Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Au__MO_173248269481_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.065000019967556
cohesive_energy=3.8102996988617694
mass=196.9665
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=[8.761022270038799e-20, 1.501149784166496e-19, 2.04939219784842e-19, 2.53703067817266e-19, 2.9733995062088997e-19, 3.36546815031504e-19, 3.7186039022149796e-19, 4.0371326388205195e-19, 4.3245310834274398e-19, 4.583635088677919e-19, 4.816751788924919e-19, 5.02588390496094e-19, 5.21269770048534e-19, 5.37865115623506e-19, 5.52500999175096e-19, 5.65284766537782e-19, 5.76317354839506e-19, 5.85678872911968e-19, 5.934462252336e-19, 5.99683498869762e-19, 6.044515765325459e-19, 6.07800125697606e-19, 6.09778813840596e-19, 6.10429297554e-19, 6.09719533305138e-19, 6.0740118371574e-19, 6.0314740475247e-19, 5.96557652256828e-19, 5.8714967106198e-19, 5.74325849283444e-19, 5.57352390022848e-19, 5.35317654775446e-19, 5.07082495954464e-19, 4.71217772002374e-19, 4.2590341026295195e-19, 3.6882106114679996e-19, 2.96960234758632e-19, 2.0641642664139e-19, 9.203383238686199e-20, -5.305623945257339e-20, -2.38149137054394e-19, -4.7597463442872e-19, -7.84308721112118e-19, -1.188396894326526e-18, -1.7248873423980599e-18, -2.44827009264906e-18, -3.4419400410558597e-18, -4.83772428106398e-18, -6.85273376834676e-18, -9.862294401185039e-18, -1.455655978644066e-17, -2.23093483224696e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.011621326401558182
Energy: 0.012321597452841577
Energy: 0.012919738098086478
Energy: 0.011874975436974671
Energy: 0.3051136721064458
Energy: 0.012064363635089606
Energy: 0.012321597453089594
Energy: 0.09287844811974288
Energy: 0.0929302300251818
Energy: 0.0927354612495189
Energy: 0.09266277153656437
Energy: 0.09289552545352599
Energy: 0.012919738097838461
Energy: 0.0929302300251818
Energy: 0.09290929681234539
Energy: 0.012198840295657348
Energy: 0.09265261287206239
Energy: 0.0929356940290941
Energy: 0.011874975436974671
Energy: 0.0927354612478379
Energy: 0.01219884029518887
Energy: 0.011793302902165676
Energy: 0.09262541385703892
Energy: 0.01206422321596362
Energy: 0.30511367210669377
Energy: 0.09266277153171423
Energy: 0.0926526128686728
Energy: 0.09262541385340131
Energy: 0.09270393881325201
Energy: 0.09264814124704703
Energy: 0.012064363635089606
Energy: 0.09289552545327798
Energy: 0.09293569402228741
Energy: 0.01206422321596362
Energy: 0.09264814124679902
Energy: 0.012028549367693181

minimum gb energy = 0.011621326401558182 eV
minimum distance =  2.87010033861151 Angstroms
sigma value = 1


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

Energy: 0.973592816088172
Energy: 0.6669849168643326
Energy: 0.739047708666399
Energy: 0.6422170581679737
Energy: 0.6662865843389779
Energy: 0.7065557036677308
Energy: 0.9336811574045527
Energy: 0.6810310736522789
Energy: 0.6805116164079081
Energy: 0.6357582956580532
Energy: 0.6810750796864924
Energy: 0.6628351804708119
Energy: 0.8025056471506123
Energy: 0.6812299350642417
Energy: 0.680873690906888
Energy: 0.6649077937646772
Energy: 0.6810720810222053
Energy: 0.6467363403635205
Energy: 0.9717123261786221
Energy: 0.6351913397278955
Energy: 0.661436055208626
Energy: 0.6787912722645842
Energy: 0.6646336068590961
Energy: 0.6944499190202207
Energy: 0.8970441357485504
Energy: 0.6643305775618459
Energy: 0.6835411269161404
Energy: 0.5760758749480548
Energy: 0.6531292161384447
Energy: 0.6835635152975407
Energy: 0.8859114351002259
Energy: 0.6808790901187359
Energy: 0.680516113489829
Energy: 0.6796626548681357
Energy: 0.6698731955801726
Energy: 0.6811871663887644
Energy: 0.8862490909506638
Energy: 0.6317068774990949
Energy: 0.6252482576738274
Energy: 0.6704469207979818
Energy: 0.6311970139728903
Energy: 0.6788838619555845
Energy: 0.7336657035772516
Energy: 0.6739061447939675
Energy: 0.6829062486846817
Energy: 0.6068392681504607
Energy: 0.6749374000023022
Energy: 0.626385605457974
Energy: 0.7365750586932835
Energy: 0.6641778061987915
Energy: 0.6826504187059438
Energy: 0.6805571594327163
Energy: 0.6756183816897072
Energy: 0.6786144727467585
Energy: 0.7328157280257838
Energy: 0.6771562091816035
Energy: 0.6783993122975476
Energy: 0.6515628629797382
Energy: 0.6651943115298563
Energy: 0.664807977474947
Energy: 0.7611612056055846
Energy: 0.6770169760316574
Energy: 0.6623850781624407
Energy: 0.7026360031113672
Energy: 0.6755356806533621
Energy: 0.7175969893659283
Energy: 0.6832529321759594
Energy: 0.6518638012248834
Energy: 0.6652543561588596
Energy: 0.681158458726898
Energy: 0.6518342859697025
Energy: 0.6650234375566132
Energy: 0.6819257052708593
Energy: 0.6664905872158274
Energy: 0.6641763075561938
Energy: 0.6816996532360622
Energy: 0.6074232732052369
Energy: 0.6653036507112285
Energy: 0.724790969476506
Energy: 0.6841013797629347
Energy: 0.6743557562473157
Energy: 0.6719151741679108
Energy: 0.6741287084027143
Energy: 0.6992942783212898
Energy: 0.7005194042416031
Energy: 0.6554487514976827
Energy: 0.6988005114565192
Energy: 0.6670992201058857
Energy: 0.6757738583247789
Energy: 0.6653477558694472
Energy: 0.6986568702625111
Energy: 0.6453311301914418
Energy: 0.6654778943870543
Energy: 0.687013880684527
Energy: 0.6773026332267894
Energy: 0.6857853182959642
Energy: 0.8418060586649763
Energy: 0.676929909890764
Energy: 0.6792655306516235
Energy: 0.6692581980159102
Energy: 0.6792138294482235
Energy: 0.6469129069361325
Energy: 0.8046137556469309
Energy: 0.6004584106285817
Energy: 0.6234471553166692
Energy: 0.6711552006478865
Energy: 0.6348683337565109
Energy: 0.6773583230860182
Energy: 0.804471296498829
Energy: 0.6791338385263462
Energy: 0.6761498948184105
Energy: 0.6573545927754271
Energy: 0.6716008069836615
Energy: 0.6757438865700179
Energy: 0.8042142240452562
Energy: 0.6691879693454554
Energy: 0.6768049920240277
Energy: 0.6010734708497846
Energy: 0.6692012172550572
Energy: 0.6763891024870436
Energy: 0.9236557937346926
Energy: 0.6392096506355538
Energy: 0.6302794518227661
Energy: 0.6762254362692073
Energy: 0.6913222579580172
Energy: 0.6484365114548312
Energy: 0.7559080397061222
Energy: 0.6871155967147856
Energy: 0.6857073848618677
Energy: 0.6598132138210885
Energy: 0.6859289812454799
Energy: 0.6661231382752684
Energy: 0.9344312961480035
Energy: 0.6654607073281316
Energy: 0.6651784542289624
Energy: 0.5661008185226242
Energy: 0.6651689744083663
Energy: 0.658816033233855

minimum gb energy = 0.5661008185226242 eV
minimum distance =  2.67132983219535 Angstroms
sigma value = 33


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

Energy: 1.163739772978522
Energy: 0.7682457765237556
Energy: 0.6906635193564704
Energy: 0.6891493749187463
Energy: 0.7457541811017141
Energy: 0.7192262381300953
Energy: 0.8403452627575371
Energy: 0.7030878856162702
Energy: 0.6978689141078455
Energy: 0.6893715082305459
Energy: 0.7034353959472283
Energy: 0.6873311985561364
Energy: 0.8641031756593016
Energy: 0.6971016027849372
Energy: 0.7107213024423801
Energy: 0.7187380149363144
Energy: 0.6971959736959393
Energy: 0.6741586457908387
Energy: 0.9319885661892081
Energy: 0.7551738684654278
Energy: 0.6998130915027824
Energy: 0.7037934579812857
Energy: 0.7517317968364489
Energy: 0.7029743922439339
Energy: 0.8836481873033138
Energy: 0.7431973922936539
Energy: 0.7089783463274635
Energy: 0.6905208986598483
Energy: 0.6977186324365608
Energy: 0.7503475084793692
Energy: 0.9384688769377618
Energy: 0.747587764483435
Energy: 0.7486049220438459
Energy: 0.7416654033737341
Energy: 0.7412778833566108
Energy: 0.7494167747459038
Energy: 0.9358001809889279
Energy: 0.7264529027797855
Energy: 0.7176689989838537
Energy: 0.7390508450654417
Energy: 0.7179366163902531
Energy: 0.701011035447182
Energy: 0.8855059246688006
Energy: 0.7103188549600502
Energy: 0.703091486493871
Energy: 0.7321319303662063
Energy: 0.6992372645026755
Energy: 0.7153042314400178
Energy: 0.7848381234930756
Energy: 0.7081025400551143
Energy: 0.7215091223195733
Energy: 0.7323657690747114
Energy: 0.7059375987564336
Energy: 0.7257063716187074
Energy: 0.7794932213390263
Energy: 0.7319479618698022
Energy: 0.7314374948981527
Energy: 0.7221266232523322
Energy: 0.7384105082484034
Energy: 0.7376271693302884
Energy: 0.8205799713912215
Energy: 0.6806795341952837
Energy: 0.6807755358904451
Energy: 0.7580849267005441
Energy: 0.6807726079409052
Energy: 0.6990651204576686
Energy: 0.7274003685328199
Energy: 0.6751230572183277
Energy: 0.7367124987370436
Energy: 0.7256381536639109
Energy: 0.6955209682498761
Energy: 0.7312336132028591
Energy: 0.7284149749007902
Energy: 0.7301389894516136
Energy: 0.7243191729201622
Energy: 0.7262617824547327
Energy: 0.7143573687302052
Energy: 0.7214580124541111
Energy: 0.7561172896758076
Energy: 0.7011822776525524
Energy: 0.6721315075301659
Energy: 0.7277328210752408
Energy: 0.7049030728513115
Energy: 0.7121745627720474
Energy: 0.7897416302727583
Energy: 0.728817582326097
Energy: 0.7210323438026419
Energy: 0.7228466651043391
Energy: 0.7290072194477056
Energy: 0.7286999189756739
Energy: 0.7911269683533086
Energy: 0.7255870555619438
Energy: 0.756665463399712
Energy: 0.7511506959394427
Energy: 0.727647182148927
Energy: 0.754258460318772
Energy: 0.919402376746573
Energy: 0.7300921671038616
Energy: 0.7304379900418845
Energy: 0.7173079541180428
Energy: 0.7367552041452675
Energy: 0.7334245124452857
Energy: 0.83533140025835
Energy: 0.7243163061477558
Energy: 0.7084132873036018
Energy: 0.700337078267361
Energy: 0.7366115636969002
Energy: 0.7129525692478803
Energy: 0.8377079845889339
Energy: 0.7387337433013643
Energy: 0.7340057573997747
Energy: 0.7095625428405987
Energy: 0.7402908379006078
Energy: 0.7270625065227198
Energy: 0.8514857179424276
Energy: 0.7225999015668232
Energy: 0.7275525884613897
Energy: 0.7386050876880326
Energy: 0.7230172079004636
Energy: 0.731815432521459
Energy: 0.9694198681420247
Energy: 0.7056717299601417
Energy: 0.6804507199099874
Energy: 0.6826670423858184
Energy: 0.7470822893259306
Energy: 0.6589328814501905
Energy: 0.7657426218281191
Energy: 0.7206942395699882
Energy: 0.721747136478877
Energy: 0.6748371064881254
Energy: 0.7208981525651539
Energy: 0.7198228346754731
Energy: 0.8522181848797564
Energy: 0.7337604083831507
Energy: 0.7275535605218304
Energy: 0.7306052368478115
Energy: 0.7333004061696564
Energy: 0.7196792485111702
Energy: 0.9867784119734643
Energy: 0.7256997840444139
Energy: 0.7041872012441134
Energy: 0.6830971131934626
Energy: 0.7277245773474392
Energy: 0.7326759674325631
Energy: 0.8566986836598665
Energy: 0.7287084965799
Energy: 0.7304818059121644
Energy: 0.7154237003851125
Energy: 0.7297184860022531
Energy: 0.735110450479937
Energy: 0.9398013597153154
Energy: 0.7361675753464363
Energy: 0.746743355417317
Energy: 0.7378301835667663
Energy: 0.7339118110227807
Energy: 0.726191799033577
Energy: 0.937667598484602
Energy: 0.7376034100857556
Energy: 0.7249951699254233
Energy: 0.7363355398635626
Energy: 0.7393568874234216
Energy: 0.731902253448993
Energy: 0.8778885786369409
Energy: 0.709032844470336
Energy: 0.7104621722690712
Energy: 0.761888734133312
Energy: 0.6999089918636956
Energy: 0.7278089014504107
Energy: 0.7743475812325177
Energy: 0.7103776555438591
Energy: 0.7102993970224218
Energy: 0.7365616444401268
Energy: 0.6985850897030933
Energy: 0.727311318411368
Energy: 0.7724774984124014
Energy: 0.7337352112444714
Energy: 0.7292047041024876
Energy: 0.7303134307438546
Energy: 0.7406891824491609
Energy: 0.732894386176272
Energy: 0.8051289867688559
Energy: 0.680242709908049
Energy: 0.6804554759054721
Energy: 0.7928506653707662
Energy: 0.68049934155496
Energy: 0.6864949438050322
Energy: 0.7368880704686114
Energy: 0.6751601905942083
Energy: 0.6707344056428335
Energy: 0.7212215624768165
Energy: 0.6962876697739293
Energy: 0.7089729612322591
Energy: 0.7377192497755594
Energy: 0.7322923256499977
Energy: 0.694917584168722
Energy: 0.7327567070706982
Energy: 0.7345725681568008
Energy: 0.7312638953824123
Energy: 0.7493144169843362
Energy: 0.693207893876145
Energy: 0.7242110696274927
Energy: 0.7227630608842219
Energy: 0.7091789326224046
Energy: 0.719280140640237
Energy: 0.78675265180685
Energy: 0.7227380612633073
Energy: 0.720570485386083
Energy: 0.72917046007664
Energy: 0.6989900837365591
Energy: 0.7260403287063244
Energy: 0.7872420282601036
Energy: 0.7050410285111138
Energy: 0.7412799171436657
Energy: 0.742825377532764
Energy: 0.7265457976217592
Energy: 0.7398704955818785
Energy: 0.7869054375840258
Energy: 0.7390754437726295
Energy: 0.6752628331700243
Energy: 0.710431080169116
Energy: 0.6747368454144377
Energy: 0.7395397222050343
Energy: 0.839525376965948
Energy: 0.7311972698963703
Energy: 0.6845591908458084
Energy: 0.7062859502010075
Energy: 0.764320789225566
Energy: 0.7418467287502821
Energy: 0.8347093998651725
Energy: 0.7091944430631112
Energy: 0.7136542636690774
Energy: 0.7009074611206954
Energy: 0.71409638060779
Energy: 0.7120400667959522
Energy: 0.8996106444064831
Energy: 0.7093874321126588
Energy: 0.7036384231025961
Energy: 0.6831347939437683
Energy: 0.7101004320316752
Energy: 0.6964624171800942
Energy: 1.055743211168683
Energy: 0.7049722628856575
Energy: 0.6770965672542822
Energy: 0.6608402333505752
Energy: 0.703419065032475
Energy: 0.6961597762465477

minimum gb energy = 0.6589328814501905 eV
minimum distance =  2.63702256819887 Angstroms
sigma value = 51


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

Energy: 1.0228535167635906
Energy: 0.6720841215637148
Energy: 0.6526636450478819
Energy: 0.6401739867454509
Energy: 0.6933506231778519
Energy: 0.7184880914221905
Energy: 0.8360488713118741
Energy: 0.6948605354326572
Energy: 0.6950560692309853
Energy: 0.6375451672205413
Energy: 0.694766600357446
Energy: 0.6797590755510119
Energy: 0.8414451590510498
Energy: 0.6921990468856065
Energy: 0.6924153570439294
Energy: 0.6718938741434106
Energy: 0.6920938018947542
Energy: 0.6639203211350381
Energy: 0.8961493980946923
Energy: 0.6562935813701938
Energy: 0.6563912542734435
Energy: 0.6748984517855524
Energy: 0.7035803395594449
Energy: 0.686978825472415
Energy: 0.7862513893808012
Energy: 0.6777259487089897
Energy: 0.7037232934278886
Energy: 0.6736540195015888
Energy: 0.7018883296258449
Energy: 0.6911692613887088
Energy: 0.7852402376308363
Energy: 0.6991649841749863
Energy: 0.6986268270625358
Energy: 0.7001575382089821
Energy: 0.7001990412893256
Energy: 0.705146800417403
Energy: 0.7849220528337931
Energy: 0.6878833655721378
Energy: 0.6938478056090336
Energy: 0.7035067717858441
Energy: 0.6194898015372494
Energy: 0.6676551050611977
Energy: 0.8109608607783579
Energy: 0.6359589051439235
Energy: 0.6579038022656738
Energy: 0.7515675191291945
Energy: 0.6660708979365132
Energy: 0.6576233021126682
Energy: 0.6927184639559858
Energy: 0.6332213013074234
Energy: 0.6348275727679027
Energy: 0.6926499147826557
Energy: 0.6514615169678091
Energy: 0.6561350639869031
Energy: 0.6940784386579799
Energy: 0.6228157475059857
Energy: 0.6700367008212604
Energy: 0.6942271599128919
Energy: 0.621973657461682
Energy: 0.6790065798485584
Energy: 0.6923528857062579
Energy: 0.6539385841248527
Energy: 0.6647869907990579
Energy: 0.6933318444057185
Energy: 0.6405241954525849
Energy: 0.7265258903716575
Energy: 0.7204162795803642
Energy: 0.621235213804459
Energy: 0.706957496659775
Energy: 0.6761447238574968
Energy: 0.650892495777972
Energy: 0.6776194433384003
Energy: 0.717412741755739
Energy: 0.6825936894937186
Energy: 0.6818078253961547
Energy: 0.7038309646742283
Energy: 0.6637083805962315
Energy: 0.6955442752383796
Energy: 0.7197914079055855
Energy: 0.6650808158294891
Energy: 0.6647467146899806
Energy: 0.7045253756221359
Energy: 0.6916234559539914
Energy: 0.6291410091846852
Energy: 0.8293718028384419
Energy: 0.6465543630745317
Energy: 0.647077435190912
Energy: 0.6278639861503548
Energy: 0.6345950131536675
Energy: 0.6323305460369849
Energy: 0.8290143335438743
Energy: 0.705039333528037
Energy: 0.6926364742409444
Energy: 0.6270788773743532
Energy: 0.7052795904566102
Energy: 0.6920271716212612
Energy: 0.8455243976173389
Energy: 0.7056562881607247
Energy: 0.7072683555202076
Energy: 0.6079759804776566
Energy: 0.7082210014883111
Energy: 0.6978625331744566
Energy: 0.9684384088593396
Energy: 0.6782017991771486
Energy: 0.6722516766309276
Energy: 0.655804491504601
Energy: 0.6781020990953077
Energy: 0.6555896479466544

minimum gb energy = 0.6079759804776566 eV
minimum distance =  2.70357297031299 Angstroms
sigma value = 19


