Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.614960119128228
cohesive_energy=3.540273420316517
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4503143217463098e-19, 2.16689583218598e-19, 2.71519271987346e-19, 3.1480047157822197e-19, 3.5145987514077595e-19, 3.8389113456620394e-19, 4.1236982423555394e-19, 4.36995279100134e-19, 4.58172849848346e-19, 4.76381587293756e-19, 4.920412617144719e-19, 5.05497943263438e-19, 5.1704002373477395e-19, 5.26912636153482e-19, 5.35336880895054e-19, 5.42503416978936e-19, 5.485740642451619e-19, 5.536769968244519e-19, 5.579019366083099e-19, 5.61301755425658e-19, 5.639036902792739e-19, 5.65733375995302e-19, 5.66814845223252e-19, 5.671689262593659e-19, 5.667908125737419e-19, 5.65577964861804e-19, 5.63434252525512e-19, 5.60266749320094e-19, 5.557069546197299e-19, 5.4941040044811e-19, 5.410550493017999e-19, 5.30285217968052e-19, 5.16698760111732e-19, 4.998310445089799e-19, 4.7913893328087e-19, 4.53949512241122e-19, 4.23389595124206e-19, 3.8624953857145196e-19, 3.40835841880722e-19, 2.84831757639252e-19, 2.1520917200878197e-19, 1.2810571777772818e-19, 1.8460279176947998e-20, -1.210229755318044e-19, -3.02069576044458e-19, -5.43416657660316e-19, -8.71540830126882e-19, -1.3221818476187938e-18, -1.9495926153165598e-18, -2.8463148556000197e-18, -4.2011795043757795e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013655038965429802
Energy: 0.014106988957047624
Energy: 0.014142196828457947
Energy: 0.01392996244619912
Energy: 0.3164449861337239
Energy: 0.014060004032421938
Energy: 0.014106988956734009
Energy: 0.09667109306623911
Energy: 0.09641230677795781
Energy: 0.09653637907176635
Energy: 0.09667110589766229
Energy: 0.09696401049888226
Energy: 0.014142196829050331
Energy: 0.09641230677764419
Energy: 0.09678367326066457
Energy: 0.014173255198133644
Energy: 0.09659195209034667
Energy: 0.0970240245614559
Energy: 0.013929962445885504
Energy: 0.09653637907054674
Energy: 0.014173255199353259
Energy: 0.013989606670095505
Energy: 0.09654172525282638
Energy: 0.014100136381417983
Energy: 0.316444986136198
Energy: 0.09667110589860312
Energy: 0.09659195209034667
Energy: 0.09654172525223399
Energy: 0.0966180128038335
Energy: 0.09674423645309634
Energy: 0.014060004031794707
Energy: 0.09696401049919587
Energy: 0.09702402456173466
Energy: 0.01410013638047714
Energy: 0.09674423645278271
Energy: 0.014117226527695507

minimum gb energy = 0.013655038965429802 eV
minimum distance =  2.55260921012136 Angstroms
sigma value = 1


