789138586571
Energy: 0.5725537883652152
Energy: 0.5871325049196275
Energy: 0.622472648517478
Energy: 0.5849082592588034
Energy: 0.5849178817947872
Energy: 0.580496542849888
Energy: 0.5779972881201968
Energy: 0.5857924749077863
Energy: 0.6219798507859848
Energy: 0.5814084451801319
Energy: 0.5865722785116028
Energy: 0.5775315662559182
Energy: 0.5816193780552612
Energy: 0.5874853910570035
Energy: 0.5946460917257379
Energy: 0.5807214881409544
Energy: 0.5859007628884164
Energy: 0.5655735706620648
Energy: 0.5795638561831766
Energy: 0.5855447482222307

minimum gb energy = 0.5629692834644356 eV
minimum distance =  2.2389556482611 Angstroms
sigma value = 33


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

Energy: 0.015330073134158939
Energy: 0.016034073207028744
Energy: 0.015855575566167516
Energy: 0.016717912844211823
Energy: 0.6000578944162196
Energy: 0.022393462163426886
Energy: 0.01589488907033834
Energy: 0.0730712587498263
Energy: 0.07243262191600353
Energy: 0.07441139336391554
Energy: 0.07369631508219764
Energy: 0.07233394810785099
Energy: 0.8138557172507372
Energy: 0.5995214403187324
Energy: 0.5983483551072566
Energy: 0.600955133918192
Energy: 0.6010108122633909
Energy: 0.5984154939409806
Energy: 0.2834974414930209
Energy: 0.0730712587498263
Energy: 0.07243262191600353
Energy: 0.07441139336439083
Energy: 0.07369631508267291
Energy: 0.07233394810740212

minimum gb energy = 0.015330073134158939 eV
minimum distance =  2.4359010445294 Angstroms
sigma value = 1