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

Energy: 0.8578584272754015
Energy: 0.6530865125430053
Energy: 0.6411480997870437
Energy: 0.7047029883931596
Energy: 0.6562261265076306
Energy: 0.640877875544939
Energy: 0.6268499964177757
Energy: 0.6551882116227236
Energy: 0.6553393845393468
Energy: 0.6691886315713329
Energy: 0.6549669472114495
Energy: 0.6593357284920651
Energy: 0.7558662995200813
Energy: 0.6529885782970256
Energy: 0.6578464236349311
Energy: 0.6732666817130416
Energy: 0.6505970995815392
Energy: 0.6578559081516658
Energy: 0.7403721334085184
Energy: 0.658704611219759
Energy: 0.658676025603944
Energy: 0.6602600989109176
Energy: 0.7293114953445361
Energy: 0.6585807703936009
Energy: 0.7192091826653638
Energy: 0.6565736870174973
Energy: 0.6543072767317594
Energy: 0.6435380318067034
Energy: 0.6565032413522311
Energy: 0.6830674531099437
Energy: 0.7538821718793228
Energy: 0.6284462561365195
Energy: 0.6799496715387724
Energy: 0.6710748991169403
Energy: 0.6287937884639566
Energy: 0.6782600966657406
Energy: 0.7560145261194059
Energy: 0.6833141380231283
Energy: 0.6761854537220928
Energy: 0.6800861259363494
Energy: 0.6459273555591643
Energy: 0.672984978900727
Energy: 0.7291352596023468
Energy: 0.6105521961429131
Energy: 0.6105088090430585
Energy: 0.7307083594972835
Energy: 0.6109002478977963
Energy: 0.6192433211803862
Energy: 0.6554147293296466
Energy: 0.6101977434794397
Energy: 0.6099656970191099
Energy: 0.6555679477725106
Energy: 0.6102536137285994
Energy: 0.6190773156592883
Energy: 0.6567836385623037
Energy: 0.6560112573958052
Energy: 0.658598552551476
Energy: 0.6569298467724217
Energy: 0.6833736672365821
Energy: 0.6586972781146049
Energy: 0.6532873591076076
Energy: 0.6544872928118427
Energy: 0.6802735804247776
Energy: 0.6532687511260438
Energy: 0.6545974593548977
Energy: 0.6530054756972767
Energy: 0.7309530159048454
Energy: 0.6849062862242236
Energy: 0.6831286448602646
Energy: 0.6573544500748377
Energy: 0.6811468359582152
Energy: 0.6580464844047612
Energy: 0.6277505751288691
Energy: 0.67040153001237
Energy: 0.6813779653289871
Energy: 0.627926148864102
Energy: 0.6709846097802853
Energy: 0.6731390907183035
Energy: 0.7181237894014512
Energy: 0.674086695894178
Energy: 0.6738148786917879
Energy: 0.653532619160157
Energy: 0.6724166121094124
Energy: 0.6731544569466491
Energy: 0.86176115787019
Energy: 0.6577990901702265
Energy: 0.6462455099619984
Energy: 0.610003833494006
Energy: 0.6545447003471928
Energy: 0.6153913372204367
Energy: 0.8606927491797677
Energy: 0.6543170966990747
Energy: 0.6196454440191596
Energy: 0.609673986520839
Energy: 0.6539493559667727
Energy: 0.6111208408345641
Energy: 0.7216716751590042
Energy: 0.6575633084734147
Energy: 0.6586233409315855
Energy: 0.6450571051844898
Energy: 0.6567113223662052
Energy: 0.655002812423425
Energy: 0.740293211776412
Energy: 0.6541639972104826
Energy: 0.6539598292283026
Energy: 0.6553415505178299
Energy: 0.6535187346042595
Energy: 0.6531779077772939
Energy: 0.7401738201945115
Energy: 0.6535805699615126
Energy: 0.6530046469001134
Energy: 0.6596585891078778
Energy: 0.65289437874246
Energy: 0.6524105364321622
Energy: 0.7194360598969048
Energy: 0.6289195072592059
Energy: 0.683035942346401
Energy: 0.652261156730613
Energy: 0.6283181240833642
Energy: 0.6790808534448332
Energy: 0.7533972348637508
Energy: 0.6544451361820722
Energy: 0.6799278014698399
Energy: 0.6726843799925967
Energy: 0.6526756381865261
Energy: 0.6724399970111896
Energy: 0.7566543725014487
Energy: 0.6337035800898346
Energy: 0.6839998267107429
Energy: 0.6521783251572453
Energy: 0.6659285338332201
Energy: 0.6829939864366165
Energy: 0.7196277307516876
Energy: 0.6096537128213774
Energy: 0.6097443891424953
Energy: 0.7314927987648482
Energy: 0.6101715659965733
Energy: 0.6432183078027162
Energy: 0.6536774523440424
Energy: 0.6598977614303865
Energy: 0.6607978964464576
Energy: 0.6491162713280201
Energy: 0.6454599169160828
Energy: 0.6559259412777992
Energy: 0.6497410310912711
Energy: 0.6610153429198378
Energy: 0.658890383744484
Energy: 0.6519686650990063
Energy: 0.6693602085171879
Energy: 0.6576472941342397
Energy: 0.7286430283094966
Energy: 0.6597746657227446
Energy: 0.6657875801111784
Energy: 0.729289235292994
Energy: 0.6603094239062672
Energy: 0.6583673537786061
Energy: 0.7567694176152513
Energy: 0.6820339970996605
Energy: 0.6825982610623087
Energy: 0.6523827749541113
Energy: 0.633838418236366
Energy: 0.6820002898908394
Energy: 0.6282376834945349
Energy: 0.6720680647851004
Energy: 0.6760831005511299
Energy: 0.6284545471832437
Energy: 0.6734802430683632
Energy: 0.6764385268626388
Energy: 0.7198328450200235
Energy: 0.6740727940462107
Energy: 0.6736152289627022
Energy: 0.6544476865642745
Energy: 0.6747568717215066
Energy: 0.6733876739463549
Energy: 0.8607668493104746
Energy: 0.6419550064191948
Energy: 0.6196711952660899
Energy: 0.6092755383794485
Energy: 0.7306746735131256
Energy: 0.616980341543937

minimum gb energy = 0.6092755383794485 eV
minimum distance =  2.74565747447891 Angstroms
sigma value = 27


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

Energy: 0.7528693299228335
Energy: 0.7383567510732226
Energy: 0.7863631813449714
Energy: 0.5637582035971449
Energy: 0.6438436542114425
Energy: 0.7871001432542837
Energy: 0.6731011107060716
Energy: 0.6436371056609489
Energy: 0.6408014369510823
Energy: 0.6271921942768961
Energy: 0.6439784747674242
Energy: 0.607759275209929
Energy: 0.6856018196332274
Energy: 0.6432679609113664
Energy: 0.6436000966943776
Energy: 0.5998666063721433
Energy: 0.6409406842070965
Energy: 0.5994103585107838
Energy: 0.6073054252196044
Energy: 0.6076540576349603
Energy: 0.6075508677173534
Energy: 0.6176171180530017
Energy: 0.7125487923443785
Energy: 0.5768285270409752
Energy: 0.7520028038620626
Energy: 0.5643807922458235
Energy: 0.5760370802579343
Energy: 0.676848873976685
Energy: 0.6688613331802385
Energy: 0.5758865773676697
Energy: 0.6438152309702989
Energy: 0.5627649857027041
Energy: 0.5657976463553663
Energy: 0.6439493558877587
Energy: 0.541845102533176
Energy: 0.5648559806924591
Energy: 0.6437026565917803
Energy: 0.5985661739381739
Energy: 0.5984947928218993
Energy: 0.64349553973711
Energy: 0.6257758425001235
Energy: 0.5985323422249997
Energy: 0.641126008512735
Energy: 0.6795518507507742
Energy: 0.6566470900244683
Energy: 0.640882034214065
Energy: 0.6096566859385272
Energy: 0.678196089218671
Energy: 0.6863192317051858
Energy: 0.5778354344263187
Energy: 0.5767643592090186
Energy: 0.6402614981591377
Energy: 0.6235765593056929
Energy: 0.5990173387462464
Energy: 0.6872645726063872
Energy: 0.599115750417696
Energy: 0.5979457356713579
Energy: 0.6108478126258257
Energy: 0.6559007607323483
Energy: 0.59852775323608
Energy: 0.6862217064229638
Energy: 0.6489267762162783
Energy: 0.6118751927676807
Energy: 0.6343753779787418
Energy: 0.6504028386542934
Energy: 0.5992717285466911
Energy: 0.686202215582102
Energy: 0.64344534442716
Energy: 0.607718578097405
Energy: 0.629200521034193
Energy: 0.6444117220380324
Energy: 0.6078782759982757

minimum gb energy = 0.541845102533176 eV
minimum distance =  2.71966578510014 Angstroms
sigma value = 9


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

Energy: 1.0721912030684186
Energy: 0.662847828656383
Energy: 0.529664365325877
Energy: 0.6195233215376066
Energy: 0.5663963337307729
Energy: 0.7107378342123675
Energy: 0.5436533838869836
Energy: 0.5664059151587942
Energy: 0.5666441838395998
Energy: 0.5509068788090453
Energy: 0.5663040141569186
Energy: 0.5498459767605366
Energy: 0.5859036418436315
Energy: 0.5653751344408652
Energy: 0.5574486944133727
Energy: 0.5593908607706031
Energy: 0.5653347765654304
Energy: 0.5593241997706745
Energy: 0.7367484119483921
Energy: 0.5408665005011288
Energy: 0.5322748885166181
Energy: 0.5504987933240965
Energy: 0.5580721823583649
Energy: 0.5323301807624772
Energy: 0.6182896600660589
Energy: 0.5393480137722705
Energy: 0.49859554197204603
Energy: 0.5678795165944258
Energy: 0.5388124872040229
Energy: 0.546361742125226
Energy: 0.5723829997712636
Energy: 0.544434778787503
Energy: 0.5296056634117312
Energy: 0.5726178706209787
Energy: 0.5189306192369165
Energy: 0.5549001351217229
Energy: 0.5730042477609881
Energy: 0.5188745904747016
Energy: 0.5181730242605932
Energy: 0.5741500649346892
Energy: 0.538545903815867
Energy: 0.5823660408540269
Energy: 0.5615394689194908
Energy: 0.5626392091411752
Energy: 0.5278530281878264
Energy: 0.5618791507585393
Energy: 0.5531788472802736
Energy: 0.5439330034039762
Energy: 0.5670156402868418
Energy: 0.5434914574688271
Energy: 0.5554764461924417
Energy: 0.570024386514793
Energy: 0.5559213768938887
Energy: 0.519693370066825
Energy: 0.8430248194920382
Energy: 0.5484717693874236
Energy: 0.5487688257581738
Energy: 0.5345182486188118
Energy: 0.6061122447879527
Energy: 0.5458083813043711
Energy: 0.5430904017104125
Energy: 0.5679324069578767
Energy: 0.5799925973580982
Energy: 0.534158985257753
Energy: 0.5675696492423852
Energy: 0.5182675101650489
Energy: 0.6354172644532843
Energy: 0.5744159932547765
Energy: 0.5739321199973322
Energy: 0.5317976603945681
Energy: 0.5746993340009681
Energy: 0.5095291926900232
Energy: 0.9551316106178673
Energy: 0.574758476923514
Energy: 0.5526072139694972
Energy: 0.5516389206727919
Energy: 0.5764329917201427
Energy: 0.584416226045841
Energy: 0.6380335078142891
Energy: 0.5669452029823421
Energy: 0.587692530104155
Energy: 0.5327233361067203
Energy: 0.5741965012425893
Energy: 0.5196611599611005
Energy: 0.5635240731468024
Energy: 0.5651112063215894
Energy: 0.573453946363415
Energy: 0.5640802967355433
Energy: 0.5769380701375577
Energy: 0.5727681871761947
Energy: 0.5654094037767206
Energy: 0.5718919994080417
Energy: 0.5387315372244001
Energy: 0.5663461012106799
Energy: 0.564550956947951
Energy: 0.5325306361854255
Energy: 0.5651861434778849
Energy: 0.5174385627602209
Energy: 0.5070796491839611
Energy: 0.565173389949223
Energy: 0.5297189813364455
Energy: 0.5510605747331638
Energy: 0.6236201227144523
Energy: 0.5547156377979767
Energy: 0.5528212361440271
Energy: 0.565602908452884
Energy: 0.5719118000716608
Energy: 0.5554087247388876
Energy: 0.5853140950731132
Energy: 0.545600591580239
Energy: 0.554919384318101
Energy: 0.5667214153486119
Energy: 0.5667219889014655
Energy: 0.5490467043209066
Energy: 0.5849663345238442
Energy: 0.5578274347157269
Energy: 0.5482047073070403
Energy: 0.5570105320935183
Energy: 0.5567354195868094
Energy: 0.5376553338350392
Energy: 0.5859795205211126
Energy: 0.5429934023999923
Energy: 0.5540741373315434
Energy: 0.5483989091739533
Energy: 0.5664376721065335
Energy: 0.5397155871325244
Energy: 0.6207395842235344
Energy: 0.5666860148787696
Energy: 0.5777539752690254
Energy: 0.5403901836243574
Energy: 0.5667832183096185
Energy: 0.5311758789734896
Energy: 0.6162303675047116
Energy: 0.5666812345317886
Energy: 0.5646658590968333
Energy: 0.5405108424512152
Energy: 0.5671710459282311
Energy: 0.5147312481903527
Energy: 0.5860405815619149
Energy: 0.5661263112573613
Energy: 0.5573136664376404
Energy: 0.5690347714027754
Energy: 0.5655924116156547
Energy: 0.5633870240622508
Energy: 0.7314219623729059
Energy: 0.530075240163999
Energy: 0.5343474587899213
Energy: 0.5722709044192518
Energy: 0.5637077262676938
Energy: 0.5404170920621157
Energy: 0.5859393267817622
Energy: 0.531605257939514
Energy: 0.5192809097719159
Energy: 0.5739192235498579
Energy: 0.5319450571942317
Energy: 0.5579998583980558
Energy: 0.532152196861161
Energy: 0.5628562493226956
Energy: 0.5628499849259371
Energy: 0.5314331517816645
Energy: 0.5616822595883617
Energy: 0.5537038338295899
Energy: 0.5752166489885535
Energy: 0.5195280912088661
Energy: 0.5196424413756703
Energy: 0.5754076096912187
Energy: 0.5317223344421182
Energy: 0.5743341252217073
Energy: 0.5662600335913498
Energy: 0.5337316253944611
Energy: 0.5538264848628721
Energy: 0.5658233869204958
Energy: 0.5437072523022248
Energy: 0.5812322125046905
Energy: 0.5496086088323587
Energy: 0.5664305583524163
Energy: 0.531490339412467
Energy: 0.5597834094766007
Energy: 0.5517469059267405
Energy: 0.5539640089660888
Energy: 0.5431743359849875
Energy: 0.5478296048005944
Energy: 0.5301752630038422
Energy: 0.5337867612243404
Energy: 0.5478670156989904
Energy: 0.5429647854171953
Energy: 0.8413311349743746
Energy: 0.5631124633398439
Energy: 0.5429629751346828
Energy: 0.5299098921243744
Energy: 0.5625955589065693
Energy: 0.545783140431681
Energy: 0.5831909093321666
Energy: 0.573809060937058
Energy: 0.5734388895072953
Energy: 0.5695616746862943
Energy: 0.5748610537787939
Energy: 0.5592767491562672
Energy: 0.7311924551768116
Energy: 0.573908268313209
Energy: 0.5746248507882438
Energy: 0.5420891714932896
Energy: 0.5735820600646534
Energy: 0.5534312884156959
Energy: 0.5809544121079129
Energy: 0.5665660717546367
Energy: 0.5422332920935845
Energy: 0.5426131651630319
Energy: 0.5670224385573442
Energy: 0.519519095459368
Energy: 0.5641344534067514
Energy: 0.5688779464730507
Energy: 0.5188072422730212
Energy: 0.5739252645724858
Energy: 0.56243269732842
Energy: 0.5327264194178477
Energy: 0.5640857606360309
Energy: 0.5513654091869784
Energy: 0.5531605808571146
Energy: 0.5644481115007046
Energy: 0.551846086767037
Energy: 0.5598061209402739
Energy: 0.5653806993885229
Energy: 0.548758957967908
Energy: 0.5459943050350821
Energy: 0.5653497583690295
Energy: 0.5487675821805174
Energy: 0.5544219407465047
Energy: 0.5664790546312393
Energy: 0.6143668938693246
Energy: 0.5457457827089486
Energy: 0.5659281646863474
Energy: 0.6143215292570195
Energy: 0.5490808943095807
Energy: 0.5858931706466136
Energy: 0.5471341509275685
Energy: 0.5462330023419734
Energy: 0.565143267779036
Energy: 0.5497743737671047
Energy: 0.5429028418297757
Energy: 0.5834285373222377
Energy: 0.5424525969782693
Energy: 0.5408681243961719
Energy: 0.5620580848998091
Energy: 0.5594017101852162
Energy: 0.55644123178869
Energy: 0.5859661068782711
Energy: 0.5600097455277052
Energy: 0.5444609950607663
Energy: 0.5656441507316615
Energy: 0.5581858139942125
Energy: 0.5431638583287208
Energy: 0.6165012431437761
Energy: 0.5663140842379571
Energy: 0.5531783423141217
Energy: 0.5405612895463685
Energy: 0.5664273045601594
Energy: 0.5144196242664196

minimum gb energy = 0.49859554197204603 eV
minimum distance =  2.69010820587448 Angstroms
sigma value = 57


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

Energy: 0.241276054417827
Energy: 0.25082192620689203
Energy: 0.25086724087645146
Energy: 0.2435683377524752
Energy: 0.2818765940635189
Energy: 0.242688602020026
Energy: 0.2425332165476865
Energy: 0.2582720445851779
Energy: 0.25846127501569055
Energy: 0.27781243737640576
Energy: 0.27908544930804613
Energy: 0.29074539717363
Energy: 0.318004787940231
Energy: 0.28072918600384794
Energy: 0.2811813122946697
Energy: 0.27955498039839766
Energy: 0.28048016163742195
Energy: 0.28812673784273274
Energy: 0.31790665427806863
Energy: 0.28078983318236017
Energy: 0.2809486801227403
Energy: 0.28064755558370075
Energy: 0.3175788192415118
Energy: 0.2894600789069877
Energy: 0.31461035479019545
Energy: 0.2424781122284414
Energy: 0.26847754713814065
Energy: 0.3158053949088222
Energy: 0.24239409844272908
Energy: 0.25983769341918167
Energy: 0.28054896240165816
Energy: 0.24234613991397022
Energy: 0.24300968855400226
Energy: 0.2590863848994639
Energy: 0.24221729911221548
Energy: 0.2652559746219845
Energy: 0.27609247254330294
Energy: 0.25820277774164235
Energy: 0.2588244587339855
Energy: 0.2769762351330123
Energy: 0.28057575274627156
Energy: 0.28739300552445657
Energy: 0.28036482097182486
Energy: 0.2823367549692692
Energy: 0.31851626173245595
Energy: 0.2804200148995734
Energy: 0.28080336686497753
Energy: 0.2807679554593775
Energy: 0.3144106786818032
Energy: 0.2804609053077752
Energy: 0.2870633212037476
Energy: 0.31602327025077254
Energy: 0.2794177125781514
Energy: 0.2824390432904626
Energy: 0.2421198605719344
Energy: 0.2803641530773775
Energy: 0.26660660447284606
Energy: 0.24224473543499733
Energy: 0.279561044120765
Energy: 0.2668647482206548
Energy: 0.2420559044001947
Energy: 0.25784245081920415
Energy: 0.25832135432327114
Energy: 0.24218406751249366
Energy: 0.2802959721236274
Energy: 0.26756091428343
Energy: 0.3162844060137057
Energy: 0.28054325897695964
Energy: 0.28377026141631556
Energy: 0.317795541277009
Energy: 0.2801558471589158
Energy: 0.2593886796073577
Energy: 0.3176099122712128
Energy: 0.31734805589476217
Energy: 0.31821033677550575
Energy: 0.31997637206210505
Energy: 0.3174041447847448
Energy: 0.3184367191906336
Energy: 0.3152661327330018
Energy: 0.28024020844637604
Energy: 0.2811578676177822
Energy: 0.31667626447272434
Energy: 0.27906675312808665
Energy: 0.2596180685509825
Energy: 0.31797677288787585
Energy: 0.2422121919255589
Energy: 0.24257170350924978
Energy: 0.28048263304376525
Energy: 0.24603751284947475
Energy: 0.24322053874771532
Energy: 0.2784680320839832
Energy: 0.2830440674937957
Energy: 0.2619358285118749
Energy: 0.27912521015835445
Energy: 0.24251081139925965
Energy: 0.2587332890967937
Energy: 0.2802793270890328
Energy: 0.28102343115217504
Energy: 0.2600764990958491
Energy: 0.28036061637541393
Energy: 0.2800045168339467
Energy: 0.28304607117567554
Energy: 0.31743517193549137
Energy: 0.2808953608648582
Energy: 0.282042037867742
Energy: 0.31730898787217865
Energy: 0.28030747872806966
Energy: 0.2811890515525089
Energy: 0.24208294097500194
Energy: 0.2592933126421235
Energy: 0.2590978976533637
Energy: 0.2422047631762728
Energy: 0.31716182857087144
Energy: 0.2870959834310582

minimum gb energy = 0.241276054417827 eV
minimum distance =  2.73754760406335 Angstroms
sigma value = 11