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

Energy: 1.0572414848992384
Energy: 0.6239908256325206
Energy: 0.6285289799429622
Energy: 0.61914216039768
Energy: 0.6161975931161179
Energy: 0.6266734255435735
Energy: 0.9551964698925594
Energy: 0.5919514629926249
Energy: 0.5921382804344758
Energy: 0.61402267742695
Energy: 0.5920175853266766
Energy: 0.603105549258065
Energy: 0.9404696506786344
Energy: 0.6057833645999224
Energy: 0.6060789763278939
Energy: 0.6066812747561042
Energy: 0.5978377520752569
Energy: 0.6086590331478288
Energy: 0.9991572244936591
Energy: 0.6063369646976873
Energy: 0.606150281007531
Energy: 0.5964734290181307
Energy: 0.6071365872418779
Energy: 0.5960780050607241
Energy: 0.9261650726716609
Energy: 0.6011268936652375
Energy: 0.603023557839287
Energy: 0.6175991763443224
Energy: 0.5901785974791313
Energy: 0.60337930226732
Energy: 0.919103524678538
Energy: 0.6115408539934433
Energy: 0.6073474458698443
Energy: 0.6064801402651996
Energy: 0.6002882234582776
Energy: 0.6065745093455895
Energy: 0.9216854763128709
Energy: 0.6001250109632132
Energy: 0.6014795682413437
Energy: 0.6061835272352711
Energy: 0.599566427220034
Energy: 0.606478169052365
Energy: 0.8837406421514634
Energy: 0.6042342068341185
Energy: 0.6043190328962782
Energy: 0.5922403700749003
Energy: 0.6035211147827123
Energy: 0.5990574044377457
Energy: 0.7742808429536016
Energy: 0.6070834623327421
Energy: 0.6056968180890115
Energy: 0.6011256854151001
Energy: 0.6069126613592025
Energy: 0.6059871911683222
Energy: 0.7723469225506825
Energy: 0.6142352990148805
Energy: 0.6100672698170759
Energy: 0.5949782075428863
Energy: 0.6164306478384638
Energy: 0.6031999686519715
Energy: 0.7664516756610991
Energy: 0.5880830460379965
Energy: 0.5873723160638933
Energy: 0.6265904235128765
Energy: 0.5885098363692085
Energy: 0.5922125073473004
Energy: 0.6874913131067135
Energy: 0.6093830092826255
Energy: 0.6102519193963255
Energy: 0.59804710954749
Energy: 0.6043206002168882
Energy: 0.5919487490661127
Energy: 0.6871576949070314
Energy: 0.6161484038776824
Energy: 0.614862460867986
Energy: 0.5940737808892189
Energy: 0.6055527459887661
Energy: 0.5923371046727179
Energy: 0.7486491200177564
Energy: 0.5863030063926234
Energy: 0.5872590330645677
Energy: 0.6154451895505332
Energy: 0.5878212357622347
Energy: 0.5879552322660511
Energy: 0.7157744056920016
Energy: 0.6137544768178308
Energy: 0.6030485168246024
Energy: 0.5925551903166861
Energy: 0.6169455022467942
Energy: 0.592341382623114
Energy: 0.7166918677415629
Energy: 0.6018830124743897
Energy: 0.6011633534901664
Energy: 0.6156032135670891
Energy: 0.6021538366345975
Energy: 0.616739376368873
Energy: 0.8497791295282029
Energy: 0.6053271330313962
Energy: 0.6066662366250445
Energy: 0.5976558285281535
Energy: 0.6070040756983333
Energy: 0.6058452006704063
Energy: 0.8490930475300476
Energy: 0.6010906128216813
Energy: 0.5995361405160797
Energy: 0.5996291271972416
Energy: 0.601328491019603
Energy: 0.6162645572183681
Energy: 0.8499641188751509
Energy: 0.6102137035142612
Energy: 0.608167306577638
Energy: 0.6006190525637203
Energy: 0.5991129749767656
Energy: 0.6162041499859161
Energy: 0.8930167964213928
Energy: 0.6002882596099569
Energy: 0.6157747311309545
Energy: 0.6017062483471126
Energy: 0.5989777335229992
Energy: 0.6079744641039296
Energy: 0.9526254113511935
Energy: 0.5975164007905167
Energy: 0.5889432579196923
Energy: 0.6025939809497498
Energy: 0.5973546451470618
Energy: 0.5898539621765206
Energy: 0.9666249572934538
Energy: 0.6060803092662421
Energy: 0.6166025443392537
Energy: 0.601784793777035
Energy: 0.6068830860683667
Energy: 0.6012840483572524
Energy: 0.9553444949413019
Energy: 0.5919055515812831
Energy: 0.5920352855223087
Energy: 0.6224379903551294
Energy: 0.5951462057025549
Energy: 0.6027831881363552

minimum gb energy = 0.5863030063926234 eV
minimum distance =  2.40894792747751 Angstroms
sigma value = 33