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

Energy: 0.8542260365685755
Energy: 0.42985834973606335
Energy: 0.4997686876067429
Energy: 0.6581607717247099
Energy: 0.41764092329629654
Energy: 0.5000318921538723
Energy: 0.43189980973257347
Energy: 0.42039464025217227
Energy: 0.46096737111425196
Energy: 0.43558824416350705
Energy: 0.42430438326949277
Energy: 0.42528457149064325
Energy: 0.4294184806601786
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Energy: 0.43009084567816214
Energy: 0.4196768218799815
Energy: 0.4322651600416267
Energy: 0.42850481668011836
Energy: 0.43698649099732206
Energy: 0.43823621826422887
Energy: 0.42910591174851936
Energy: 0.42674593832219737
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Energy: 0.4175972928454026
Energy: 0.48336644026544284
Energy: 0.4720824541742966
Energy: 0.41746695380731114
Energy: 0.44649660711247113
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Energy: 0.5073575477442317
Energy: 0.49315640686567985
Energy: 0.4928612760196277
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Energy: 0.6513532306725033
Energy: 0.48730668000366384
Energy: 0.48338439855908855
Energy: 0.44188484517603793
Energy: 0.43926184349744174
Energy: 0.4829013201893891
Energy: 0.6078453857936673
Energy: 0.5714384675119573
Energy: 0.44829052999548114
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Energy: 0.6177913030233061
Energy: 0.44987067326158614
Energy: 0.49416704040140064
Energy: 0.46302975341022035
Energy: 0.4643626094874594
Energy: 0.43980744674424804
Energy: 0.4623660525365596
Energy: 0.4853457768230716
Energy: 0.49242717793237867
Energy: 0.44657273536630926
Energy: 0.4440849936231725
Energy: 0.425720937068602
Energy: 0.44480332372307724
Energy: 0.4796283766630214
Energy: 0.5212337509818006
Energy: 0.49318476701479347
Energy: 0.4967421612699533
Energy: 0.5176357834334298
Energy: 0.5904555472872072
Energy: 0.4981938879247297
Energy: 0.6514742010880094
Energy: 0.4842654524850803
Energy: 0.46263332768002635
Energy: 0.42450983703960277
Energy: 0.44895811369811967
Energy: 0.45448674994120475
Energy: 0.5401920569468075
Energy: 0.57410743201533
Energy: 0.5382385460422507
Energy: 0.5315017972186153
Energy: 0.6161176048049403
Energy: 0.4844618434764954
Energy: 0.42352472393110524
Energy: 0.44315004625167165
Energy: 0.4637902604050944
Energy: 0.4239644435738418
Energy: 0.4458701701660227
Energy: 0.4543717376882414
Energy: 0.48421039260418136
Energy: 0.5080524279623473
Energy: 0.4806506224046402
Energy: 0.48149530185025224
Energy: 0.5174370075662915
Energy: 0.4814592014082097
Energy: 0.47397142174709933
Energy: 0.4196364329298006
Energy: 0.41940012636466506
Energy: 0.47493241851379747
Energy: 0.4279283371653642
Energy: 0.4760174454384261
Energy: 0.4891568400221726
Energy: 0.4575519615992048
Energy: 0.44360305035844166
Energy: 0.578900917253953
Energy: 0.4359035464062505
Energy: 0.444699564032213

minimum gb energy = 0.4064301509244069 eV
minimum distance =  2.70016006335478 Angstroms
sigma value = 41


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

Energy: 0.8314288254269682
Energy: 0.46971475400634366
Energy: 0.46912957934522587
Energy: 0.6424950127437477
Energy: 0.4565442911020474
Energy: 0.6425854853490288
Energy: 0.4796117560583695
Energy: 0.45607654883518584
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Energy: 0.4799135840654094
Energy: 0.4592262595495084
Energy: 0.4760216312615616
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Energy: 0.475880195102897
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Energy: 0.4573951535334745
Energy: 0.45666800711029676
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Energy: 0.5043011719618773
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Energy: 0.460681768052905
Energy: 0.517379169176187
Energy: 0.5356611328208392
Energy: 0.5358588647974549
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Energy: 0.47944522738741446
Energy: 0.47507536506114917
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Energy: 0.5563329541334018
Energy: 0.5562485281429925
Energy: 0.4772109494060553
Energy: 0.5565824779180358
Energy: 0.46457921917953354
Energy: 0.5160342539655037
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Energy: 0.4785608297258344
Energy: 0.5024055888855414
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Energy: 0.5819074610630216
Energy: 0.46587912630617373
Energy: 0.46143661741168307
Energy: 0.6150735251767074
Energy: 0.4982294581800956
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Energy: 0.46203475970046104
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Energy: 0.43602831971504163
Energy: 0.6433242523055013
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Energy: 0.4582921638721747
Energy: 0.48360216287562247
Energy: 0.45980492767793785
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Energy: 0.47261648890650826
Energy: 0.457318015749626
Energy: 0.4574131170664269
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Energy: 0.4606397634592078
Energy: 0.4560028790840495
Energy: 0.4584027933747079
Energy: 0.45858896289518397
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Energy: 0.4576937672745412
Energy: 0.47618973129234865
Energy: 0.4586520878842293
Energy: 0.4621444101606692
Energy: 0.4761905771567508
Energy: 0.5645391071163006
Energy: 0.5335395214899742
Energy: 0.5300677942198889
Energy: 0.5651300297799953
Energy: 0.5344733970386554
Energy: 0.5296307832450655
Energy: 0.5185990659695674
Energy: 0.45605566098472705
Energy: 0.4754838508658361
Energy: 0.459140995414062
Energy: 0.48009640171928436
Energy: 0.47623129187537244
Energy: 0.47684531082852855
Energy: 0.5490449983097859
Energy: 0.5515416019539905
Energy: 0.4769863270219918
Energy: 0.5494780308628285
Energy: 0.46530490904297256
Energy: 0.518013977428754
Energy: 0.46020825828335293
Energy: 0.45646023540851516
Energy: 0.4839792932769716
Energy: 0.45971593287013307
Energy: 0.47538324562145473
Energy: 0.614471893659637
Energy: 0.46416940309131144
Energy: 0.48870125918270263
Energy: 0.5824907276930055
Energy: 0.4635267158365633
Energy: 0.46383869955312557
Energy: 0.6136685517218151
Energy: 0.46560930613296814
Energy: 0.5624298700342479
Energy: 0.582492185342254
Energy: 0.5422140563353948
Energy: 0.4623284627261421
Energy: 0.603636257227633
Energy: 0.4630712022742638
Energy: 0.5012439136109011
Energy: 0.46365913246292767
Energy: 0.4629946118568674
Energy: 0.46150626277882073
Energy: 0.4655797795176943
Energy: 0.6409148698511379
Energy: 0.6410986262757316
Energy: 0.5379071923619162
Energy: 0.6433143760645695
Energy: 0.6406430557687117
Energy: 0.46450549525257356
Energy: 0.48685059880825265
Energy: 0.4654903514871078
Energy: 0.46516762884098745
Energy: 0.48974920492898727
Energy: 0.4785529747113676
Energy: 0.5438532348156271
Energy: 0.5385918531248587
Energy: 0.5495762385622915
Energy: 0.5433915412350665
Energy: 0.5816725374519153
Energy: 0.5429647561166111
Energy: 0.5426997027246376
Energy: 0.45734465883592174
Energy: 0.4615770365476315
Energy: 0.46212265354255727
Energy: 0.45900719470117346
Energy: 0.4599072088798743
Energy: 0.750741928244911
Energy: 0.47690158808044836
Energy: 0.48707540644385505
Energy: 0.6435838620994654
Energy: 0.45770424845499535
Energy: 0.4823988579179087

minimum gb energy = 0.43602831971504163 eV
minimum distance =  2.69900480683419 Angstroms
sigma value = 33


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

Energy: 0.6263367222368045
Energy: 0.7696210486148327
Energy: 0.7697372619374969
Energy: 0.6270540474148492
Energy: 0.5391807443905113
Energy: 0.769810648637781
Energy: 0.5376350477835986
Energy: 0.4955479700637543
Energy: 0.4959117560427304
Energy: 0.5126329061181789
Energy: 0.5101154857392687
Energy: 0.5163681711001429
Energy: 0.5061606049978881
Energy: 0.4957138025870498
Energy: 0.4948813045533513
Energy: 0.5060953833069357
Energy: 0.5046686758653358
Energy: 0.49386915607705334
Energy: 0.5064897097574582
Energy: 0.5156746453610445
Energy: 0.49446098958149615
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Energy: 0.5083728264061083
Energy: 0.4942805337368568
Energy: 0.5063416302261767
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Energy: 0.4787477128154968
Energy: 0.50690012600466
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Energy: 0.4795174577286031
Energy: 0.6868537539536623
Energy: 0.48007363907045325
Energy: 0.47922956815463863
Energy: 0.5300518142038365
Energy: 0.6251264475965636
Energy: 0.48015718907259564
Energy: 0.5374112959370856
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Energy: 0.5145596475612977
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Energy: 0.5302774544650561
Energy: 0.49317192468268933
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Energy: 0.5590191887684208
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Energy: 0.5331431922505666
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Energy: 0.5049471115199772
Energy: 0.4772511491035449
Energy: 0.4756760541404087
Energy: 0.6520655027780471
Energy: 0.47628863173760766

minimum gb energy = 0.4739045601345197 eV
minimum distance =  2.71739814878961 Angstroms
sigma value = 67


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

Energy: 0.7414604759530535
Energy: 0.5136967071329074
Energy: 0.5137752822858729
Energy: 0.7398888528915357
Energy: 0.5601107485807207
Energy: 0.5144233191031676
Energy: 0.581384355024126
Energy: 0.5101515088353181
Energy: 0.5091744788210654
Energy: 0.5261118643508945
Energy: 0.522753297783993
Energy: 0.5110443671189058
Energy: 0.5420505542237068
Energy: 0.4668120562278094
Energy: 0.4990360523665085
Energy: 0.5187282355545682
Energy: 0.4665444246858709
Energy: 0.4991491820709239
Energy: 0.5374884570156232
Energy: 0.5238293879946767
Energy: 0.5133304037004103
Energy: 0.5221840152856473
Energy: 0.5116233173225277
Energy: 0.4975100367833396
Energy: 0.5340888998715883
Energy: 0.526927572607745
Energy: 0.5267511099738077
Energy: 0.5346276129494902
Energy: 0.5272744851360598
Energy: 0.5156124803007229
Energy: 0.5382850962422998
Energy: 0.4917991156324373
Energy: 0.517070192741192
Energy: 0.5385790290852868
Energy: 0.49292002617378056
Energy: 0.5166772817736941
Energy: 0.5820133148816632
Energy: 0.526219831979153
Energy: 0.525171188043652
Energy: 0.4976997200516938
Energy: 0.5237307312888513
Energy: 0.5120926633906433

minimum gb energy = 0.4665444246858709 eV
minimum distance =  2.75086027872461 Angstroms
sigma value = 3


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

Energy: 0.7381225341545794
Energy: 0.7005317964394057
Energy: 0.6307365178126958
Energy: 0.5672863520116168
Energy: 0.9251162445835655
Energy: 0.6329693134918799
Energy: 0.583160435617676
Energy: 0.5664417635338069
Energy: 0.5518829464528111
Energy: 0.5883559655007458
Energy: 0.5661647669601282
Energy: 0.5516026578222681
Energy: 0.5563111822472397
Energy: 0.549691915608967
Energy: 0.5493280880514004
Energy: 0.5564088697778744
Energy: 0.5498986791282978
Energy: 0.5519480022174454
Energy: 0.5516317511620276
Energy: 0.5509348091001612
Energy: 0.5506967369325206
Energy: 0.5527625130771952
Energy: 0.5659081289671877
Energy: 0.5506468473322972
Energy: 0.5506504998415969
Energy: 0.5514899147658584
Energy: 0.5524384556918014
Energy: 0.5512095317802688
Energy: 0.5850117967800323
Energy: 0.5521584301831189
Energy: 0.5501379659836624
Energy: 0.5854503727430113
Energy: 0.5510334012116714
Energy: 0.5519072604169344
Energy: 0.5992211562892346
Energy: 0.5529789508678173
Energy: 0.5513638715212683
Energy: 0.6269047950262788
Energy: 0.5833734977159507
Energy: 0.5955855053792123
Energy: 0.5868090223611002
Energy: 0.5886080146927473
Energy: 0.949431292603223
Energy: 0.6481039837965158
Energy: 0.5887230682323275
Energy: 0.5503398473202544
Energy: 0.6276215943026858
Energy: 0.6472499304479512
Energy: 0.554501192979583
Energy: 0.552162426881547
Energy: 0.5994903179018569
Energy: 0.598770071570007
Energy: 0.567378875155442
Energy: 0.5667972802988106
Energy: 0.6763160706672913
Energy: 0.5587795889796827
Energy: 0.5587123330674546
Energy: 0.6546197379307043
Energy: 0.5630054090725307
Energy: 0.6147634287036097
Energy: 0.6096795385851671
Energy: 0.5506655374139183
Energy: 0.6233061304429081
Energy: 0.5941517722528292
Energy: 0.5830906062389639
Energy: 0.5920469885983838
Energy: 0.6190493484367049
Energy: 0.5849092305430728
Energy: 0.5528230281310704
Energy: 0.6290082406627593
Energy: 0.568788618324768
Energy: 0.5534526909218623
Energy: 0.5854550352994318
Energy: 0.5533041651080756
Energy: 0.5535467131814369
Energy: 0.5910378347981771
Energy: 0.552566258194456
Energy: 0.5544123897203692
Energy: 0.6204360013789391
Energy: 0.5510483733957143
Energy: 0.5509287282265426
Energy: 0.5762066523991665
Energy: 0.5532277258462268
Energy: 0.5509509379292397
Energy: 0.7123795322279035
Energy: 0.55500594710833
Energy: 0.5547884472927123
Energy: 0.5483990534009143
Energy: 0.553916176189988
Energy: 0.5538983173159409
Energy: 0.6554051760007296
Energy: 0.5517499269821949
Energy: 0.5519866768734705
Energy: 0.6090879537828424
Energy: 0.5816872792191261
Energy: 0.5519133267991099
Energy: 0.764591063711087
Energy: 0.5811268005401433
Energy: 0.580330188307841
Energy: 0.7653263758898301
Energy: 0.5976709740761432
Energy: 0.6473492764489643
Energy: 0.6085929148627571
Energy: 0.5508461336916534
Energy: 0.5518818473467368
Energy: 0.592620416284398
Energy: 0.576363999397407
Energy: 0.5533805959435891
Energy: 0.6135932920813266
Energy: 0.5543991574725646
Energy: 0.5528570954075265
Energy: 0.5596833782477546
Energy: 0.5820421851101597
Energy: 0.5641241723869582
Energy: 0.6088685961911374
Energy: 0.5839571407173099
Energy: 0.5846340152275343
Energy: 0.5843492390761976
Energy: 0.5812969445530821
Energy: 0.56186006681112
Energy: 0.5833197915800489
Energy: 0.5527290564915801
Energy: 0.5516148940219355
Energy: 0.5953666727356567
Energy: 0.5543904391873656
Energy: 0.5918770918822246
Energy: 0.5834690576227859
Energy: 0.5979065047321869
Energy: 0.5831852606716186
Energy: 0.5976966277916863
Energy: 0.5973955107211679
Energy: 0.5806423022821818
Energy: 0.5886859961589671
Energy: 0.5837693115981573
Energy: 0.5793058438774217
Energy: 0.5891432210317251
Energy: 0.5975346339748038
Energy: 0.6169779516659228
Energy: 0.5875869829822009
Energy: 0.550386855441567
Energy: 0.5500951841172156
Energy: 0.588153719171706
Energy: 0.5507685592338412
Energy: 0.5859844882320059
Energy: 0.5530608882073828
Energy: 0.5797057216534235
Energy: 0.5459886810636208
Energy: 0.642413286208687
Energy: 0.5954206900737027
Energy: 0.5459981630753592
Energy: 0.6135721095679101
Energy: 0.5966652737624513
Energy: 0.5948463771887025
Energy: 0.5695614829789118
Energy: 0.6652382583382892
Energy: 0.6045228124648155
Energy: 0.5469828146251232
Energy: 0.5964987007157421
Energy: 0.5961456424182247
Energy: 0.5706468491378919
Energy: 0.6657596517777082
Energy: 0.5818597383750312
Energy: 0.5538140918574322
Energy: 0.5461467494508138
Energy: 0.5461388386526407
Energy: 0.5887818389873489
Energy: 0.5746568015494604
Energy: 0.5462462750072818
Energy: 0.5623770590534726
Energy: 0.5505704453641976
Energy: 0.5501703184839849
Energy: 0.5623981950809253
Energy: 0.5507782308863581
Energy: 0.56312262568524
Energy: 0.5629566526670302
Energy: 0.563779720386591
Energy: 0.5658459367528003
Energy: 0.5634703385011411
Energy: 0.6366997995477223
Energy: 0.5457742455487085
Energy: 0.5622250543158254
Energy: 0.5889020012159638
Energy: 0.5643704985096072
Energy: 0.5646575920478039
Energy: 0.5883008665885099
Energy: 0.5648436173796848
Energy: 0.5698234389451677
Energy: 0.5661545270418551
Energy: 0.5852964261535097
Energy: 0.6062802801512422
Energy: 0.6281979222383353
Energy: 0.5853209507574505
Energy: 0.6330528696761434
Energy: 0.6403157879517277
Energy: 0.6157895760103097
Energy: 0.5490882600445934
Energy: 0.6381651051055097
Energy: 0.5806403831160838
Energy: 0.5711389281980338
Energy: 0.5522439745520541
Energy: 0.6041336430624816
Energy: 0.5675176183683046
Energy: 0.5789584669512006
Energy: 0.5870580102810797
Energy: 0.5748898668354548
Energy: 0.5987995971942895
Energy: 0.5664921274313779
Energy: 0.6045513550423375
Energy: 0.5837753633426022
Energy: 0.5892537731038014
Energy: 0.6471233808927289
Energy: 0.5586812354977763
Energy: 0.5595364764168117
Energy: 0.6477528722441404
Energy: 0.5498753550596568
Energy: 0.6148910934077038
Energy: 0.5937714116779539
Energy: 0.551417317164519
Energy: 0.5518367235968619
Energy: 0.603261556970037
Energy: 0.593863058929255
Energy: 0.5533563806376526
Energy: 0.6112212000095731
Energy: 0.5535070911138041
Energy: 0.5541981514053781
Energy: 0.5997390961973119
Energy: 0.5527690778754667
Energy: 0.5892167493719458
Energy: 0.6223194755288501
Energy: 0.5520649807067278
Energy: 0.5521351450669216
Energy: 0.6025049837515861
Energy: 0.5562252638081348
Energy: 0.5515046319435271
Energy: 0.5756944782619351
Energy: 0.552586894387812
Energy: 0.5528105976232839
Energy: 0.5478757173993669
Energy: 0.5522911012813972
Energy: 0.5525793977640839
Energy: 0.6409233139965032
Energy: 0.5518253899914776
Energy: 0.5510708382033067
Energy: 0.5972427541700678
Energy: 0.5902956382081639
Energy: 0.5509759059455105
Energy: 0.6675196388862475
Energy: 0.5514352195572324
Energy: 0.5485899006206231
Energy: 0.6680673202505591
Energy: 0.5837466635540598
Energy: 0.554855177200345
Energy: 0.7743729393338175
Energy: 0.5977231756575403
Energy: 0.5802970198262063
Energy: 0.7668521622790491
Energy: 0.5852273428575077
Energy: 0.5897500854460547
Energy: 0.5997894777829023
Energy: 0.5516009620941978
Energy: 0.5510869975837728
Energy: 0.5647712387190319
Energy: 0.5757694052284283
Energy: 0.5523822820978465
Energy: 0.8866280255131117
Energy: 0.5788006027412522
Energy: 0.5606453416567888
Energy: 0.5706097859337471
Energy: 0.576921349247838
Energy: 0.5610478713182752
Energy: 0.5796519074879599
Energy: 0.5844402795781447
Energy: 0.5847768631301735
Energy: 0.5649278159211183
Energy: 0.5773622041091309
Energy: 0.5870030069568516
Energy: 0.5718668060988282
Energy: 0.5854495687753644
Energy: 0.5688959250208798
Energy: 0.5787664520906807
Energy: 0.5894900473706564
Energy: 0.5668576334238642
Energy: 0.5721190287182233
Energy: 0.5700265674127637
Energy: 0.5734288664681947
Energy: 0.5722476017043784
Energy: 0.5978581589072856
Energy: 0.5730151819528829
Energy: 0.5712469856316053
Energy: 0.5484381174103475
Energy: 0.5506350060256173
Energy: 0.5724412229788199
Energy: 0.5495700803890379
Energy: 0.582050211260214
Energy: 0.5705266102219183
Energy: 0.5489110640057452
Energy: 0.548655433669548
Energy: 0.6058509688583382
Energy: 0.5498082588290739
Energy: 0.5519846354889372
Energy: 0.5839198724654945
Energy: 0.591694600966265
Energy: 0.6000246303930932
Energy: 0.6224893234220195
Energy: 0.5715613087555709
Energy: 0.552088456084275

minimum gb energy = 0.5457742455487085 eV
minimum distance =  2.73170977152256 Angstroms
sigma value = 81