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

Energy: 1.3162073994883248
Energy: 0.6957654534582426
Energy: 0.6788491368316497
Energy: 0.6485293751514183
Energy: 0.6711399643143124
Energy: 0.7033741994251997
Energy: 0.6353128439261213
Energy: 0.6431114495931293
Energy: 0.6147735786643294
Energy: 0.6261708004767119
Energy: 0.6444011463755631
Energy: 0.6223087846346749
Energy: 0.9280832320723731
Energy: 0.62350212830226
Energy: 0.6236324637410249
Energy: 0.6726838462988105
Energy: 0.6238743816199143
Energy: 0.6230909786525877
Energy: 0.9805209811684191
Energy: 0.7197779378215688
Energy: 0.6561499914127522
Energy: 0.6402963826237892
Energy: 0.6533019616487208
Energy: 0.661684012220311
Energy: 0.9344867449586162
Energy: 0.6296742222755438
Energy: 0.6314389689972584
Energy: 0.6119430314354447
Energy: 0.6220895860230791
Energy: 0.6306387134090619
Energy: 0.9859183648610425
Energy: 0.6539739703606005
Energy: 0.670791880783143
Energy: 0.6376576865172532
Energy: 0.6305698710765086
Energy: 0.6545778504103019
Energy: 0.9854378481420925
Energy: 0.7143637402198997
Energy: 0.675203267838066
Energy: 0.6384170560393395
Energy: 0.7145988834748336
Energy: 0.7040140954911783
Energy: 0.9336419631753432
Energy: 0.6464496428296403
Energy: 0.6432432527726355
Energy: 0.6186169574491137
Energy: 0.6480017398644309
Energy: 0.6338010575318357
Energy: 0.8201485748245005
Energy: 0.6473654941213355
Energy: 0.6974953117172361
Energy: 0.6932341764080443
Energy: 0.6451038195970336
Energy: 0.6039645756342922
Energy: 0.8252290071731124
Energy: 0.6902719095080327
Energy: 0.7143019899712577
Energy: 0.6802062008208536
Energy: 0.6844693920686018
Energy: 0.6740388159531968
Energy: 0.8095169551796257
Energy: 0.6611553287900086
Energy: 0.6548843342213027
Energy: 0.6794510351340328
Energy: 0.624071693479086
Energy: 0.664155792649613
Energy: 0.780452252394679
Energy: 0.6184116767669436
Energy: 0.6831048013316581
Energy: 0.7027768486351946
Energy: 0.6388614021001994
Energy: 0.6774529238849863
Energy: 0.7772615866621821
Energy: 0.6958134047744254
Energy: 0.7195488246698217
Energy: 0.7205072432171125
Energy: 0.6941960529534781
Energy: 0.6905876735662995
Energy: 0.8332250263803987
Energy: 0.6348735958632896
Energy: 0.661868187052388
Energy: 0.7685226226838568
Energy: 0.6348292078228503
Energy: 0.6333068510312042
Energy: 0.8130496972057545
Energy: 0.6860429096644856
Energy: 0.692165875356234
Energy: 0.6973288527824859
Energy: 0.6823805570240008
Energy: 0.6918153893400936
Energy: 0.8121149736386852
Energy: 0.7079027588558
Energy: 0.7063704567615564
Energy: 0.728681619821636
Energy: 0.7079202956739014
Energy: 0.7292387732077562
Energy: 0.9272462298658123
Energy: 0.695599362775071
Energy: 0.696513566648034
Energy: 0.7016836621402434
Energy: 0.6951196403489835
Energy: 0.7045755105965795
Energy: 0.8904279343473247
Energy: 0.7015082475085852
Energy: 0.6836033003331832
Energy: 0.645810830460246
Energy: 0.6841459716084385
Energy: 0.6431431049797168
Energy: 0.8919540677503335
Energy: 0.6825486921548974
Energy: 0.6840694639814361
Energy: 0.6455439815228914
Energy: 0.6829407625177124
Energy: 0.6904505716184672
Energy: 0.909307842774184
Energy: 0.6639090734301044
Energy: 0.664800137851176
Energy: 0.6864066366409395
Energy: 0.6739902158110682
Energy: 0.683252770857179
Energy: 1.0087968026549947
Energy: 0.7125034614630781
Energy: 0.6341440138594993
Energy: 0.5784214823086404
Energy: 0.7136901689772199
Energy: 0.6344957079988677
Energy: 0.8292345915529142
Energy: 0.6989658586275057
Energy: 0.6936633697651755
Energy: 0.5995619539446098
Energy: 0.706071489920965
Energy: 0.6653603842128356
Energy: 0.9100568283732483
Energy: 0.6821620279953822
Energy: 0.6840249679672556
Energy: 0.6811208606792076
Energy: 0.6819879300422049
Energy: 0.6870734714108213
Energy: 1.0764952401344283
Energy: 0.7186794534086012
Energy: 0.7246803970391346
Energy: 0.7067699914219219
Energy: 0.7181165266806212
Energy: 0.7060247246279636
Energy: 0.9099415258052619
Energy: 0.6928800578773912
Energy: 0.6917880490397743
Energy: 0.6772917630721348
Energy: 0.6919569350946615
Energy: 0.6928404000446059
Energy: 0.9294164477020666
Energy: 0.730725377333093
Energy: 0.7315072239324607
Energy: 0.7020444686703491
Energy: 0.7296920017522417
Energy: 0.7003174617219101
Energy: 0.974382249573223
Energy: 0.7067403560611439
Energy: 0.7119718221583061
Energy: 0.6917162795807725
Energy: 0.7158974141228824
Energy: 0.713798939221499
Energy: 0.9288039395926617
Energy: 0.6499269117918213
Energy: 0.6469847881281844
Energy: 0.7011537206791656
Energy: 0.6471540386936079
Energy: 0.6937807274913993
Energy: 0.8480611484331473
Energy: 0.6492313622775967
Energy: 0.6486754851853073
Energy: 0.685300326370849
Energy: 0.6469768011851956
Energy: 0.6825423609257945
Energy: 0.8511564997796924
Energy: 0.6918366699267944
Energy: 0.6930940373381023
Energy: 0.6801376579721115
Energy: 0.693640935546026
Energy: 0.7134602748501844
Energy: 0.8285026535104254
Energy: 0.6262766528292408
Energy: 0.6613605569909451
Energy: 0.7115264401334702
Energy: 0.6265069093590537
Energy: 0.6619588178633523
Energy: 0.7594443385040592
Energy: 0.6252258272715548
Energy: 0.623634605862866
Energy: 0.717853496083973
Energy: 0.6170784379752435
Energy: 0.7091725557279203
Energy: 0.756626335565293
Energy: 0.6938890041837642
Energy: 0.6855545257886545
Energy: 0.6905686776823475
Energy: 0.6874015634873395
Energy: 0.674018071565829
Energy: 0.7593929202985469
Energy: 0.6480567578389689
Energy: 0.630034768833343
Energy: 0.71764151174257
Energy: 0.6758255330399395
Energy: 0.627781923502384
Energy: 0.8248259065647133
Energy: 0.691814541042326
Energy: 0.6547547705355801
Energy: 0.6577524920747766
Energy: 0.6301886569042292
Energy: 0.6971803117684378
Energy: 0.821976568852132
Energy: 0.6323642394483789
Energy: 0.6459632113442316
Energy: 0.6605948353930987
Energy: 0.6365952431698949
Energy: 0.6602045380413759
Energy: 0.8248746609431156
Energy: 0.6343856998029548
Energy: 0.6622561655101965
Energy: 0.6390532253076222
Energy: 0.6362644552672941
Energy: 0.6597599623892791
Energy: 0.893054207670338
Energy: 0.6163012809584603
Energy: 0.6509928147958224
Energy: 0.645063128193888
Energy: 0.6226342388145629
Energy: 0.6304844696362657
Energy: 0.8886842471462637
Energy: 0.6246458473933342
Energy: 0.6321811451501154
Energy: 0.6458670620488579
Energy: 0.6241063404703601
Energy: 0.672882872411328
Energy: 0.9347691732802675
Energy: 0.6206516008233472
Energy: 0.6476447416949508
Energy: 0.6295501636923261
Energy: 0.6244270548220691
Energy: 0.6285564738585617
Energy: 1.0128515605897057
Energy: 0.6491014226093605
Energy: 0.6337789384814164
Energy: 0.5983471804
Energy: 0.6506353425440699
Energy: 0.6412983130073353

minimum gb energy = 0.5784214823086404 eV
minimum distance =  2.3150941355398 Angstroms
sigma value = 51