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

Energy: 1.1207350353473389
Energy: 0.6271067196670971
Energy: 0.5686861614697403
Energy: 0.571280878086944
Energy: 0.6158995389060553
Energy: 0.6271372827541306
Energy: 0.6032296375815384
Energy: 0.5851101116042401
Energy: 0.585079311390916
Energy: 0.5964009824676134
Energy: 0.5692401428587728
Energy: 0.5829126819279188
Energy: 0.6992384123550631
Energy: 0.6028517412597402
Energy: 0.578251251383559
Energy: 0.6176880248333861
Energy: 0.5906305689020276
Energy: 0.617607011226865
Energy: 0.6593873159924898
Energy: 0.6026300478256943
Energy: 0.6764848037447586
Energy: 0.6620220426928632
Energy: 0.591050373748215
Energy: 0.5594030027714866
Energy: 0.6597063262472008
Energy: 0.5962345985899709
Energy: 0.6731893643882098
Energy: 0.6622170028596442
Energy: 0.6723496146137643
Energy: 0.6179847179569491
Energy: 0.6551582480604371
Energy: 0.6355882587877675
Energy: 0.5849179729088813
Energy: 0.6984070054506479
Energy: 0.689214975824097
Energy: 0.680301102316656
Energy: 0.6168452446628941
Energy: 0.6389861330391378
Energy: 0.6103048059747713
Energy: 0.5823045479301935
Energy: 0.6710685964374813
Energy: 0.6690656642136692
Energy: 0.6417613787983509
Energy: 0.7417165159987623
Energy: 0.6968672593471101
Energy: 0.6196700309875757
Energy: 0.7547496360102839
Energy: 0.6004733016053838
Energy: 0.6196539740372694
Energy: 0.5869288558384583
Energy: 0.5916981261479285
Energy: 0.582308988476461
Energy: 0.6035175164482823
Energy: 0.5840882697556854
Energy: 0.58972582155984
Energy: 0.5750690213994926
Energy: 0.5751185236310361
Energy: 0.5919181496685592
Energy: 0.5451325132132396
Energy: 0.5451300429032436
Energy: 0.617289181996439
Energy: 0.6023911973341568
Energy: 0.575166843644688
Energy: 0.6012852435739366
Energy: 0.5453981706243901
Energy: 0.5818797383614934
Energy: 0.6244352490751828
Energy: 0.5860829276722364
Energy: 0.5877567392691304
Energy: 0.5903031115017997
Energy: 0.5971695822005086
Energy: 0.6111315283606122
Energy: 0.6243318248097648
Energy: 0.6748786239337121
Energy: 0.6292470256380284
Energy: 0.5903226450973574
Energy: 0.6758936211030385
Energy: 0.600528728667705
Energy: 0.6092686675507395
Energy: 0.6283405000486161
Energy: 0.6282642946345235
Energy: 0.5980159581772763
Energy: 0.630650384170449
Energy: 0.6318924761049121
Energy: 0.6556402796078228
Energy: 0.6302741720569365
Energy: 0.7060797266797666
Energy: 0.6797879631368073
Energy: 0.63102120541921
Energy: 0.6802944095731616
Energy: 0.6763348506690067
Energy: 0.6579624058471626
Energy: 0.6560242461764311
Energy: 0.6765727690196232
Energy: 0.657349532719201
Energy: 0.6553118232670324
Energy: 0.7853439815966097
Energy: 0.583041004642819
Energy: 0.5974202150633449
Energy: 0.7857215858285224
Energy: 0.5827370497274581
Energy: 0.596749646318419
Energy: 0.655530812775346
Energy: 0.6674839855241959
Energy: 0.6834656963292197
Energy: 0.657140513172793
Energy: 0.6672241037178849
Energy: 0.6798337678775385
Energy: 0.5881222992967757
Energy: 0.6443541246988217
Energy: 0.5749034302924672
Energy: 0.5913127303641058
Energy: 0.6669917699597859
Energy: 0.5749837214022577
Energy: 0.5869970128913228
Energy: 0.6447088062600634
Energy: 0.5747098815046128
Energy: 0.5725431717119894
Energy: 0.6671081663149895
Energy: 0.5747383903336472
Energy: 0.6556909210505397
Energy: 0.6671257529296173
Energy: 0.6637294248216885
Energy: 0.657207304579786
Energy: 0.6769327212343068
Energy: 0.6901077299403788
Energy: 0.6710715628489459
Energy: 0.5816620935250539
Energy: 0.578273337536484
Energy: 0.6710691015932542
Energy: 0.603296371790055
Energy: 0.5779792856208348
Energy: 0.6695783041788146
Energy: 0.676646613982056
Energy: 0.681079147589274
Energy: 0.670642249897885
Energy: 0.6562612640357471
Energy: 0.6853074445521932
Energy: 0.6502427398381153
Energy: 0.6837062089730569
Energy: 0.6833085230282133
Energy: 0.6500148560465404
Energy: 0.6180180837631775
Energy: 0.683758112155944
Energy: 0.628611005415133
Energy: 0.6531543970008723
Energy: 0.6548306041410833
Energy: 0.5973917366554269
Energy: 0.6321331594910405
Energy: 0.6028153790962488
Energy: 0.7765874990674659
Energy: 0.7516109683472905
Energy: 0.653147316717191
Energy: 0.6214752239437136
Energy: 0.7515597403382953
Energy: 0.6006099684379816
Energy: 0.6419332412216602
Energy: 0.5856531612205661
Energy: 0.608084312510687
Energy: 0.6326602356049974
Energy: 0.6003167834596819
Energy: 0.6134162519049801
Energy: 0.6195347517522776
Energy: 0.5530839328845563
Energy: 0.5820873069142334
Energy: 0.6032830873325534
Energy: 0.5807124864300528
Energy: 0.5822096088255005
Energy: 0.5839173385985076
Energy: 0.5454749170740301
Energy: 0.5453551918607842
Energy: 0.5863396636083332
Energy: 0.5751588507875617
Energy: 0.5749826438664514
Energy: 0.5824568181714385
Energy: 0.5846883194164233
Energy: 0.5825800561765174
Energy: 0.5823524225353391
Energy: 0.6096209708333803
Energy: 0.5834386884717955
Energy: 0.6247633857587612
Energy: 0.6246862436570962
Energy: 0.610918618992498
Energy: 0.5905780287556204
Energy: 0.6723685733455524
Energy: 0.6003597727382078
Energy: 0.6177936340329728
Energy: 0.6651590675935535
Energy: 0.6402385256191984
Energy: 0.5827481999251953
Energy: 0.6653152761281679
Energy: 0.5877490551352242
Energy: 0.6425445198686937
Energy: 0.6794714075793563
Energy: 0.6479600070653778
Energy: 0.678380049092318
Energy: 0.6144798282819007
Energy: 0.6769886478845117
Energy: 0.6656043206120802
Energy: 0.5927902230897095
Energy: 0.6817972368251188
Energy: 0.6678798493507629
Energy: 0.6797157507770524
Energy: 0.631434519434967
Energy: 0.6642858307000823
Energy: 0.5534181474398329
Energy: 0.680540999961849
Energy: 0.6668567861456661
Energy: 0.5831513931370683
Energy: 0.5815523655208442
Energy: 0.7533412775981935
Energy: 0.5827204085015978
Energy: 0.5832373484777443
Energy: 0.7237476595065628
Energy: 0.6238265841754798
Energy: 0.7446890901503073
Energy: 0.7124883071528773
Energy: 0.5850104368403954
Energy: 0.5534487002656083
Energy: 0.5963224544755298
Energy: 0.5282993667265807
Energy: 0.5829170507704463
Energy: 0.7809794678149505
Energy: 0.5917240458577745
Energy: 0.5686105884150597
Energy: 0.5655322054150287
Energy: 0.5924650893716168
Energy: 0.6274704609290067

minimum gb energy = 0.5282993667265807 eV
minimum distance =  2.74522033879413 Angstroms
sigma value = 43


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

Energy: 0.5480156244172643
Energy: 0.69266537720744
Energy: 0.6364589979426424
Energy: 0.5667774382313687
Energy: 0.735430943786947
Energy: 0.5670958319063234
Energy: 0.5426301364327165
Energy: 0.5591292268399779
Energy: 0.5828652276501181
Energy: 0.5541559015622022
Energy: 0.6023809995557667
Energy: 0.5546972218787221
Energy: 0.5594021289757264
Energy: 0.5420252793962186
Energy: 0.5420797425382525
Energy: 0.5664600203598416
Energy: 0.5424160262082066
Energy: 0.5539622940827571
Energy: 0.5540300299921426
Energy: 0.5423224184803493
Energy: 0.5544807023504444
Energy: 0.5541789099182136
Energy: 0.5448833553805884
Energy: 0.554521931278863
Energy: 0.55472121516565
Energy: 0.5547913770920776
Energy: 0.577285594540245
Energy: 0.5543293477136315
Energy: 0.553676971175745
Energy: 0.5832683063150151
Energy: 0.5548389733736058
Energy: 0.5646585188892774
Energy: 0.5832629578143241
Energy: 0.5545469308935878
Energy: 0.5550977869726421
Energy: 0.5796861645226139
Energy: 0.5544834812407888
Energy: 0.5548362485048469
Energy: 0.5551007043159306
Energy: 0.5543054190109171
Energy: 0.5546828894367442
Energy: 0.5550110730034381
Energy: 0.6132976937924541
Energy: 0.5560448578591948
Energy: 0.5558434881941161
Energy: 0.5449716903138886
Energy: 0.5561580226442084
Energy: 0.55450352671367
Energy: 0.6019166384714153
Energy: 0.5555553298102593
Energy: 0.5558206456646371
Energy: 0.6019998624408902
Energy: 0.5552595520844273
Energy: 0.5549898332120259
Energy: 0.7363061926065372
Energy: 0.5551825894616303
Energy: 0.6018077381490876
Energy: 0.7354660702266442
Energy: 0.6056376918369403
Energy: 0.6005149397410601
Energy: 0.544657681239005
Energy: 0.5441880878892679
Energy: 0.5762593978925237
Energy: 0.5579181206533452
Energy: 0.5580282943210316
Energy: 0.5495862440175779
Energy: 0.5695918823737982
Energy: 0.5542249094029714
Energy: 0.5543359348975766
Energy: 0.5429136772969835
Energy: 0.5542703787489037
Energy: 0.5544623071092681
Energy: 0.5696926043282177
Energy: 0.553771622193691
Energy: 0.5638872083833044
Energy: 0.5445189477930045
Energy: 0.6006490053534396
Energy: 0.5639263849627264
Energy: 0.5460186419497266
Energy: 0.5538056619307384
Energy: 0.5544898922884494
Energy: 0.5583837269161916
Energy: 0.5552387740734827
Energy: 0.5468243100382889
Energy: 0.545825188217611
Energy: 0.5980219842475364
Energy: 0.566396141646632
Energy: 0.5457948106554239
Energy: 0.5901187000205226
Energy: 0.5549044478946704
Energy: 0.5454044994354071
Energy: 0.5551148492875246
Energy: 0.5445082267290232
Energy: 0.5444916409899936
Energy: 0.5667400129283279
Energy: 0.544664275774546
Energy: 0.548838016796725
Energy: 0.5482080293293029
Energy: 0.5482270458774862
Energy: 0.5486382960584183
Energy: 0.5535341978549452
Energy: 0.5482081789461035
Energy: 0.5475757938904023
Energy: 0.545506447989335
Energy: 0.5445461482342938
Energy: 0.6068154481282243
Energy: 0.5454732037726515
Energy: 0.544294173955566
Energy: 0.5571783860400792
Energy: 0.5456367231645027
Energy: 0.5457727676783053
Energy: 0.5581275556168602
Energy: 0.5462717139323991
Energy: 0.5534072930720938
Energy: 0.5565920538495801
Energy: 0.5463643691265865
Energy: 0.5461360584264326
Energy: 0.5574963335195308
Energy: 0.5462901474412957
Energy: 0.553443458091514
Energy: 0.5472282322765837
Energy: 0.5456490805107316
Energy: 0.5766214769167656
Energy: 0.6072433155046064
Energy: 0.5966288703170692
Energy: 0.5447136116688139
Energy: 0.6446717680240489
Energy: 0.5644780818260469
Energy: 0.5646735995268611
Energy: 0.6447021998107707
Energy: 0.5438652396697464
Energy: 0.6458492781432057
Energy: 0.6512228339481975
Energy: 0.5452740373919512
Energy: 0.5453791701355161
Energy: 0.6019551229340803
Energy: 0.545181367219871
Energy: 0.5452557470036853
Energy: 0.6350155348186234
Energy: 0.5470670249800155
Energy: 0.5476887339930028
Energy: 0.5439139208737781
Energy: 0.5669328736755527
Energy: 0.5474150886784515
Energy: 0.6142795366620311
Energy: 0.545220366377588
Energy: 0.544998601984702
Energy: 0.5655953917723959
Energy: 0.544981039855491
Energy: 0.544694247873991
Energy: 0.6068996332874643
Energy: 0.5459639789575329
Energy: 0.5548074829461441
Energy: 0.5550222579233828
Energy: 0.5465011433392081
Energy: 0.5543806585179198
Energy: 0.605171067087847
Energy: 0.5450524172934107
Energy: 0.5542254455121246
Energy: 0.554619418231812
Energy: 0.5628599366821829
Energy: 0.5542181582359471
Energy: 0.6067568951748469
Energy: 0.5476532224235557
Energy: 0.554723819532504
Energy: 0.555368487758771
Energy: 0.5499434807127903
Energy: 0.5542853962884342
Energy: 0.6336344706919467
Energy: 0.5537560742026414
Energy: 0.5537017774329285
Energy: 0.6339174778934973
Energy: 0.5445456126121444
Energy: 0.5538610779212416
Energy: 0.5541693905756491
Energy: 0.5590360970623457
Energy: 0.5834508287619129
Energy: 0.5541400138444519
Energy: 0.5595577451494868
Energy: 0.5554502468119761
Energy: 0.5449241953527496
Energy: 0.6409868226367333
Energy: 0.6378734110687307
Energy: 0.5646302586640306
Energy: 0.6747530335257022
Energy: 0.6346705958156728

minimum gb energy = 0.5420252793962186 eV
minimum distance =  2.65507676603484 Angstroms
sigma value = 57


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

Energy: 0.7119515373723603
Energy: 0.5837379004384762
Energy: 0.5834076186717131
Energy: 0.5431293308037533
Energy: 0.5648944987440191
Energy: 0.5837639761379325
Energy: 0.5153894774592784
Energy: 0.5639972378186038
Energy: 0.5553230155157816
Energy: 0.5650245152541289
Energy: 0.5642493697468605
Energy: 0.5402883720858727
Energy: 0.5843969940506467
Energy: 0.512751590693828
Energy: 0.512660667461141
Energy: 0.5648988480011715
Energy: 0.5126566476137334
Energy: 0.5130239408736466
Energy: 0.5542656635773738
Energy: 0.5120365213581838
Energy: 0.5124001503386105
Energy: 0.5551475546087182
Energy: 0.5120413172388867
Energy: 0.5555752309562475
Energy: 0.5548884729538985
Energy: 0.5395201712556972
Energy: 0.5386600676439683
Energy: 0.5550590981180965
Energy: 0.5376560714351647
Energy: 0.5517989975178555
Energy: 0.5404827577056011
Energy: 0.5381413874434395
Energy: 0.5378620633172037
Energy: 0.5562926073612173
Energy: 0.5390462969705491
Energy: 0.5370028301712643
Energy: 0.5657466775853894
Energy: 0.5553078115026843
Energy: 0.5561297105707063
Energy: 0.564982777924861
Energy: 0.5547053042579876
Energy: 0.5509566816569395
Energy: 0.5806235482680326
Energy: 0.5518563733941091
Energy: 0.562922846129114
Energy: 0.5544950752076061
Energy: 0.5647007672672065
Energy: 0.5612541206182908
Energy: 0.5637850449140056
Energy: 0.5552897923344045
Energy: 0.5564198519040815
Energy: 0.5641389258302005
Energy: 0.557334072174278
Energy: 0.541549723296914
Energy: 0.566058699605721
Energy: 0.5518026383203923
Energy: 0.5517524398638327
Energy: 0.5664733803652205
Energy: 0.551278901908048
Energy: 0.5517528968885329
Energy: 0.5868177289076978
Energy: 0.5393142532170356
Energy: 0.5508178936061344
Energy: 0.5673853441904027
Energy: 0.5540865791822592
Energy: 0.5546727361059165
Energy: 0.511993540035958
Energy: 0.5673289837256877
Energy: 0.5543596859306663
Energy: 0.5136284207137229
Energy: 0.5684155047932672
Energy: 0.5871895813445605
Energy: 0.5121234835661154
Energy: 0.571738482179692
Energy: 0.5877297869509882
Energy: 0.5391457293217882
Energy: 0.5684337076336331
Energy: 0.5879146184784759
Energy: 0.5953314360407279
Energy: 0.5599921810626406
Energy: 0.5389201902306388
Energy: 0.5643232964528417
Energy: 0.5654806039260936
Energy: 0.5553654765814016
Energy: 0.5637521072677815
Energy: 0.5119052438194739
Energy: 0.5127288546913908
Energy: 0.5639019717380968
Energy: 0.5155903549764479
Energy: 0.5177899683498801
Energy: 0.5543137569199128
Energy: 0.548585923773369
Energy: 0.5488481461200279
Energy: 0.5542385823331547
Energy: 0.5495940248662308
Energy: 0.5528526276139992
Energy: 0.5584536413021741
Energy: 0.5382196971798455
Energy: 0.5377007338398904
Energy: 0.5577413021350289
Energy: 0.5388284817075663
Energy: 0.550194755000351
Energy: 0.5581955961475481
Energy: 0.5501837374846329
Energy: 0.5375143957836521
Energy: 0.538093133090702
Energy: 0.5552442147603601
Energy: 0.5379182571760593
Energy: 0.565107226241833
Energy: 0.5566383694437899
Energy: 0.557134723562594
Energy: 0.538735829918062
Energy: 0.555949763025282
Energy: 0.5563867940710686
Energy: 0.5649710502298159
Energy: 0.5561737166233178
Energy: 0.5562468204478138
Energy: 0.5654118569227559
Energy: 0.5560986606495546
Energy: 0.5561611558260974
Energy: 0.5658088325318368
Energy: 0.5609947750901929
Energy: 0.5510253650297835
Energy: 0.565955045775848
Energy: 0.5609153613811305
Energy: 0.5492870990016319
Energy: 0.5604583541728744
Energy: 0.5524048260174146
Energy: 0.5547456446575622
Energy: 0.5614053713623409
Energy: 0.5525105589777365
Energy: 0.5653085495827566
Energy: 0.5955553956688908
Energy: 0.5583084373513765
Energy: 0.5606302942975786
Energy: 0.5638291606617325
Energy: 0.5653815618327287
Energy: 0.5576312503162346
Energy: 0.5119014985016238
Energy: 0.5736279628323006
Energy: 0.5878096603644271
Energy: 0.5391142375556264
Energy: 0.5676332824735609
Energy: 0.5879735782021327

minimum gb energy = 0.5119014985016238 eV
minimum distance =  2.7022858510387 Angstroms
sigma value = 17