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

Energy: 1.0989046852982685
Energy: 0.6412253372432135
Energy: 0.6403558276368148
Energy: 0.6415284542449745
Energy: 0.6366046559268828
Energy: 0.6424403845064868
Energy: 0.8825644693957759
Energy: 0.636807078588236
Energy: 0.6300383813444684
Energy: 0.6516387352636177
Energy: 0.636292529232015
Energy: 0.6258528631115325
Energy: 0.961426192232619
Energy: 0.6358999918131621
Energy: 0.6365432927397255
Energy: 0.641553451155043
Energy: 0.6371639095550016
Energy: 0.6319574627953671
Energy: 0.9418652699973845
Energy: 0.6363684496948601
Energy: 0.6380246539202978
Energy: 0.6431742912787685
Energy: 0.6330021919509691
Energy: 0.6226498056254326
Energy: 0.826970605054478
Energy: 0.6516804235488812
Energy: 0.6598265398583644
Energy: 0.6537345389804758
Energy: 0.6508662199709407
Energy: 0.6596194470877697
Energy: 0.8260365025145248
Energy: 0.6528011898569223
Energy: 0.657492314974297
Energy: 0.649943507861154
Energy: 0.6503595899447097
Energy: 0.6573113433554015
Energy: 0.8275205267020801
Energy: 0.6502461488317062
Energy: 0.6591769685542879
Energy: 0.6506137311330882
Energy: 0.6508788502939824
Energy: 0.6589581226670894
Energy: 0.824660081801906
Energy: 0.6225718819797463
Energy: 0.6291806765547993
Energy: 0.6441585557781826
Energy: 0.6227039966879876
Energy: 0.6293726066003628
Energy: 0.7023117485186905
Energy: 0.622699211227597
Energy: 0.6295289197787224
Energy: 0.6371395368196106
Energy: 0.6229841409958664
Energy: 0.631257889617785
Energy: 0.7030453240705745
Energy: 0.6587436414719925
Energy: 0.6271177974904333
Energy: 0.6362820989184483
Energy: 0.6252425648735637
Energy: 0.6305108304171886
Energy: 0.7008268735740911
Energy: 0.6306477056842049
Energy: 0.6267293437397692
Energy: 0.6348853511612542
Energy: 0.6257355609126587
Energy: 0.6250684213204873
Energy: 0.7337871553824525
Energy: 0.624778023206391
Energy: 0.6409958430326479
Energy: 0.6310911639931451
Energy: 0.6303958476770295
Energy: 0.6241316272364238
Energy: 0.7320106630333036
Energy: 0.6428114557771405
Energy: 0.6464582091418931
Energy: 0.6529081054775322
Energy: 0.643448556240006
Energy: 0.6321107122386272
Energy: 0.7338260822898345
Energy: 0.6276422359631773
Energy: 0.6284193209207999
Energy: 0.6312539137213976
Energy: 0.6266814709671685
Energy: 0.6282593456712396
Energy: 0.8814185262617765
Energy: 0.6283339854558934
Energy: 0.6411306446812784
Energy: 0.6191413396053017
Energy: 0.6259050857943302
Energy: 0.6407067295520663
Energy: 0.8795881782044216
Energy: 0.6328827830125785
Energy: 0.6463884137924415
Energy: 0.6519794682029528
Energy: 0.631099598338275
Energy: 0.6195147170698385
Energy: 0.8903410291952815
Energy: 0.6347673832619618
Energy: 0.6484625487591715
Energy: 0.6511821180547799
Energy: 0.6319280375055432
Energy: 0.6414779101142788
Energy: 1.003028658742853
Energy: 0.6241725045287044
Energy: 0.6246883892963023
Energy: 0.6212150151867908
Energy: 0.6239529263680699
Energy: 0.6245497484521995

minimum gb energy = 0.6191413396053017 eV
minimum distance =  2.39248856511487 Angstroms
sigma value = 19


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

Energy: 0.9160912374550557
Energy: 0.5921648770820459
Energy: 0.5922389650625092
Energy: 0.6474001445219926
Energy: 0.5766577119053826
Energy: 0.5940570037084391
Energy: 0.9175961827413507
Energy: 0.5748236098106804
Energy: 0.574763261381504
Energy: 0.600063583533405
Energy: 0.573885987084493
Energy: 0.574522847026119
Energy: 0.9572063651965133
Energy: 0.5736640827547232
Energy: 0.5740594761467819
Energy: 0.6105772953382431
Energy: 0.5736045625777961
Energy: 0.5744544133210399
Energy: 0.7701121476767896
Energy: 0.5739174515033098
Energy: 0.5744174090573496
Energy: 0.590339270401954
Energy: 0.5743525650542316
Energy: 0.5749924539129515
Energy: 0.7782009036235537
Energy: 0.5743592861734673
Energy: 0.5980878361907671
Energy: 0.5981193408699472
Energy: 0.5744133872666003
Energy: 0.59829365306137
Energy: 0.7752643346332309
Energy: 0.5503061126726277
Energy: 0.5956947748792883
Energy: 0.5993937651646143
Energy: 0.5500975163191276
Energy: 0.5954048740510314
Energy: 0.7768625478291289
Energy: 0.5995069462940391
Energy: 0.5962062788083017
Energy: 0.6005754221475581
Energy: 0.5598556940798808
Energy: 0.5959150322152071
Energy: 0.7344336311556324
Energy: 0.5509828717262948
Energy: 0.5505083471445239
Energy: 0.5751189481387835
Energy: 0.553222237884765
Energy: 0.5504917539484818
Energy: 0.6414351165893245
Energy: 0.5508155231294775
Energy: 0.5506820920157853
Energy: 0.5739201327107067
Energy: 0.5517258359815078
Energy: 0.5506561413149901
Energy: 0.6406467568812665
Energy: 0.5748377011394208
Energy: 0.5744224925771241
Energy: 0.5738753185504798
Energy: 0.5991063023741116
Energy: 0.5742815145045483
Energy: 0.6386238177017259
Energy: 0.6122554536801686
Energy: 0.6120878603399115
Energy: 0.5727968449530776
Energy: 0.6123504651885965
Energy: 0.5745256371238966
Energy: 0.7769601589105248
Energy: 0.5990910130285142
Energy: 0.5987817909539759
Energy: 0.5741852020431569
Energy: 0.5993095022532191
Energy: 0.5741607025025545
Energy: 0.6182011324195495
Energy: 0.598140700125076
Energy: 0.5989950024302687
Energy: 0.5496828249096216
Energy: 0.5986558304193481
Energy: 0.5994361301460697
Energy: 0.7776832535880787
Energy: 0.5996723012078222
Energy: 0.5991146586212203
Energy: 0.5744199713512087
Energy: 0.6000486956778482
Energy: 0.5989187212487065
Energy: 0.9159509138341466
Energy: 0.5742983760675072
Energy: 0.5744149074342584
Energy: 0.5512062267024597
Energy: 0.5743000932415395