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

Energy: 0.5148661473775713
Energy: 0.6374660837391298
Energy: 0.6373123740766578
Energy: 0.5468917368636625
Energy: 0.5755426258138082
Energy: 0.5473362763732121
Energy: 0.5475199067470924
Energy: 0.6233749785735384
Energy: 0.6237916323097715
Energy: 0.6255363183157404
Energy: 0.6246327569851846
Energy: 0.5746887769396276
Energy: 0.5648789685181768
Energy: 0.5481256483799687
Energy: 0.54829558991711
Energy: 0.6012062937933181
Energy: 0.5473338822393483
Energy: 0.5481323922988253
Energy: 0.6033560840267612
Energy: 0.5484068985081795
Energy: 0.5480850263772546
Energy: 0.6038305774964379
Energy: 0.5134009723548814
Energy: 0.601540622282526
Energy: 0.5370038467007667
Energy: 0.5527417859842078
Energy: 0.549159315226982
Energy: 0.536296232909492
Energy: 0.5296175733719884
Energy: 0.5498422286306768
Energy: 0.5661326970210951
Energy: 0.5333043141750795
Energy: 0.5315107710765488
Energy: 0.5104599907651342
Energy: 0.5338578127877001
Energy: 0.5105036157865002
Energy: 0.5291538215347062
Energy: 0.5281640145000002
Energy: 0.5281734514365468
Energy: 0.5298737989176555
Energy: 0.528139993254979
Energy: 0.5350372784119427
Energy: 0.5610341231761431
Energy: 0.5387280826058269
Energy: 0.5389414378022659
Energy: 0.5413076488209799
Energy: 0.5395245359753412
Energy: 0.5376460304960085
Energy: 0.5307113236086856
Energy: 0.5405507887616235
Energy: 0.533551235135573
Energy: 0.5317088088003808
Energy: 0.5330535056302106
Energy: 0.5288261367482744
Energy: 0.5337487109446925
Energy: 0.5339487050102278
Energy: 0.5537394117467207
Energy: 0.5338648717284665
Energy: 0.5513041987597765
Energy: 0.5537475087368092
Energy: 0.6333024838365368
Energy: 0.5749597537771278
Energy: 0.549942750716748
Energy: 0.552039621057936
Energy: 0.5364696479212654
Energy: 0.5499455083083622
Energy: 0.5362742518717997
Energy: 0.5599434363399902
Energy: 0.623896971728727
Energy: 0.535728134108546
Energy: 0.6233555716210502
Energy: 0.6053489424548626
Energy: 0.5360819693232054
Energy: 0.6017013621643265
Energy: 0.6022899597752266
Energy: 0.5307518592411793
Energy: 0.6011769156001913
Energy: 0.6029196407698428
Energy: 0.6267151728001749
Energy: 0.6251317054894328
Energy: 0.5350338989884295
Energy: 0.6248076640518017
Energy: 0.6247597503138644
Energy: 0.5743715039328298
Energy: 0.6167712222476196
Energy: 0.5930007957488613
Energy: 0.6123395609285385
Energy: 0.616843408385245
Energy: 0.5927710821696279
Energy: 0.6126143965683307
Energy: 0.5647304880103429
Energy: 0.6400687273418623
Energy: 0.5752134028170823
Energy: 0.6249042910772951
Energy: 0.6310744843017632
Energy: 0.6234829797229768
Energy: 0.5071066774942017
Energy: 0.603206342204927
Energy: 0.6382993179143894
Energy: 0.5070434278054088
Energy: 0.6028158981264446
Energy: 0.6413046748997425

minimum gb energy = 0.5070434278054088 eV
minimum distance =  2.67388289300961 Angstroms
sigma value = 17


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

Energy: 0.5016699043750587
Energy: 0.6717582977735213
Energy: 0.5804794443705973
Energy: 0.542307832407332
Energy: 0.5489030702675884
Energy: 0.581171233622102
Energy: 0.6758369774300023
Energy: 0.6310213732837651
Energy: 0.5427881436472886
Energy: 0.627457338382919
Energy: 0.6329256956755284
Energy: 0.5726165804795978
Energy: 0.7319095494743177
Energy: 0.49221463352573563
Energy: 0.5537740731773694
Energy: 0.636860636297518
Energy: 0.4919769625739897
Energy: 0.561874349793163
Energy: 0.6341300862759179
Energy: 0.5614448665584914
Energy: 0.5615639879280254
Energy: 0.6353317963580966
Energy: 0.5004351545020319
Energy: 0.5608294811348589
Energy: 0.5391901466847812
Energy: 0.5315705963844253
Energy: 0.5427390063330463
Energy: 0.5392036598073
Energy: 0.5326565967679391
Energy: 0.5303279764928855
Energy: 0.47943396191986964
Energy: 0.530891661181855
Energy: 0.498999815086577
Energy: 0.49211781980259883
Energy: 0.5309495342928543
Energy: 0.49388265288200467
Energy: 0.48882614884145426
Energy: 0.5298140976769704
Energy: 0.5296951698035776
Energy: 0.5103360559898459
Energy: 0.5333293282839198
Energy: 0.5155540441516728
Energy: 0.4893618977753576
Energy: 0.4995193058283196
Energy: 0.49355450689995745
Energy: 0.5074799938391671
Energy: 0.4985489899616806
Energy: 0.5019813614165833
Energy: 0.4895842439594807
Energy: 0.5022985186863811
Energy: 0.4899072734562404
Energy: 0.49073850026411764
Energy: 0.499857653642447
Energy: 0.48854437198936296
Energy: 0.48917986769130134
Energy: 0.500694805317789
Energy: 0.5011247888020312
Energy: 0.48931029524900355
Energy: 0.4999625123281994
Energy: 0.5008824279973484
Energy: 0.5049586811155647
Energy: 0.48943082688374623
Energy: 0.49956549734152206
Energy: 0.4995499106725969
Energy: 0.4893145661797076
Energy: 0.4999172659749959
Energy: 0.49165440157126616
Energy: 0.4889755007399324
Energy: 0.48857456314323494
Energy: 0.4921030973310513
Energy: 0.4935835639297514
Energy: 0.5022503593232159
Energy: 0.5099672422233048
Energy: 0.5038082633009447
Energy: 0.5049887158199639
Energy: 0.5049374050115507
Energy: 0.5043355791778578
Energy: 0.5036419687299112
Energy: 0.5302000811060299
Energy: 0.5060397736742538
Energy: 0.5092701769998769
Energy: 0.5312245804897259
Energy: 0.5302598302542739
Energy: 0.5298293454622288
Energy: 0.5306338269356043
Energy: 0.5091619233792157
Energy: 0.49863253419101305
Energy: 0.5307441677814673
Energy: 0.5067340531990905
Energy: 0.5190091994646607
Energy: 0.6949716657776361
Energy: 0.5535540430372788
Energy: 0.5410178513045214
Energy: 0.5313927594906591
Energy: 0.5393698905086218
Energy: 0.5398655170097447
Energy: 0.4891814351176327
Energy: 0.6311400101426612
Energy: 0.6318502451251483
Energy: 0.49034638802511366
Energy: 0.6365711944924519
Energy: 0.5295764516579617
Energy: 0.48982142288561875
Energy: 0.6312062709917219
Energy: 0.6318332136633719
Energy: 0.4913041484279995
Energy: 0.6359059323871545
Energy: 0.5280846497363785
Energy: 0.7062664789872743
Energy: 0.6264375623539822
Energy: 0.583627497014407
Energy: 0.632508377347479
Energy: 0.5423211413061977
Energy: 0.5389258244097997
Energy: 0.5248017945116248
Energy: 0.537427226536832
Energy: 0.5375259061738636
Energy: 0.5853097299272053
Energy: 0.5374129215505224
Energy: 0.604734053124896
Energy: 0.7369358028826871
Energy: 0.6316304651110402
Energy: 0.5414963433879957
Energy: 0.6332120911859711
Energy: 0.6321068060111228
Energy: 0.6267381447200867
Energy: 0.4979633850280193
Energy: 0.6317697787675282
Energy: 0.6851654985485383
Energy: 0.5491190429653906
Energy: 0.6314490604668167
Energy: 0.5619515590647772
Energy: 0.5007453927834116
Energy: 0.6311433969461152
Energy: 0.6309649788395439
Energy: 0.5012360573940094
Energy: 0.6350904669444208
Energy: 0.6122027300169924
Energy: 0.7322995262346688
Energy: 0.501187951682187
Energy: 0.5397944028610032
Energy: 0.6321543040557848
Energy: 0.49791388847282725
Energy: 0.6304518241684157
Energy: 0.6319232190376252
Energy: 0.500945285610156
Energy: 0.5541587594616738
Energy: 0.6320287047791178
Energy: 0.4970404853380247
Energy: 0.5618289100108922
Energy: 0.54060280515539
Energy: 0.5315599639547464
Energy: 0.5425720858299732
Energy: 0.5404813015953349
Energy: 0.5352079491959143
Energy: 0.5814301768206567
Energy: 0.47934641216720275
Energy: 0.5459272977423106
Energy: 0.5827266670744513
Energy: 0.48780739041548943
Energy: 0.5352099254901587
Energy: 0.4966459706396071
Energy: 0.48229674721923715
Energy: 0.5360075826758689
Energy: 0.5297316677389358
Energy: 0.48264824877552975
Energy: 0.5321569165111426
Energy: 0.5295254518411353
Energy: 0.490104827373915
Energy: 0.5047594528709084
Energy: 0.5054149622421066
Energy: 0.5026525377884181
Energy: 0.4989540696372882
Energy: 0.503771617209895
Energy: 0.48851348922680177
Energy: 0.49904391756945
Energy: 0.49378810201158524
Energy: 0.4887195089584676
Energy: 0.49825301744522144
Energy: 0.5043570250722008
Energy: 0.49364839091919166
Energy: 0.49790270619861815
Energy: 0.49810960509482033
Energy: 0.4949123426724791
Energy: 0.4979387329806052
Energy: 0.4950885542424419
Energy: 0.5014313626032794
Energy: 0.49782791803814713
Energy: 0.49787508603424585
Energy: 0.49814447383308036
Energy: 0.4974308929472462
Energy: 0.49837350609542513
Energy: 0.49801835956000334
Energy: 0.49454523846879545
Energy: 0.48886604584271204
Energy: 0.49970107369702005
Energy: 0.4901214783455825
Energy: 0.48836941083670227
Energy: 0.48942471863464243
Energy: 0.5127342072209574
Energy: 0.5078649259384408
Energy: 0.5038716008859039
Energy: 0.49001104880140023
Energy: 0.5028501926077849
Energy: 0.5366864796890606
Energy: 0.5034312128066629
Energy: 0.5073405189236789
Energy: 0.5300933040191832
Energy: 0.5046271898293684
Energy: 0.5038958759620954
Energy: 0.5374711723509642
Energy: 0.4965584464579168
Energy: 0.540486895032022
Energy: 0.529889522067889
Energy: 0.49535814464715366
Energy: 0.530949850102845
Energy: 0.6830473796811294
Energy: 0.5410508435499475
Energy: 0.5170410286660575
Energy: 0.5343662106781132
Energy: 0.49294624089131517
Energy: 0.5398528872801666
Energy: 0.4940240270346191
Energy: 0.630627591551251
Energy: 0.5292540209052776
Energy: 0.552192198332623
Energy: 0.6325430984822616
Energy: 0.5400858310446223
Energy: 0.48915481922685194
Energy: 0.6074163990700532
Energy: 0.5339659863201286
Energy: 0.5276587246269778
Energy: 0.6172211222705108
Energy: 0.5337845132858701
Energy: 0.6173144589316236
Energy: 0.6311204416400951
Energy: 0.6314979572254242
Energy: 0.5403816699223325
Energy: 0.6343650498099912
Energy: 0.5812029127437526
Energy: 0.7086397305323034
Energy: 0.5318629962580287
Energy: 0.5910093922240959
Energy: 0.6315202114997832
Energy: 0.5319606507436254
Energy: 0.6137377306329432
Energy: 0.7320546254553166
Energy: 0.5869783244997739
Energy: 0.527851798315655
Energy: 0.632938621771708
Energy: 0.5395837392074925
Energy: 0.6311597374666714
Energy: 0.5017672790025121
Energy: 0.6309711033441695
Energy: 0.6317187148795055
Energy: 0.5025738923427376
Energy: 0.6339227229577731
Energy: 0.6123094001609937

minimum gb energy = 0.47934641216720275 eV
minimum distance =  2.68374836916442 Angstroms
sigma value = 57


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

Energy: 0.4620527991425628
Energy: 0.5953162461277289
Energy: 0.5596893498380631
Energy: 0.46941523512947353
Energy: 0.775628276082227
Energy: 0.560263967127142
Energy: 0.6678493944398803
Energy: 0.5294261652203087
Energy: 0.5102047526782494
Energy: 0.6280181835560112
Energy: 0.6210545639621678
Energy: 0.5015436605853929
Energy: 0.693870861474318
Energy: 0.4694498570282106
Energy: 0.4692854795617524
Energy: 0.6262198001381365
Energy: 0.4898765544159381
Energy: 0.5472369558358863
Energy: 0.6215739372712498
Energy: 0.4691772541358275
Energy: 0.5474836597201894
Energy: 0.6221575543223283
Energy: 0.4613174077417882
Energy: 0.5583012578657796
Energy: 0.5185646591064839
Energy: 0.5315279297182409
Energy: 0.5114071213915623
Energy: 0.5193439816699922
Energy: 0.5286155851686328
Energy: 0.508784109326175
Energy: 0.44939926529019414
Energy: 0.5262855116252323
Energy: 0.47822950958414556
Energy: 0.47711988887814794
Energy: 0.5263235528825698
Energy: 0.4701509324906143
Energy: 0.5631140660745629
Energy: 0.5330768697593504
Energy: 0.5257204248125584
Energy: 0.48463900556057743
Energy: 0.5293098088558874
Energy: 0.47478729524738705
Energy: 0.6264825057584674
Energy: 0.4644901967299998
Energy: 0.4643677766937604
Energy: 0.48672535352467594
Energy: 0.4643005346199948
Energy: 0.47316293099752965
Energy: 0.4798280067888459
Energy: 0.4859897464943554
Energy: 0.4765538069270986
Energy: 0.47959510252889526
Energy: 0.48190190761072155
Energy: 0.47652727782285276
Energy: 0.47715982496697373
Energy: 0.4618677495892831
Energy: 0.46198257350248506
Energy: 0.47725577460605556
Energy: 0.4616653689033231
Energy: 0.46167498416943115
Energy: 0.45997861839448656
Energy: 0.4545750650837854
Energy: 0.45998047705663725
Energy: 0.4585639075714736
Energy: 0.4545509997718046
Energy: 0.46004775567207085
Energy: 0.4805176770424883
Energy: 0.46253504353462116
Energy: 0.4543896346406521
Energy: 0.468113496886252
Energy: 0.45862935004491506
Energy: 0.46215796429557277
Energy: 0.4556466458259261
Energy: 0.46049138535289985
Energy: 0.4638608453441361
Energy: 0.4607741027722305
Energy: 0.492524432505564
Energy: 0.46346938593274106
Energy: 0.45594806049579023
Energy: 0.45953671240857125
Energy: 0.45475595095116367
Energy: 0.45746708887242066
Energy: 0.4722901738532021
Energy: 0.4545841040812967
Energy: 0.4547421001983158
Energy: 0.4690562543230099
Energy: 0.468014876646939
Energy: 0.45490067256353445
Energy: 0.46927645031186827
Energy: 0.464048497271341
Energy: 0.4907771295502392
Energy: 0.47671282925336383
Energy: 0.46401838243167165
Energy: 0.4663868022945426
Energy: 0.48702498881007267
Energy: 0.4639324450102463
Energy: 0.45599086500239894
Energy: 0.4862666260520397
Energy: 0.4764850016156138
Energy: 0.48440131545707305
Energy: 0.48299491754303464
Energy: 0.48633565575588383
Energy: 0.45743485579481113
Energy: 0.48711660269036117
Energy: 0.48166818617092066
Energy: 0.45833700808079236
Energy: 0.48582472450218483
Energy: 0.4744012782860948
Energy: 0.5271496095014545
Energy: 0.48576506364355315
Energy: 0.5117963266139172
Energy: 0.5277927176843676
Energy: 0.49302140708213
Energy: 0.526038967079231
Energy: 0.5932630793612547
Energy: 0.48304389992687435
Energy: 0.4894987210081537
Energy: 0.5244685131185816
Energy: 0.4776854189469275
Energy: 0.504798613637895
Energy: 0.6678757987062132
Energy: 0.5456954561156754
Energy: 0.4913123943436454
Energy: 0.5284553512414932
Energy: 0.5332852149303056
Energy: 0.5256110976746892
Energy: 0.45515258095306255
Energy: 0.6310534419784483
Energy: 0.5263328529967312
Energy: 0.4693339413610811
Energy: 0.6284777645516624
Energy: 0.5163877439815552
Energy: 0.532915932250853
Energy: 0.6253268235169471
Energy: 0.6056453464360037
Energy: 0.5337889745721845
Energy: 0.6224269932807339
Energy: 0.6054338747797682
Energy: 0.6582508964361307
Energy: 0.5269424658844466
Energy: 0.5085394068426976
Energy: 0.5306781874007698
Energy: 0.47620643193569295
Energy: 0.5287998420482044
Energy: 0.7051979530626543
Energy: 0.5062846847424095
Energy: 0.5238265909718437
Energy: 0.6059822944323744
Energy: 0.5059827718258555
Energy: 0.5804828111832999
Energy: 0.6498882539984887
Energy: 0.6253101204394863
Energy: 0.6076576201292665
Energy: 0.6228322541404291
Energy: 0.6235598139371535
Energy: 0.5094851397756002
Energy: 0.46032697580156395
Energy: 0.565312453104379
Energy: 0.5596293153888873
Energy: 0.47000538347987364
Energy: 0.6286672204047081
Energy: 0.5601922949711137

minimum gb energy = 0.44939926529019414 eV
minimum distance =  2.67668674071513 Angstroms
sigma value = 43


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

Energy: 0.4042914225256547
Energy: 0.5163497738516626
Energy: 0.5087437604638768
Energy: 0.4258568080456434
Energy: 0.5598393231383996
Energy: 0.42473852293426156
Energy: 0.5842526859395846
Energy: 0.43181128255774814
Energy: 0.4324231763509432
Energy: 0.554259898523095
Energy: 0.4825832493193582
Energy: 0.41544201428435995
Energy: 0.6162308364977077
Energy: 0.41028183835252774
Energy: 0.40971336323533797
Energy: 0.5112951650542229
Energy: 0.41018306086291995
Energy: 0.43434887931722416
Energy: 0.5363617340428516
Energy: 0.4095905682821803
Energy: 0.43444226704385064
Energy: 0.47129304496278207
Energy: 0.4457251165258298
Energy: 0.48856878666124093
Energy: 0.47998637328349913
Energy: 0.4306291714630712
Energy: 0.420587626961648
Energy: 0.4579891220076507
Energy: 0.48341129960025375
Energy: 0.42846402941909834
Energy: 0.3890555047795194
Energy: 0.4817988821672872
Energy: 0.4071939674967852
Energy: 0.4020199868126128
Energy: 0.48136168432057513
Energy: 0.4177124962559725
Energy: 0.5579845945581535
Energy: 0.4815229700745149
Energy: 0.481503561338165
Energy: 0.4299903556984268
Energy: 0.4816805115157063
Energy: 0.4053972366762279
Energy: 0.5574747115494505
Energy: 0.39021850236540007
Energy: 0.3962568801211759
Energy: 0.39946926285619816
Energy: 0.39041148603863207
Energy: 0.39599512776760637
Energy: 0.43919615219161506
Energy: 0.396507903303622
Energy: 0.43711305550844476
Energy: 0.4407114117389195
Energy: 0.3992488780060184
Energy: 0.4369647262077795
Energy: 0.42096571759726786
Energy: 0.386899251146819
Energy: 0.38681361161959965
Energy: 0.4382004430052663
Energy: 0.38918737099682643
Energy: 0.3878750841412255
Energy: 0.3850075111603914
Energy: 0.4102134818334454
Energy: 0.38739230094730454
Energy: 0.3822956673574363
Energy: 0.41013892093961096
Energy: 0.3841777507878579
Energy: 0.43751270211770227
Energy: 0.41011093079411304
Energy: 0.41036660773512873
Energy: 0.38604639176745875
Energy: 0.4102215451473353
Energy: 0.3851946986264934
Energy: 0.5291943772096348
Energy: 0.40730986538161906
Energy: 0.379144788834265
Energy: 0.4334902142476615
Energy: 0.37817877648151077
Energy: 0.3864612597702404
Energy: 0.3943308843319459
Energy: 0.3946503069135068
Energy: 0.3942009450261822
Energy: 0.3957421338961489
Energy: 0.387171015872933
Energy: 0.39433711956481593
Energy: 0.3950311613892635
Energy: 0.377788556636036
Energy: 0.37987350370679446
Energy: 0.39461745926414976
Energy: 0.37838213392568987
Energy: 0.38033184340823517
Energy: 0.38804416571456485
Energy: 0.3868919080546221
Energy: 0.3873984001584574
Energy: 0.3775498528390153
Energy: 0.38679956109264085
Energy: 0.37701052768014837
Energy: 0.39694791756932624
Energy: 0.38687979678900797
Energy: 0.3870338689486185
Energy: 0.3953692927059088
Energy: 0.3867736460626068
Energy: 0.3791588260337562
Energy: 0.4207505127241514
Energy: 0.3814523197958852
Energy: 0.38108264538790215
Energy: 0.3872608318627941
Energy: 0.37927445465749665
Energy: 0.3806745875455171
Energy: 0.3865219681754492
Energy: 0.3904369493702613
Energy: 0.3871773565506262
Energy: 0.3877769718651509
Energy: 0.44779418765327167
Energy: 0.3868835001288003
Energy: 0.3877157895391144
Energy: 0.38521181633602963
Energy: 0.38492256481568066
Energy: 0.3876320846407738
Energy: 0.38552336011728006
Energy: 0.38481279627630743
Energy: 0.41313451331539636
Energy: 0.39444786883446786
Energy: 0.3944835047634376
Energy: 0.3834187815819704
Energy: 0.3943830402073044
Energy: 0.38463242344835674
Energy: 0.388064206085756
Energy: 0.39432960175714643
Energy: 0.39448721027542144
Energy: 0.3809702654036821
Energy: 0.3944012504551225
Energy: 0.3794328431123625
Energy: 0.4098985583665179
Energy: 0.37962881263694725
Energy: 0.37940149552678587
Energy: 0.4112499514538461
Energy: 0.380412318516249
Energy: 0.3818032562192322
Energy: 0.4104982327651445
Energy: 0.4056843372278269
Energy: 0.4098883682667607
Energy: 0.4118200831130806
Energy: 0.39429055863440116
Energy: 0.41009533782980734
Energy: 0.5414041125664397
Energy: 0.41119638502456
Energy: 0.3887990664170537
Energy: 0.4188482317028315
Energy: 0.3841198000593171
Energy: 0.40177566576165513
Energy: 0.5032182471336699
Energy: 0.437627213081411
Energy: 0.43747515282775123
Energy: 0.39020082416836716
Energy: 0.43762103804139457
Energy: 0.3876223776562451
Energy: 0.3872139481903879
Energy: 0.43732816066551905
Energy: 0.4278680864929921
Energy: 0.38950360793297595
Energy: 0.4372447727377445
Energy: 0.39270431568998637
Energy: 0.4348655507901474
Energy: 0.4094335514126024
Energy: 0.39502688157822796
Energy: 0.45248874602708544
Energy: 0.42996756807929704
Energy: 0.40569470404848157
Energy: 0.4833240614501852
Energy: 0.4007650055883477
Energy: 0.48142375799088266
Energy: 0.4845770506747587
Energy: 0.409990360153006
Energy: 0.4811247350632946
Energy: 0.5732864695116103
Energy: 0.40065136166616616
Energy: 0.4035300136756155
Energy: 0.4663524322106714
Energy: 0.40047393513385077
Energy: 0.4036913572692822
Energy: 0.5742307846396969
Energy: 0.46595154863241733
Energy: 0.4662870572686742
Energy: 0.48249196591583
Energy: 0.4697104210649754
Energy: 0.46423340147566916
Energy: 0.39579317476889747
Energy: 0.5041758122168938
Energy: 0.4524395487967825
Energy: 0.41823369168315444
Energy: 0.51027406789855
Energy: 0.42361767808179657
Energy: 0.5358995585177149
Energy: 0.4913725066912353
Energy: 0.46904443577640104
Energy: 0.4822560769528609
Energy: 0.5124067180523372
Energy: 0.46403277413791216
Energy: 0.5743862556926363
Energy: 0.4314782874070262
Energy: 0.45507000706144657
Energy: 0.4712608443850849
Energy: 0.41482097765177306
Energy: 0.512518799421675
Energy: 0.6151606128201625
Energy: 0.4182957956416496
Energy: 0.4432957772582524
Energy: 0.5031919781640007
Energy: 0.41773912065758456
Energy: 0.466438894046316
Energy: 0.5842527111005839
Energy: 0.46919299144582927
Energy: 0.46899571884032504
Energy: 0.482277979266685
Energy: 0.5121383695749656
Energy: 0.42744250835569375

minimum gb energy = 0.37701052768014837 eV
minimum distance =  2.70220423473908 Angstroms
sigma value = 81


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

Energy: 0.011178549160113412
Energy: 0.04293926689903404
Energy: 0.011487517766718382
Energy: 0.01333682846698301
Energy: 0.011983577287556677
Energy: 0.011749227114232213
Energy: 0.0438291980072105
Energy: 0.01207195911936688
Energy: 0.01187638092310598
Energy: 0.04233500703805537
Energy: 0.012297978112689291
Energy: 0.011774508124980031
Energy: 0.04214940280611091
Energy: 0.011849114739606077
Energy: 0.011690048071658335
Energy: 0.04207701764507788
Energy: 0.011643011422311472
Energy: 0.04307800751026627
Energy: 0.014659904042511017
Energy: 0.01181023450844842
Energy: 0.012334200776036697
Energy: 0.011786181174266445
Energy: 0.011759145682587442
Energy: 0.043324511253966844
Energy: 0.0429168944139183
Energy: 0.04223886530678642
Energy: 0.0423593956064583
Energy: 0.043612688472315385
Energy: 0.04215119220994506
Energy: 0.042362885685088385
Energy: 0.012240393213781018
Energy: 0.011828556019777137
Energy: 0.011745231344177536
Energy: 0.013517707748720654
Energy: 0.012440933647037545
Energy: 0.011935213576106999
Energy: 0.04253372817660524
Energy: 0.01185537211436183
Energy: 0.01234621173264219
Energy: 0.04213722525072106
Energy: 0.012149231367046653
Energy: 0.01188823173273369
Energy: 0.04227611468225651
Energy: 0.011682004217200082
Energy: 0.01183786395260317
Energy: 0.042209017336193276
Energy: 0.01172515071872786
Energy: 0.043667624718174175
Energy: 0.013032797327756869
Energy: 0.011753060367239537
Energy: 0.043458724868592355
Energy: 0.013600602403258461
Energy: 0.011821159936562705
Energy: 0.044480526149350996
Energy: 0.011910290036109897
Energy: 0.04213963003375566
Energy: 0.04218384714460639
Energy: 0.011543645561571893
Energy: 0.04215025678989092
Energy: 0.04222879258746024

minimum gb energy = 0.011178549160113412 eV
minimum distance =  2.84881406888131 Angstroms
sigma value = 3


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

Energy: 0.4974170155605779
Energy: 0.5105365859665791
Energy: 0.5264927763068216
Energy: 0.421591870487359
Energy: 0.4821640604567529
Energy: 0.4271526916709684
Energy: 0.5084740211417045
Energy: 0.4605551712254522
Energy: 0.46073957924243164
Energy: 0.5015318063903398
Energy: 0.48038438382437215
Energy: 0.46554750887327834
Energy: 0.5066458685647314
Energy: 0.44734182414373574
Energy: 0.4117002560020378
Energy: 0.5006794644599212
Energy: 0.4090332663233561
Energy: 0.4949045687276089
Energy: 0.4626423483075157
Energy: 0.4102930882086643
Energy: 0.41149458322173643
Energy: 0.46015569806564005
Energy: 0.4084334044159122
Energy: 0.47215352275634964
Energy: 0.4182180459396041
Energy: 0.46331899559171036
Energy: 0.46600217820590484
Energy: 0.41807259630510857
Energy: 0.47947766784192203
Energy: 0.4464477303087772
Energy: 0.40752937225450275
Energy: 0.44119029495841106
Energy: 0.45173973728204975
Energy: 0.38516060595780305
Energy: 0.440318649863264
Energy: 0.41005630522801384
Energy: 0.47401236680882525
Energy: 0.42646157025400216
Energy: 0.4261152665846858
Energy: 0.4733645820936346
Energy: 0.430593613369592
Energy: 0.48178734624500275
Energy: 0.4587678096331943
Energy: 0.39046184984693105
Energy: 0.4177382888111657
Energy: 0.4589269663979856
Energy: 0.36637590796398256
Energy: 0.42338163797422135
Energy: 0.39173598858113345
Energy: 0.46455803727339773
Energy: 0.4852754943648329
Energy: 0.4333383260260261
Energy: 0.3898228322522768
Energy: 0.41711382405100345
Energy: 0.3955134787803894
Energy: 0.4278346076893373
Energy: 0.42719942692706575
Energy: 0.39595152219414437
Energy: 0.4286969487136409
Energy: 0.42646346785347583
Energy: 0.3717100535404663
Energy: 0.4283193659067336
Energy: 0.42909538569628675
Energy: 0.3708874793078856
Energy: 0.37629991312719696
Energy: 0.39175494753210294
Energy: 0.3987263828194065
Energy: 0.3941802758673964
Energy: 0.4733945471531621
Energy: 0.3983106541590023
Energy: 0.4227724187967593
Energy: 0.39477511544677807
Energy: 0.4086706596795795
Energy: 0.40601126796330006
Energy: 0.39716642784392875
Energy: 0.40088847993315596
Energy: 0.36075070705664464
Energy: 0.4053865327870456
Energy: 0.3649264688425835
Energy: 0.3749078383414331
Energy: 0.457116449328052
Energy: 0.39837505095129466
Energy: 0.3737191620215457
Energy: 0.45860660790245805
Energy: 0.3969607301302946
Energy: 0.37485302531003234
Energy: 0.37426091369543096
Energy: 0.36322316755220446
Energy: 0.3761970848624062
Energy: 0.3742466304162793
Energy: 0.3635712889388732
Energy: 0.3749509775553468
Energy: 0.4440680466347114
Energy: 0.36425832058967783
Energy: 0.4475232945618842
Energy: 0.4451551155251461
Energy: 0.36539570800686655
Energy: 0.44623287829971836
Energy: 0.44454241159310565
Energy: 0.36513347712135974
Energy: 0.3764843610178087
Energy: 0.3624570006095225
Energy: 0.3632062414689652
Energy: 0.43902689153747604
Energy: 0.44046340779833304
Energy: 0.36337645362609255
Energy: 0.3646958910237355
Energy: 0.36527144283768875
Energy: 0.45129892862588816
Energy: 0.364880076137609
Energy: 0.43732654245852254
Energy: 0.36441031952195563
Energy: 0.3642522374049466
Energy: 0.44019978931926507
Energy: 0.4463662137821439
Energy: 0.36232764576909315
Energy: 0.36203515015847637
Energy: 0.3981865484759932
Energy: 0.36479750568962893
Energy: 0.3622542161441405
Energy: 0.4444123498603962
Energy: 0.44407355220310346
Energy: 0.44567216265353166
Energy: 0.4017084155249334
Energy: 0.41438846020402054
Energy: 0.44542375283860947
Energy: 0.37982350119023517
Energy: 0.44395470942842413
Energy: 0.37742999563895835
Energy: 0.38071506578546804
Energy: 0.4446331548401334
Energy: 0.376132439956858
Energy: 0.37326682391546834
Energy: 0.46003901524294827
Energy: 0.4605919718827128
Energy: 0.37321594638140215
Energy: 0.3988792030197902
Energy: 0.4569024157011159
Energy: 0.3681349248222467
Energy: 0.40520857787425385
Energy: 0.40613140413217264
Energy: 0.3660985247473188
Energy: 0.40435449290958375
Energy: 0.3816577536386346
Energy: 0.37424671239784996
Energy: 0.3961476324078459
Energy: 0.39524733990525196
Energy: 0.37457137736348295
Energy: 0.39817727565606553
Energy: 0.3947727697058297
Energy: 0.37490026186737524
Energy: 0.38157601231002675
Energy: 0.406783268527286
Energy: 0.3745911570907819
Energy: 0.40843027134456644
Energy: 0.4261404106635888
Energy: 0.42801933394489333
Energy: 0.46034713060348925
Energy: 0.4081676368393843
Energy: 0.4278408761663202
Energy: 0.3812159223716715
Energy: 0.42751638406671416
Energy: 0.405797159166343
Energy: 0.44714300564281234
Energy: 0.4439224176281188
Energy: 0.4056359149821565
Energy: 0.4474879602168746
Energy: 0.44359343991667705
Energy: 0.3781661266471288
Energy: 0.46090420519980146
Energy: 0.4401002714721905
Energy: 0.37644870326157887
Energy: 0.4605815687584306
Energy: 0.40154730366300967
Energy: 0.4319187144079047
Energy: 0.47447463343871205
Energy: 0.4465614019269056
Energy: 0.42590520224647105
Energy: 0.4747636025849833
Energy: 0.43621427991318207
Energy: 0.4223030701918044
Energy: 0.40023391221155186
Energy: 0.4309556474793431
Energy: 0.42112214133869147
Energy: 0.3707088374972216
Energy: 0.43146571972765224
Energy: 0.505912251451988
Energy: 0.47403156959069753
Energy: 0.40936741816779526
Energy: 0.5043067818470764
Energy: 0.39879461020184015
Energy: 0.41910324657236686
Energy: 0.42941034353979507
Energy: 0.460936584052526
Energy: 0.4609330418454443
Energy: 0.429467291511519
Energy: 0.46365831480338104
Energy: 0.44060518684127725

minimum gb energy = 0.36075070705664464 eV
minimum distance =  2.68613772837927 Angstroms
sigma value = 67


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

Energy: 0.5311758910067188
Energy: 0.5985507405282295
Energy: 0.5823688099202836
Energy: 0.4694708764755315
Energy: 0.6018595215329294
Energy: 0.5829450530700024
Energy: 0.5813326720477446
Energy: 0.5616428921566182
Energy: 0.5608800114466418
Energy: 0.5374925520364567
Energy: 0.559698181745031
Energy: 0.5246578382957214
Energy: 0.5902783395329301
Energy: 0.4935089500587785
Energy: 0.5209018429351988
Energy: 0.5900080559148911
Energy: 0.49007869832203116
Energy: 0.5588272306747275
Energy: 0.5444060226704889
Energy: 0.5277323302406469
Energy: 0.5152760909557587
Energy: 0.5452425153168754
Energy: 0.4858730846286864
Energy: 0.5193900559114366
Energy: 0.538528749707374
Energy: 0.5625000670371407
Energy: 0.5244109225628535
Energy: 0.538485844990926
Energy: 0.5606134431534924
Energy: 0.5239335523312366
Energy: 0.4575316050903248
Energy: 0.5302313417737424
Energy: 0.5399744099232591
Energy: 0.49168574369550566
Energy: 0.5294938879200689
Energy: 0.5414322074168212
Energy: 0.5398202118406472
Energy: 0.49041732090675366
Energy: 0.4950149422307294
Energy: 0.539569729228954
Energy: 0.49402289351010115
Energy: 0.4946278365807284
Energy: 0.547829721381455
Energy: 0.46267335394752906
Energy: 0.4900089192570014
Energy: 0.5481277956749112
Energy: 0.45869773117814194
Energy: 0.5420037379255374
Energy: 0.4635177319316227
Energy: 0.5214863335246409
Energy: 0.5202311994211718
Energy: 0.46308080821863523
Energy: 0.4886884379916616
Energy: 0.5189269071816603
Energy: 0.45752730713146694
Energy: 0.4955736531563106
Energy: 0.488441847663435
Energy: 0.45791585919047373
Energy: 0.49197469102072683
Energy: 0.48888471472469086
Energy: 0.45981382086744477
Energy: 0.4607632272946617
Energy: 0.492717263257198
Energy: 0.4581784479173967
Energy: 0.48124065986724635
Energy: 0.4923860106139255
Energy: 0.4615011023071627
Energy: 0.5580660889662244
Energy: 0.5594193851806794
Energy: 0.462543421899103
Energy: 0.46127257894916207
Energy: 0.4572802913902333
Energy: 0.4618996005870934
Energy: 0.4648488594715627
Energy: 0.5165632556608339
Energy: 0.4629500905595372
Energy: 0.46008987845507654
Energy: 0.4570848528029849
Energy: 0.4805262966835807
Energy: 0.45942774995941865
Energy: 0.5141623684181035
Energy: 0.45846543447186366
Energy: 0.4572161650878786
Energy: 0.5536109888075956
Energy: 0.5082877835884969
Energy: 0.4622688982496931
Energy: 0.45647944524096706
Energy: 0.5063027847942939
Energy: 0.4586221631390204
Energy: 0.456504962995735
Energy: 0.45957908579094964
Energy: 0.516546747220647
Energy: 0.5617326416882967
Energy: 0.46280857096676264
Energy: 0.45783801540882985
Energy: 0.5596944982809268
Energy: 0.49316681713312394
Energy: 0.45483281223466565
Energy: 0.46581057734637615
Energy: 0.4942365907836257
Energy: 0.4505437520849426
Energy: 0.49078519278321986
Energy: 0.49667883811746444
Energy: 0.5194938565064259
Energy: 0.5202280681812002
Energy: 0.49746194789816617
Energy: 0.518597462185293
Energy: 0.4897894718459255
Energy: 0.4485425381779926
Energy: 0.4579156819496741
Energy: 0.5158203129295086
Energy: 0.4670536172026178
Energy: 0.5138456255251909
Energy: 0.5154567279938765
Energy: 0.48972643165092355
Energy: 0.5475434302512371
Energy: 0.4943491589522711
Energy: 0.48969573609910083
Energy: 0.5448325889269421
Energy: 0.4969921658204075
Energy: 0.4971972241474494
Energy: 0.5179687117289407
Energy: 0.46477652107544765
Energy: 0.49738905886550183
Energy: 0.5643602793970462
Energy: 0.46491932467210934
Energy: 0.5890021543274296
Energy: 0.47145778963880924
Energy: 0.46503154897585314
Energy: 0.5892378687292712
Energy: 0.4677260672864909
Energy: 0.5212537589521066
Energy: 0.5813348565022531
Energy: 0.5480862612473449
Energy: 0.5386123088380503
Energy: 0.5809467781131666
Energy: 0.5455342329283451
Energy: 0.49367469872605996

minimum gb energy = 0.4485425381779926 eV
minimum distance =  2.67638099842237 Angstroms
sigma value = 33