Energy: 0.5506145534893446
Energy: 0.9176164894465499
Energy: 0.5771651685036625
Energy: 0.5501949468635433
Energy: 0.5521236034802958
Energy: 0.5747493732605198
Energy: 0.5503228890659758
Energy: 0.7781396925398459
Energy: 0.5742979933031547
Energy: 0.5747531939399594
Energy: 0.6007877111704033
Energy: 0.5737664566532433
Energy: 0.5744444437391343
Energy: 0.7706458923986383
Energy: 0.5738077296260309
Energy: 0.5745125085938939
Energy: 0.5896894545676609
Energy: 0.5737906728876885
Energy: 0.5752603757428437
Energy: 0.772260704029871
Energy: 0.5735250841886437
Energy: 0.5737995570103834
Energy: 0.5910578789937613
Energy: 0.5735166246986896
Energy: 0.5745464911547405
Energy: 0.7776740525833551
Energy: 0.5501034554066265
Energy: 0.5967790373947558
Energy: 0.598097599868002
Energy: 0.550152111438848
Energy: 0.5962934649624335
Energy: 0.7719184177119354
Energy: 0.5977273806485965
Energy: 0.5979698818069431
Energy: 0.6003520547444334
Energy: 0.5981460639284704
Energy: 0.5985135246599168
Energy: 0.7772002110169266
Energy: 0.5998389286383367
Energy: 0.5993775308499467
Energy: 0.5995205640802836
Energy: 0.5998256906115844
Energy: 0.5988262737376848
Energy: 0.7358456497857522
Energy: 0.648202739902574
Energy: 0.6103415756512245
Energy: 0.6712534614099113
Energy: 0.6480130522551522
Energy: 0.6106243319733445
Energy: 0.6410111798976467
Energy: 0.5751591185075511
Energy: 0.5745548991217986
Energy: 0.5739963791148186
Energy: 0.585118079279519
Energy: 0.5744002762583459
Energy: 0.6409346103452356
Energy: 0.6162381874261791
Energy: 0.5740102396483802
Energy: 0.5736801849225202
Energy: 0.6220676712121743
Energy: 0.5740500698195881
Energy: 0.7365525214595355
Energy: 0.5906235719745457
Energy: 0.5906765148622765
Energy: 0.6726221897000015
Energy: 0.590481132083897
Energy: 0.5741200115939129
Energy: 0.7773112356174018
Energy: 0.5991845312346968
Energy: 0.5986645932772252
Energy: 0.5994020967453876
Energy: 0.5981819411925186
Energy: 0.5982705090752009
Energy: 0.6190804405225092
Energy: 0.5982078657640743
Energy: 0.5961033162124587
Energy: 0.5500805745516226
Energy: 0.5989592965730328
Energy: 0.5953460053409754
Energy: 0.7342062403761589
Energy: 0.5992754216510505
Energy: 0.5971707203845046
Energy: 0.5596972027468371
Energy: 0.5996742932834486
Energy: 0.5962989585231401
Energy: 0.9151893454040521
Energy: 0.5751831663234933
Energy: 0.5506468335989254
Energy: 0.5526005227184199
Energy: 0.5745511196954994
Energy: 0.5506468626952563