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

Energy: 0.6305381610402282
Energy: 0.7003392889427378
Energy: 0.6986532277382057
Energy: 0.5337314418224306
Energy: 0.5785314500888958
Energy: 0.5971763798392112
Energy: 0.6233748477837546
Energy: 0.5823562193352557
Energy: 0.5835473355338293
Energy: 0.583918497549858
Energy: 0.5840943855249561
Energy: 0.580532708012238
Energy: 0.6753570921308752
Energy: 0.576536306426296
Energy: 0.5482421012461667
Energy: 0.6749222533588926
Energy: 0.5781608027799976
Energy: 0.5787230696946029
Energy: 0.5825383507608014
Energy: 0.5776149358693421
Energy: 0.5494142198240634
Energy: 0.5838247951219686
Energy: 0.5765090543825112
Energy: 0.5222880646258753
Energy: 0.5801389284706828
Energy: 0.5818973628956194
Energy: 0.5837132632710438
Energy: 0.5802887148397587
Energy: 0.5831205218301986
Energy: 0.5240442626223996
Energy: 0.5135070213437504
Energy: 0.5155015716170454
Energy: 0.5150085767512796
Energy: 0.5176974126694049
Energy: 0.5151245426618342
Energy: 0.5798629801472082
Energy: 0.5799166945749921
Energy: 0.5160297369260832
Energy: 0.5174132706086866
Energy: 0.5799724792207787
Energy: 0.5152255624680582
Energy: 0.5242036993542396
Energy: 0.5851771104188952
Energy: 0.5147694910119335
Energy: 0.5498917002794955
Energy: 0.5861112093668392
Energy: 0.5180965747802807
Energy: 0.5828791012454065
Energy: 0.5150108027166902
Energy: 0.516216176570846
Energy: 0.525492809885761
Energy: 0.5239477522503821
Energy: 0.5154368284601777
Energy: 0.5246268255761417
Energy: 0.5153399727296065
Energy: 0.514448896578409
Energy: 0.5143562701286857
Energy: 0.5164985404848693
Energy: 0.5167741153985094
Energy: 0.5146278319963288
Energy: 0.5511067092766867
Energy: 0.515789368452537
Energy: 0.5154268711799784
Energy: 0.5180141405814426
Energy: 0.5153530825912801
Energy: 0.5153107268178009
Energy: 0.5144796225341343
Energy: 0.5153342401761496
Energy: 0.5146151014291128
Energy: 0.5145612430229259
Energy: 0.5314997005188421
Energy: 0.5149185721606985
Energy: 0.5146136277620633
Energy: 0.5264271430049239
Energy: 0.515265722668311
Energy: 0.5147276295786232
Energy: 0.5237574552096276
Energy: 0.515124585579556
Energy: 0.4964329997496864
Energy: 0.5520438582821787
Energy: 0.5228527585779612
Energy: 0.4997830392964958
Energy: 0.5537912108647266
Energy: 0.5313123241151453
Energy: 0.4964125713573022
Energy: 0.5796657941484955
Energy: 0.5806825617045809
Energy: 0.4965050506008683
Energy: 0.5833539769453719
Energy: 0.5236605634315192
Energy: 0.5256943968941895
Energy: 0.599972402086151
Energy: 0.4970641273657186
Energy: 0.5233698633145706
Energy: 0.530932976894034
Energy: 0.5243160809044578
Energy: 0.6757677161238714
Energy: 0.5306093771487159
Energy: 0.5321231714322765
Energy: 0.6760294957346632
Energy: 0.5340147345612785
Energy: 0.5674514335127024
Energy: 0.651817564236495
Energy: 0.5803321763177098
Energy: 0.5806714220885648
Energy: 0.5792274330819307
Energy: 0.5804048299008079
Energy: 0.5184039097288081
Energy: 0.5322450901350513
Energy: 0.5856598417378245
Energy: 0.6461982855504655
Energy: 0.5341355634270436
Energy: 0.5855435383212267
Energy: 0.5626060732810529
Energy: 0.6236302096933972
Energy: 0.5819740746141846
Energy: 0.5831966815462457
Energy: 0.6237436110732899
Energy: 0.582860983097188
Energy: 0.5804644865872975
Energy: 0.685017424708974
Energy: 0.5785454506212159
Energy: 0.549389004585302
Energy: 0.6860928257844257
Energy: 0.5685674745907702
Energy: 0.5777020845567814
Energy: 0.5817437490226731
Energy: 0.5767785115452972
Energy: 0.5481746619079709
Energy: 0.5820832109348325
Energy: 0.5790294320513307
Energy: 0.5227119865786941
Energy: 0.5806547105767158
Energy: 0.5825901634835402
Energy: 0.5854236261272824
Energy: 0.5802622125742574
Energy: 0.5841345375058457
Energy: 0.523786096249892
Energy: 0.5130695288163959
Energy: 0.5773154198757016
Energy: 0.5149484620204683
Energy: 0.516211632581269
Energy: 0.5768959872050404
Energy: 0.5902675903984452
Energy: 0.5795986905969032
Energy: 0.517556224411166
Energy: 0.5172728751628956
Energy: 0.5797432724494086
Energy: 0.5171979754475677
Energy: 0.5609624861953212
Energy: 0.5830726703660555
Energy: 0.514812490555442
Energy: 0.5494346890896749
Energy: 0.5843622257762018
Energy: 0.517826951058446
Energy: 0.5824105077228805
Energy: 0.5152903234090778
Energy: 0.5150876432856861
Energy: 0.5151053348610135
Energy: 0.5167085224412961
Energy: 0.5155063020590462
Energy: 0.5251020896216907
Energy: 0.5151071769502137
Energy: 0.5144797900085419
Energy: 0.5144634436867168
Energy: 0.5153282665071955
Energy: 0.5178854157042337
Energy: 0.5147583772472174
Energy: 0.5522073007598329
Energy: 0.5151602260781983
Energy: 0.5164012991340302
Energy: 0.5152920341868169
Energy: 0.5150708091277474
Energy: 0.5152377020251934
Energy: 0.5147970992953241
Energy: 0.5166365661184387
Energy: 0.5152712900732176
Energy: 0.5147738674042903
Energy: 0.5314383341747627
Energy: 0.5150274386866318
Energy: 0.5209194891265815
Energy: 0.5256361695987595
Energy: 0.5151140731710321
Energy: 0.5148797073681984
Energy: 0.5234642431178985
Energy: 0.514861448422162
Energy: 0.4975335289751304
Energy: 0.5228974520047308
Energy: 0.5231570676848792
Energy: 0.4988283011078734
Energy: 0.5514468327138654
Energy: 0.5317529267223745
Energy: 0.4964607942164986
Energy: 0.5793900334675219
Energy: 0.5799268323820895
Energy: 0.4967281063282906
Energy: 0.5837339120268972
Energy: 0.5973914517317855
Energy: 0.524139450473604
Energy: 0.5415895640212817
Energy: 0.5168765828035388
Energy: 0.5246011699674133
Energy: 0.5308455942262219
Energy: 0.5244127832590297
Energy: 0.6739065906229418
Energy: 0.5306799979565943
Energy: 0.5965432278416423
Energy: 0.6742838305483299
Energy: 0.5018012089148746
Energy: 0.5672692208823567
Energy: 0.6506334084929369
Energy: 0.5805157595335484
Energy: 0.580750030504797
Energy: 0.5858220683397045
Energy: 0.5805570386239738
Energy: 0.5238084172030274
Energy: 0.5299727048886989
Energy: 0.5851636407916277
Energy: 0.5314981038305523
Energy: 0.5324851856781949
Energy: 0.5852010996015518
Energy: 0.5651329718098396

minimum gb energy = 0.4964125713573022 eV
minimum distance =  2.68955706602265 Angstroms
sigma value = 41


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

Energy: 0.8444305337712262
Energy: 0.7809474810281577
Energy: 0.7821757071802995
Energy: 0.6459934520399696
Energy: 0.9316183177306512
Energy: 0.7811012320711372
Energy: 0.6391153051996726
Energy: 0.6002614311630389
Energy: 0.5985010752952501
Energy: 0.6148577517978863
Energy: 0.5994648565176679
Energy: 0.5978723236028906
Energy: 0.6836915574836518
Energy: 0.5971592948112034
Energy: 0.6139653446000854
Energy: 0.6844642758277693
Energy: 0.5989158695341427
Energy: 0.5990665408903778
Energy: 0.6140930176027705
Energy: 0.59827015348421
Energy: 0.6544195668523284
Energy: 0.6139926931085475
Energy: 0.6139953291947025
Energy: 0.5997521901417963
Energy: 0.5982201308615219
Energy: 0.6008021997127069
Energy: 0.5999075369867394
Energy: 0.5977713386810024
Energy: 0.6003650273780073
Energy: 0.5829721662647284
Energy: 0.6326090734240876
Energy: 0.7189924200698558
Energy: 0.6420067251462886
Energy: 0.5670732552398723
Energy: 0.7206848305828891
Energy: 0.6151831418741209
Energy: 0.5971834591916173
Energy: 0.5835650809160694
Energy: 0.5819072363582299
Energy: 0.5973831472222761
Energy: 0.5836066702154465
Energy: 0.5979260832160983
Energy: 0.5998035380514964
Energy: 0.5691086993344517
Energy: 0.5977951896799508
Energy: 0.6009402110498558
Energy: 0.5716040794837859
Energy: 0.5977129396544981
Energy: 0.6932392756216872
Energy: 0.7023744737091889
Energy: 0.5688978655962807
Energy: 0.6904035141696278
Energy: 0.5975776700889586
Energy: 0.5681758035755793
Energy: 0.5973568185849802
Energy: 0.603550780251239
Energy: 0.5973349922188662
Energy: 0.5698962663077178
Energy: 0.5989043039763232
Energy: 0.5976954984661143
Energy: 0.6129293877678647
Energy: 0.598495880506481
Energy: 0.5691933297187111
Energy: 0.5696349234832807
Energy: 0.5526597100273059
Energy: 0.5699934864764535
Energy: 0.6847262234788383
Energy: 0.6112437322307754
Energy: 0.6786301910742382
Energy: 0.6846742296479081
Energy: 0.5523847431055835
Energy: 0.6482223014346954
Energy: 0.6908788668647474
Energy: 0.5978873689761399
Energy: 0.6159905831790686
Energy: 0.6151067797782754
Energy: 0.5976457758684617
Energy: 0.5983095708688099
Energy: 0.5534159806796212
Energy: 0.6141558614627616
Energy: 0.5532937053353095
Energy: 0.5571189866124716
Energy: 0.6137980469643924
Energy: 0.5525318250295687

minimum gb energy = 0.5523847431055835 eV
minimum distance =  2.70854689436192 Angstroms
sigma value = 11


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

Energy: 0.6277626619339047
Energy: 0.7574939193225484
Energy: 0.6907716549697204
Energy: 0.7147176139055315
Energy: 0.7604746234670231
Energy: 0.7802782615531577
Energy: 0.7432241516214314
Energy: 0.6396476151052511
Energy: 0.6395628366868324
Energy: 0.7180123205879607
Energy: 0.6393908461240224
Energy: 0.6405716237686127
Energy: 0.7317803863922212
Energy: 0.693137135780852
Energy: 0.6932220595520328
Energy: 0.731815882885718
Energy: 0.6420550960391597
Energy: 0.6959767190675165
Energy: 0.7078538923279343
Energy: 0.6235588738229835
Energy: 0.6676422144477134
Energy: 0.673282390645435
Energy: 0.6809395246962369
Energy: 0.6669660073382325
Energy: 0.7164028045405696
Energy: 0.6393684206742832
Energy: 0.6391682685748421
Energy: 0.6797256637358123
Energy: 0.6474217452878067
Energy: 0.6394304101443453
Energy: 0.7166701940254641
Energy: 0.6589022886483565
Energy: 0.6585347697657764
Energy: 0.6883346903668139
Energy: 0.6587744467987141
Energy: 0.6643899945860788
Energy: 0.6586796348439501
Energy: 0.6642561857579479
Energy: 0.6594913396201302
Energy: 0.6586966422663972
Energy: 0.6442679236681667
Energy: 0.6588083311184219
Energy: 0.6475334514969725
Energy: 0.683449248635784
Energy: 0.6398706735296932
Energy: 0.647868685914233
Energy: 0.7172657689986174
Energy: 0.6393863183759417
Energy: 0.6549116761728726
Energy: 0.6668382151012702
Energy: 0.6674245619359491
Energy: 0.6592164458551402
Energy: 0.6660772105026521
Energy: 0.6285818361948134
Energy: 0.655607014071039
Energy: 0.6938590005674228
Energy: 0.6680809792818214
Energy: 0.6627455500593625
Energy: 0.6933731385968516
Energy: 0.6275464788359988
Energy: 0.6474269070990832
Energy: 0.6602276526872538
Energy: 0.6402097641600782
Energy: 0.6481835698326484
Energy: 0.6628432183376654
Energy: 0.6395983740542811
Energy: 0.6484466330270067
Energy: 0.689072927075907
Energy: 0.7449098038099536
Energy: 0.646662593331467
Energy: 0.6931858438749579
Energy: 0.7773985201239055
Energy: 0.6393204597353925
Energy: 0.7193854591622467
Energy: 0.6851700255985981
Energy: 0.6392529696183143
Energy: 0.7163814864652032
Energy: 0.6401865318762966
Energy: 0.6812796639250631
Energy: 0.7312879918813111
Energy: 0.7550910431196237
Energy: 0.6858068298884967
Energy: 0.7314733496742899
Energy: 0.6951406208985623
Energy: 0.6248431021655553
Energy: 0.698083425013481
Energy: 0.6248034861160756
Energy: 0.6248064003904107
Energy: 0.6841903760385785
Energy: 0.6249176935500163
Energy: 0.6252170960820437
Energy: 0.6248110378679637
Energy: 0.6245073725871167
Energy: 0.6266564151755116
Energy: 0.6853064464289446
Energy: 0.6249056975356452
Energy: 0.6247712209571298
Energy: 0.6255427169699652
Energy: 0.6249224553358499
Energy: 0.6248372893512175
Energy: 0.6850471331913146
Energy: 0.6568972260410555
Energy: 0.7127581764539793
Energy: 0.6599585079400678
Energy: 0.6595580990299205
Energy: 0.6809064184582129
Energy: 0.7361893047035178
Energy: 0.6956483476910885
Energy: 0.6638400764860234
Energy: 0.6648049327543883
Energy: 0.6618159585787886
Energy: 0.6637451165240943
Energy: 0.6667328982972764
Energy: 0.6780589891766186
Energy: 0.7054150337977995
Energy: 0.695204093047913
Energy: 0.6276997659216482
Energy: 0.7062534936238815
Energy: 0.6256501165241393
Energy: 0.6868462064388663
Energy: 0.7010865569477325
Energy: 0.6257858556296805
Energy: 0.6938809146020446
Energy: 0.7023284864098628
Energy: 0.6911853765113807
Energy: 0.6610079395769334
Energy: 0.6454353126006585
Energy: 0.6616623974420225
Energy: 0.6610918684520607
Energy: 0.6382215052161918
Energy: 0.680073903891093
Energy: 0.675610922211692
Energy: 0.6433086350284292
Energy: 0.6776244205514826
Energy: 0.6656830136487352
Energy: 0.6872129734720123
Energy: 0.6619721058530551
Energy: 0.6583047963421057
Energy: 0.7034480000800415
Energy: 0.6638178864888585
Energy: 0.6734255931597836
Energy: 0.6729939986524572
Energy: 0.6637751071253225
Energy: 0.6604237804893442
Energy: 0.7333130564948965
Energy: 0.6793586550463183
Energy: 0.6790943287315108
Energy: 0.7345072383328557
Energy: 0.6382737782650484
Energy: 0.6463118519750121
Energy: 0.7320621808265638
Energy: 0.6253094110074789
Energy: 0.6564074439614471
Energy: 0.6843843376431518
Energy: 0.6247434569645477
Energy: 0.6257578912861422
Energy: 0.730102371329568
Energy: 0.6245205967493278
Energy: 0.6247738498851292
Energy: 0.6847495406363793
Energy: 0.6273150544124374
Energy: 0.6246569745407798
Energy: 0.7306835894312498
Energy: 0.6575640003438775
Energy: 0.6432182683002857
Energy: 0.6647413337563304
Energy: 0.6248722728614434
Energy: 0.6247779550975463
Energy: 0.7313228159272103
Energy: 0.6861624506768652
Energy: 0.687331040774723
Energy: 0.7313850939424169
Energy: 0.6345952105368159
Energy: 0.7067841766773953
Energy: 0.7905422182427259
Energy: 0.6397225333184342
Energy: 0.6396669316607163
Energy: 0.7101616578139908
Energy: 0.6394818467089641
Energy: 0.7081077599789963
Energy: 0.6280406250332146
Energy: 0.6462758573117791
Energy: 0.742233952037087
Energy: 0.628273144902862
Energy: 0.6392675360426466
Energy: 0.6807786426395274

minimum gb energy = 0.6235588738229835 eV
minimum distance =  2.69084816093797 Angstroms
sigma value = 57


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

Energy: 0.9768824921117361
Energy: 0.778488860518833
Energy: 0.774960761592966
Energy: 0.7751659639706804
Energy: 1.0285552783031187
Energy: 0.7748182556135642
Energy: 0.5711588319841995
Energy: 0.5918232768412889
Energy: 0.5935030751373487
Energy: 0.6141466166058744
Energy: 0.6152375396883597
Energy: 0.5929628137260391
Energy: 0.6852861447656398
Energy: 0.7163558503039354
Energy: 0.6687635309154577
Energy: 0.682292369891543
Energy: 0.61543946870777
Energy: 0.6737458886313842
Energy: 0.6136580487622617
Energy: 0.5937844300591493
Energy: 0.5915307292027094
Energy: 0.6147643707818418
Energy: 0.6308634545429215
Energy: 0.5919391673390272
Energy: 0.6342227336367591
Energy: 0.6204657953675548
Energy: 0.5922377189693596
Energy: 0.6345674998882241
Energy: 0.6184857460819153
Energy: 0.5922574527943798
Energy: 0.6140331741487812
Energy: 0.6823722034757611
Energy: 0.6818445833419068
Energy: 0.6149759661292121
Energy: 0.6821244367155095
Energy: 0.6752313086913239
Energy: 0.6833794738296308
Energy: 0.6588559803441821
Energy: 0.5830026875149548
Energy: 0.68441346780329
Energy: 0.6447289347810006
Energy: 0.681918570535558
Energy: 0.6998926164448107
Energy: 0.591896453318881
Energy: 0.5925331378555938
Energy: 0.6161376979497268
Energy: 0.6376900329596806
Energy: 0.5917156382104201
Energy: 0.6183283002582199
Energy: 0.6791945881502691
Energy: 0.7140287463657474
Energy: 0.5739520876065236
Energy: 0.6746913184974709
Energy: 0.5728949031456234
Energy: 0.5715030892421165
Energy: 0.6819593068573245
Energy: 0.6208116061813187
Energy: 0.5724456369978084
Energy: 0.6813136606846886
Energy: 0.5719526477347963
Energy: 0.6997447896330418
Energy: 0.5929685375065474
Energy: 0.5922280127477497
Energy: 0.6166545493785652
Energy: 0.6391183778663942
Energy: 0.5917842061893868
Energy: 0.6132874881803865
Energy: 0.7259026478979479
Energy: 0.6099922456504652
Energy: 0.6739950286180532
Energy: 0.7176924982353369
Energy: 0.6735513025238766
Energy: 0.6132833062856227
Energy: 0.5926343675734488
Energy: 0.5938424424031251
Energy: 0.6136802606433025
Energy: 0.6149302244771662
Energy: 0.6145381870922192
Energy: 0.6136098721841655
Energy: 0.684058181816919
Energy: 0.6816541382300304
Energy: 0.5916823936417155
Energy: 0.6839333858058346
Energy: 0.6737067964415402
Energy: 0.6361677211539732
Energy: 0.6488250672616064
Energy: 0.5938587873979563
Energy: 0.634932132160051
Energy: 0.6443835612966385
Energy: 0.5916624210427269
Energy: 0.6826938301226989
Energy: 0.6499534180825919
Energy: 0.5719040070683051
Energy: 0.6833469263752652
Energy: 0.6445348058737161
Energy: 0.6179039467275758
Energy: 0.5711768002791823
Energy: 0.6190331261261296
Energy: 0.5936185906306188
Energy: 0.5714336365258196
Energy: 0.615049467951048
Energy: 0.5930912765549577

minimum gb energy = 0.5711588319841995 eV
minimum distance =  2.69895034818528 Angstroms
sigma value = 9


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

Energy: 1.1048315316066748
Energy: 0.6909933825228016
Energy: 0.7152878247830344
Energy: 0.7183668425447873
Energy: 0.7937013234673184
Energy: 0.7199675668751069
Energy: 0.7853063320841451
Energy: 0.6674447163899337
Energy: 0.6917260230233947
Energy: 0.6761718035916647
Energy: 0.6667668226399286
Energy: 0.6781159150034934
Energy: 0.6971184420187949
Energy: 0.676036890760144
Energy: 0.6577744267608183
Energy: 0.6979448969915052
Energy: 0.6982890322093056
Energy: 0.7191629890736946
Energy: 0.6668933351092362
Energy: 0.6764177394377914
Energy: 0.7071371862287489
Energy: 0.6573239440534857
Energy: 0.6761821915357077
Energy: 0.6791118223621861
Energy: 0.7356069455892237
Energy: 0.6727240713851118
Energy: 0.6573281832805435
Energy: 0.738123909081236
Energy: 0.6797462499792645
Energy: 0.6452125200562262
Energy: 0.6922217025897296
Energy: 0.6961932437625499
Energy: 0.6943387201948158
Energy: 0.6935852559491767
Energy: 0.6850312759445728
Energy: 0.6939869225106348
Energy: 0.6796280500173619
Energy: 0.6302560655445392
Energy: 0.661974589525035
Energy: 0.6799406501046107
Energy: 0.7151096623647546
Energy: 0.6938739388040774
Energy: 0.6781977828674252
Energy: 0.6893616656871451
Energy: 0.6943529328464751
Energy: 0.6703121645650839
Energy: 0.6901774494758136
Energy: 0.6908388221556301
Energy: 0.6749922079559846
Energy: 0.6932631435901135
Energy: 0.6689049842052025
Energy: 0.723485153568543
Energy: 0.7013234219034988
Energy: 0.6828848221388453
Energy: 0.6750135021192187
Energy: 0.6594342251920392
Energy: 0.6550906247215169
Energy: 0.667221853276606
Energy: 0.6571617930075483
Energy: 0.654568934120908
Energy: 0.6781020379086885
Energy: 0.6816531885362089
Energy: 0.6460634267186789
Energy: 0.6785109271689135
Energy: 0.694117154644726
Energy: 0.6561371235615278
Energy: 0.6779186458912272
Energy: 0.6782450856001837
Energy: 0.6931271682340743
Energy: 0.6783261582889876
Energy: 0.7317375292237143
Energy: 0.6934174573085383
Energy: 0.8984493180616645
Energy: 0.6584353294604891
Energy: 0.6587991975248565
Energy: 0.711975026385284
Energy: 0.6585354676459972
Energy: 0.6811395451486426
Energy: 0.6904779197125884
Energy: 0.6487005426779746
Energy: 0.6586706667656328
Energy: 0.6577002525352563
Energy: 0.6604754383785977
Energy: 0.6784248828224435
Energy: 0.7228778975556327
Energy: 0.6952544527890708
Energy: 0.6531248358328726
Energy: 0.7237887610140232
Energy: 0.6930508735387442
Energy: 0.7116005482554085
Energy: 0.7132626291147958
Energy: 0.6976826284250325
Energy: 0.686251671463638
Energy: 0.7129335180654537
Energy: 0.7266177081520376
Energy: 0.679585302401641
Energy: 0.6774237959561722
Energy: 0.6768263612043817
Energy: 0.7065083960941363
Energy: 0.6774172286182397
Energy: 0.6550913787086932
Energy: 0.6770806671730684
Energy: 0.8258195115892336
Energy: 0.6705179570943941
Energy: 0.6685831426239066
Energy: 0.7042977373061405
Energy: 0.6691851846108946
Energy: 0.6583794936740548
Energy: 0.6666676005572593
Energy: 0.6775116110147154
Energy: 0.6778147820195856
Energy: 0.6668093344006373
Energy: 0.6584208476590283
Energy: 0.6778179597818147
Energy: 0.6672944805864169
Energy: 0.6769000380309144
Energy: 0.6784004078866355
Energy: 0.6680609055600447
Energy: 0.6809181143767841
Energy: 0.6585199845462848
Energy: 0.6693117932807057
Energy: 0.6671571108990203
Energy: 0.6678894547960077
Energy: 0.651912928408485
Energy: 0.6718510980504462
Energy: 0.6914646417913795

minimum gb energy = 0.6302560655445392 eV
minimum distance =  2.67907454571242 Angstroms
sigma value = 27


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

Energy: 0.9420158173591819
Energy: 0.8105601355927373
Energy: 0.8044778010115291
Energy: 0.8047726293297842
Energy: 0.9937565162119216
Energy: 0.8050521372172139
Energy: 0.6570326650830792
Energy: 0.669438814068153
Energy: 0.6776920726138526
Energy: 0.6939544683396125
Energy: 0.6776889749991578
Energy: 0.6578291220546068
Energy: 0.6999577608951367
Energy: 0.6444719695112368
Energy: 0.7191728147200038
Energy: 0.6998446246043756
Energy: 0.7147110128987235
Energy: 0.736886085717934
Energy: 0.6629456681475298
Energy: 0.6592882315648672
Energy: 0.6591081251394182
Energy: 0.6640867439680378
Energy: 0.6698390172908949
Energy: 0.6820380959145529
Energy: 0.7197556970042311
Energy: 0.6646663257811494
Energy: 0.6636833859401096
Energy: 0.7198391234292648
Energy: 0.6641216451396117
Energy: 0.6598633152504696
Energy: 0.7174156848631533
Energy: 0.6556078061941469
Energy: 0.6554609364859345
Energy: 0.7174770157167843
Energy: 0.6638603208384329
Energy: 0.6803773254744345
Energy: 0.7328353293893469
Energy: 0.7349176083050486
Energy: 0.7345771757549346
Energy: 0.7344914965299686
Energy: 0.734820641872756
Energy: 0.7347341670340126
Energy: 0.6960806497657608
Energy: 0.6883088684885816
Energy: 0.689094741176055
Energy: 0.6963643747513626
Energy: 0.6541464139446102
Energy: 0.670199654548953
Energy: 0.6890897974812334
Energy: 0.6939721027569808
Energy: 0.678446612018729
Energy: 0.6704071790375451
Energy: 0.7192250334967437
Energy: 0.6764948770989275
Energy: 0.6780295149523399
Energy: 0.6819072415944756
Energy: 0.6668612663990561
Energy: 0.6551585029378512
Energy: 0.7079724450619191
Energy: 0.6779790440633735
Energy: 0.6904825193916533
Energy: 0.6687217776780012
Energy: 0.6837462915592938
Energy: 0.6910938131362668
Energy: 0.7105539371344453
Energy: 0.669308770932102
Energy: 0.6812068659884469
Energy: 0.6748362584330362
Energy: 0.6693387823456224
Energy: 0.6788175612759998
Energy: 0.6741512441868134
Energy: 0.6686016600367553
Energy: 0.8577753655559615
Energy: 0.7320617678601716
Energy: 0.7322339896185456
Energy: 0.735087294178246
Energy: 0.7378227794178841
Energy: 0.7329342878604105
Energy: 0.7481380031288932
Energy: 0.7329636582121944
Energy: 0.6859605286303871
Energy: 0.7484435760703969
Energy: 0.7327009483245033
Energy: 0.6959753989573517
Energy: 0.7213495831050213
Energy: 0.6659884365133707
Energy: 0.6700937118506572
Energy: 0.7204065605508099
Energy: 0.664217594643431
Energy: 0.6695008714962047
Energy: 0.6977613060529464
Energy: 0.6725709444038895
Energy: 0.675032878305967
Energy: 0.6979165852143203
Energy: 0.6657264270911598
Energy: 0.6721055387725289
Energy: 0.679232400579633
Energy: 0.667436491988742
Energy: 0.6680671016345093
Energy: 0.6793676753622236
Energy: 0.6981109706353105
Energy: 0.6660111205849827
Energy: 0.6990020371953821
Energy: 0.6643460622467735
Energy: 0.6554611141550805
Energy: 0.6982318729701898
Energy: 0.6665190929446723
Energy: 0.6549990131663556
Energy: 0.7451198716916901
Energy: 0.7398393147350458
Energy: 0.7407695227720212
Energy: 0.7460963949074426
Energy: 0.7087075961029519
Energy: 0.7418072155043504
Energy: 0.7382632094681171
Energy: 0.7085898953924938
Energy: 0.7406981517734565
Energy: 0.73925905886342
Energy: 0.6742511634880453
Energy: 0.7343185300210175
Energy: 0.7970183983877603
Energy: 0.6643274738097921
Energy: 0.6549457805057803
Energy: 0.6765243674472402
Energy: 0.6664514752307362
Energy: 0.6547708943256636
Energy: 0.7139536650275742
Energy: 0.6972817622318473
Energy: 0.6950471245763519
Energy: 0.7145808789191913
Energy: 0.7249511262923323
Energy: 0.6583525283980824
Energy: 0.684711607493814
Energy: 0.6447855272546569
Energy: 0.6803700435971055
Energy: 0.6853271142586976
Energy: 0.645105232788738
Energy: 0.6788457718598548
Energy: 0.6538940625516738
Energy: 0.6620650406345268
Energy: 0.658764751812784
Energy: 0.6548412875997289
Energy: 0.6650956171890877
Energy: 0.6823910118378554
Energy: 0.6573244995828049
Energy: 0.8421312148258542
Energy: 0.6891350305798623
Energy: 0.6574438482864613
Energy: 0.838889874269461
Energy: 0.6446222906351968

minimum gb energy = 0.6444719695112368 eV
minimum distance =  2.63848431383524 Angstroms
sigma value = 19


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

Energy: 1.0512178220530783
Energy: 0.7812887228311003
Energy: 0.7938294653138187
Energy: 0.6596881592627994
Energy: 0.6584758171924235
Energy: 0.796865537105051
Energy: 0.665088893772487
Energy: 0.6807568825727024
Energy: 0.6654390225314072
Energy: 0.6704435523930325
Energy: 0.6801031730332727
Energy: 0.6663131919075768
Energy: 0.6786860918424152
Energy: 0.6632312684848407
Energy: 0.666935168235896
Energy: 0.6789227319586494
Energy: 0.66677644591769
Energy: 0.674806229708371
Energy: 0.6797886405390009
Energy: 0.6682930944651632
Energy: 0.6637219716964218
Energy: 0.6801021716103738
Energy: 0.6673325309581017
Energy: 0.6670160226609737
Energy: 0.7258786599565319
Energy: 0.6785458674227292
Energy: 0.673453696615839
Energy: 0.6758222557583817
Energy: 0.6764572597798653
Energy: 0.6736689422220306
Energy: 0.6798567299730588
Energy: 0.6681998177767848
Energy: 0.6954916039385748
Energy: 0.6801286190898876
Energy: 0.6715606547852777
Energy: 0.7120510101483978
Energy: 0.7180889044971013
Energy: 0.730598210064625
Energy: 0.7305704130770015
Energy: 0.7102636461476199
Energy: 0.7348170309706478
Energy: 0.7334443068404034
Energy: 0.7274115987141888
Energy: 0.6681636462875775
Energy: 0.7296840298790969
Energy: 0.7282952573176472
Energy: 0.7021705397837513
Energy: 0.730070803487782
Energy: 0.7123145741019536
Energy: 0.6779294628968
Energy: 0.6679720791594259
Energy: 0.7141993658406998
Energy: 0.6750326215038099
Energy: 0.6664231513387383
Energy: 0.7252343567872035
Energy: 0.6748371485213231
Energy: 0.674516964864713
Energy: 0.7048808648785747
Energy: 0.674630567497791
Energy: 0.6738291866676793
Energy: 0.6728074498591319
Energy: 0.6535834803829144
Energy: 0.7138621918778548
Energy: 0.6729635195215203
Energy: 0.6533619948366156
Energy: 0.6632647787253584
Energy: 0.6641418518823126
Energy: 0.6841267476975628
Energy: 0.6958074148052348
Energy: 0.6647225225534505
Energy: 0.6870875733789379
Energy: 0.6473089885449509
Energy: 0.7196500712911733
Energy: 0.6763900495395713
Energy: 0.6751362783523011
Energy: 0.6934213643728788
Energy: 0.6978464185966516
Energy: 0.6668901713095577
Energy: 0.7117753453953903
Energy: 0.6736559562337254
Energy: 0.6697416696914141
Energy: 0.6930815072512972
Energy: 0.671491740796809
Energy: 0.6773636732744556
Energy: 0.663653334612322
Energy: 0.647200249979194
Energy: 0.6462243818039867
Energy: 0.6643248066928368
Energy: 0.6952865034174979
Energy: 0.6482619257708022
Energy: 0.6642209569557942
Energy: 0.6908417694643618
Energy: 0.6527057936592722
Energy: 0.6648028281951343
Energy: 0.6514925485602854
Energy: 0.6550078840772594
Energy: 0.7095849062256511
Energy: 0.6692151545577967
Energy: 0.6831468470271931
Energy: 0.6537830336989507
Energy: 0.6756789604710927
Energy: 0.6787407437808807
Energy: 0.6917908498370864
Energy: 0.6613936482665067
Energy: 0.6551197069964872
Energy: 0.6924721353966068
Energy: 0.6647703351143716
Energy: 0.6506190276755219
Energy: 0.6911147301730558
Energy: 0.6620788943391649
Energy: 0.6577465435726413
Energy: 0.6922043407350911
Energy: 0.7211904829788772
Energy: 0.6590069461527243
Energy: 0.6783469277842274
Energy: 0.662097677178553
Energy: 0.6576342352222375
Energy: 0.6791946262851448
Energy: 0.721356441198889
Energy: 0.659602230500999
Energy: 0.6966260280452199
Energy: 0.6601386619288141
Energy: 0.653112407930747
Energy: 0.699341635358029
Energy: 0.6651048529089448
Energy: 0.6531355349566228
Energy: 0.7057132470953131
Energy: 0.6519871606043949
Energy: 0.6515542358719829
Energy: 0.7061739948684622
Energy: 0.6654028364792105
Energy: 0.6474542718119551
Energy: 0.7006994597873407
Energy: 0.6738981863317202
Energy: 0.6762380235206521
Energy: 0.7017901904329432
Energy: 0.6768357901682304
Energy: 0.6693308020004217
Energy: 0.6793931952855956
Energy: 0.6577843082179858
Energy: 0.6569426067467874
Energy: 0.6799733223542139
Energy: 0.73874625797603
Energy: 0.6564556206617601
Energy: 0.7164941847815768
Energy: 0.6663832123931139
Energy: 0.6485493310832171
Energy: 0.7048121341222197
Energy: 0.6647392055727176
Energy: 0.6444322068161171
Energy: 0.716754524226305
Energy: 0.6764700502638276
Energy: 0.6692745239653408
Energy: 0.7069079074097343
Energy: 0.6769831973111103
Energy: 0.6628198384927598
Energy: 0.6786768407678794
Energy: 0.6693076204313924
Energy: 0.6695217031601391
Energy: 0.67876103164042
Energy: 0.6697264315392686
Energy: 0.670532709000829
Energy: 0.6779823956027505
Energy: 0.6728044703158326
Energy: 0.6666062712879678
Energy: 0.6753093427084956
Energy: 0.7092119372237481
Energy: 0.6631813413748449
Energy: 0.6899633455999791
Energy: 0.7288038590996074
Energy: 0.7276066391522604
Energy: 0.6925801639215381
Energy: 0.7271393674471224
Energy: 0.6587141236334125

minimum gb energy = 0.6444322068161171 eV
minimum distance =  2.66555128234685 Angstroms
sigma value = 101


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

Energy: 0.9856203071668967
Energy: 0.6797493970141071
Energy: 0.683404998111641
Energy: 0.6519773393167737
Energy: 0.6726322628306803
Energy: 0.6651997929042492
Energy: 0.6579457255816329
Energy: 0.6842610748367407
Energy: 0.6613117472883022
Energy: 0.663169030937958
Energy: 0.6803187976804985
Energy: 0.6676504946783656
Energy: 0.6795377493583513
Energy: 0.6677977004052205
Energy: 0.6659046671799259
Energy: 0.68002154325763
Energy: 0.6763154725793918
Energy: 0.6787674396851481
Energy: 0.6777181544085694
Energy: 0.6622760450271408
Energy: 0.6882377845347804
Energy: 0.6781287236134328
Energy: 0.6625299705989204
Energy: 0.6611844156488543
Energy: 0.6962742127674427
Energy: 0.675598925009603
Energy: 0.6781419367452951
Energy: 0.6988410039947659
Energy: 0.6742387799448873
Energy: 0.694033577951
Energy: 0.6944892283943546
Energy: 0.6617288387413985
Energy: 0.6913161682570172
Energy: 0.6963502150069477
Energy: 0.6718645219108876
Energy: 0.6948562986797661
Energy: 0.7086744176084206
Energy: 0.6634751139315386
Energy: 0.6650555547808837
Energy: 0.6924591729348712
Energy: 0.6594860047462974
Energy: 0.6734282562482393
Energy: 0.6930440708940501
Energy: 0.6941576278149686
Energy: 0.6654219883850196
Energy: 0.6937186429795827
Energy: 0.6883342480305127
Energy: 0.6941901369519131
Energy: 0.682104803818594
Energy: 0.6747446049345777
Energy: 0.664203087658882
Energy: 0.683567461636415
Energy: 0.6726246634656234
Energy: 0.663992942945889
Energy: 0.67986722505406
Energy: 0.6711693490613058
Energy: 0.6706330227648792
Energy: 0.6714909452970315
Energy: 0.6788480536476749
Energy: 0.687683646590584
Energy: 0.7525374350902797
Energy: 0.6456568345188451
Energy: 0.6627290749248891
Energy: 0.7535176913670555
Energy: 0.645649077839631
Energy: 0.7417079208726658
Energy: 0.6778665418578769
Energy: 0.6890948554119465
Energy: 0.692632456156616
Energy: 0.6779429111950961
Energy: 0.6901376546235164
Energy: 0.6713583230557769
Energy: 0.6994618488196696
Energy: 0.6743497779028822
Energy: 0.674639162394484
Energy: 0.693644335697864
Energy: 0.6715039003751132
Energy: 0.6689822629613301
Energy: 0.6852714300418687
Energy: 0.6661526328065269
Energy: 0.6701810577594314
Energy: 0.6775442506030624
Energy: 0.6730828945289294
Energy: 0.6712559177151899
Energy: 0.677784328460976
Energy: 0.6845456931374478
Energy: 0.689076845199468
Energy: 0.6784534886117135
Energy: 0.6831044878276588
Energy: 0.6703210738293532
Energy: 0.678092101619336
Energy: 0.6882062121507382
Energy: 0.6817265684858271
Energy: 0.6717199195349407
Energy: 0.6872956891391522
Energy: 0.66087137092342
Energy: 0.9829224134097354
Energy: 0.7486622421882454
Energy: 0.6839126351205114
Energy: 0.6456534536346012
Energy: 0.7468164470146909
Energy: 0.6596180537587547
Energy: 0.7349213477554626
Energy: 0.682051865559064
Energy: 0.6797960761379148
Energy: 0.6785195506633179
Energy: 0.6790721822527681
Energy: 0.6829337300585857
Energy: 0.6781452067420023
Energy: 0.6922343471402854
Energy: 0.6642536829470779
Energy: 0.6735973228825106
Energy: 0.6738737049211093
Energy: 0.6680708040555319
Energy: 0.6783191757771595
Energy: 0.6908376159566628
Energy: 0.669101582400852
Energy: 0.6794158256341081
Energy: 0.6738815045142584
Energy: 0.664031867656139
Energy: 0.698906061242728
Energy: 0.6766200174840333
Energy: 0.6794256993809816
Energy: 0.7015686725023143
Energy: 0.6758174166779757
Energy: 0.6870561720094077
Energy: 0.7080132381839208
Energy: 0.6689709103886243
Energy: 0.6612619410435355
Energy: 0.7091437540967069
Energy: 0.6715505560421938
Energy: 0.667171016105388
Energy: 0.6977273444508815
Energy: 0.657910211632612
Energy: 0.6586345833740047
Energy: 0.6976598202343164
Energy: 0.6816288701456954
Energy: 0.6623873927576307
Energy: 0.6918461781163042
Energy: 0.6802890865212848
Energy: 0.6679524411055829
Energy: 0.6925161261724332
Energy: 0.6872094620079865
Energy: 0.6987982938540365
Energy: 0.6854444601972011
Energy: 0.6742269148310915
Energy: 0.6682364038308387
Energy: 0.6861571404861505
Energy: 0.6725410357186778
Energy: 0.6691776220275897
Energy: 0.6814029992921327
Energy: 0.6705931920268869
Energy: 0.6726131403460295
Energy: 0.6812801119989105
Energy: 0.6748205896193483
Energy: 0.6705401404993011
Energy: 0.6716497472158782
Energy: 0.6416680271351027
Energy: 0.6458676307739213
Energy: 0.6723094596041789
Energy: 0.66348167575038
Energy: 0.6489166704405881
Energy: 0.6808992376370744
Energy: 0.659371745846775
Energy: 0.6454574183678065
Energy: 0.6815340713605389
Energy: 0.6718988746189133
Energy: 0.670437959493893
Energy: 0.6868295403800335
Energy: 0.6893839934145102
Energy: 0.682999170430931
Energy: 0.6780203371690635
Energy: 0.6909599624200699
Energy: 0.6825197437461881
Energy: 0.6876367569598085
Energy: 0.6709601693739369
Energy: 0.6608459758460009
Energy: 0.6787143702847576
Energy: 0.6717188619262512
Energy: 0.6580551832329848
Energy: 0.6793988450871421
Energy: 0.6804401637681643
Energy: 0.6671914877397727
Energy: 0.6784594278921452
Energy: 0.6816962306348683
Energy: 0.6700755224067193
Energy: 0.6780671760973065
Energy: 0.6755570650311012
Energy: 0.6637340741081517
Energy: 0.6715109930884087
Energy: 0.674977001398294
Energy: 0.6686805230766953
Energy: 0.6837714265392476
Energy: 0.680919353073199
Energy: 0.6873123568550662
Energy: 0.6620590585217292
Energy: 0.680304770516212
Energy: 0.6704507420373964

minimum gb energy = 0.6416680271351027 eV
minimum distance =  2.69759652330864 Angstroms
sigma value = 33


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

Energy: 0.013148029879054054
Energy: 0.015235192840201908
Energy: 0.013848329671257887
Energy: 0.014856815150668142
Energy: 0.5210676342490458
Energy: 0.013564374763415033
Energy: 0.013822817542886617
Energy: 0.10145021248942426
Energy: 0.10040113545717963
Energy: 0.0999888700832127
Energy: 0.1026293543962985
Energy: 0.10027018671040966
Energy: 0.7660354919709421
Energy: 0.519653854539391
Energy: 0.5183850411966914
Energy: 0.5185440224548005
Energy: 0.5203731314482948
Energy: 0.5176871337065059
Energy: 0.34529289346080977
Energy: 0.10145021248975553
Energy: 0.10040113545717963
Energy: 0.0999888700832127
Energy: 0.10262935439662976
Energy: 0.1002701867100784

minimum gb energy = 0.013148029879054054 eV
minimum distance =  2.84072110692492 Angstroms
sigma value = 1