minimum gb energy = 0.5496828249096216 eV
minimum distance =  2.42306064475063 Angstroms
sigma value = 27


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

Energy: 0.7623236065168607
Energy: 0.6739720894481802
Energy: 0.6740158301821807
Energy: 0.5792765412745874
Energy: 1.1914713308837224
Energy: 0.6741309816020448
Energy: 0.6773279994001997
Energy: 0.6226741695365995
Energy: 0.5706518184398659
Energy: 0.5648958964682123
Energy: 0.6225108327305464
Energy: 0.5595416637440287
Energy: 0.6867922121551959
Energy: 0.620582301989736
Energy: 0.5703924494493674
Energy: 0.5723884611243538
Energy: 0.6191566396920211
Energy: 0.5695212172185921
Energy: 0.754264022264452
Energy: 0.5765165453356945
Energy: 0.5689188305077306
Energy: 0.6062325016647555
Energy: 0.6047447091679115
Energy: 0.5545909988044637
Energy: 0.7559938469879539
Energy: 0.5382192433569747
Energy: 0.5653917076603243
Energy: 0.6051883728910427
Energy: 0.5255797308931935
Energy: 0.5695738901835399
Energy: 0.6420302556021509
Energy: 0.5224241147932354
Energy: 0.5240193207400701
Energy: 0.6187678554187724
Energy: 0.522990891033391
Energy: 0.5380696561982309
Energy: 0.6456776873186013
Energy: 0.5636798474074975
Energy: 0.5696546745247096
Energy: 0.6209602479001045
Energy: 0.5649965625680964
Energy: 0.5693294689275458
Energy: 0.6451520351707973
Energy: 0.5625454043125536
Energy: 0.5603946794143115
Energy: 0.622322301801576
Energy: 0.5786276685547267
Energy: 0.5649565721614217
Energy: 0.6862912746876214
Energy: 0.5628697581421694
Energy: 0.5598684256424192
Energy: 0.622847208254894
Energy: 0.5758980223935202
Energy: 0.5546852299055759
Energy: 0.6869777589507305
Energy: 0.5709150971123355
Energy: 0.5824555246153335
Energy: 0.57939270702046
Energy: 0.5765932162710918
Energy: 0.5810011151127806
Energy: 0.6878934270197465
Energy: 0.5746182361634875
Energy: 0.5758134398698769
Energy: 0.5799236986331052
Energy: 0.575876561093229
Energy: 0.5781035119032397
Energy: 0.6859897863470138
Energy: 0.5689981277064069
Energy: 0.5690055616214077
Energy: 0.5654426038625032
Energy: 0.570467637906413
Energy: 0.5595431932148678

minimum gb energy = 0.5224241147932354 eV
minimum distance =  2.43625009630883 Angstroms
sigma value = 9


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

Energy: 1.384645721125069
Energy: 0.5458825392852779
Energy: 0.5898756758056116
Energy: 0.5046624298209298
Energy: 0.5126965155954993
Energy: 0.4911958776376915
Energy: 0.5312180252490492
Energy: 0.5010610581496254
Energy: 0.5301188800902477
Energy: 0.5014335460409146
Energy: 0.5306870531742643
Energy: 0.49942783984091244
Energy: 0.576536112057549
Energy: 0.52570528295062
Energy: 0.5270262962377807
Energy: 0.5291171459958337
Energy: 0.5276190168895051
Energy: 0.5013620171954936
Energy: 0.577830343735142
Energy: 0.513549964141896
Energy: 0.5133882040753305
Energy: 0.5347012801152942
Energy: 0.5284838225231469
Energy: 0.5006755283304078
Energy: 0.6116673597690105
Energy: 0.5339076067785302
Energy: 0.5418146951997422
Energy: 0.5554638571321442
Energy: 0.5337735116939003
Energy: 0.5170525056316134
Energy: 0.5704047879015363
Energy: 0.5538800344254998
Energy: 0.5122837017693302
Energy: 0.5804379015136137
Energy: 0.5526523967459231
Energy: 0.5042073360755305
Energy: 0.5714623061916606
Energy: 0.5013233439464903
Energy: 0.5013458095374388
Energy: 0.5677612969867853
Energy: 0.5015984641117699
Energy: 0.5575116581270929
Energy: 0.5720649388183722
Energy: 0.5332402401117772
Energy: 0.5399739112934289
Energy: 0.5120439686816688
Energy: 0.5444845598174072
Energy: 0.5205115490124101
Energy: 0.5480470955740271
Energy: 0.5536533013457816
Energy: 0.5443155125272304
Energy: 0.560055426640859
Energy: 0.5524241687321829
Energy: 0.5374120134220363
Energy: 0.5306015780930532
Energy: 0.5117727985747037
Energy: 0.5109554304650693
Energy: 0.5430462362626681
Energy: 0.5410625322082023
Energy: 0.49690099574712776
Energy: 0.5306695621217603
Energy: 0.5553986810082855
Energy: 0.5487772717296209
Energy: 0.5370590067419027
Energy: 0.5536736140608148
Energy: 0.5325782130117784
Energy: 0.6179949571401516
Energy: 0.5627843263328389
Energy: 0.5570495403317527
Energy: 0.5133853931240054
Energy: 0.5680772565070593
Energy: 0.5063051051825359
Energy: 0.7869973647897025
Energy: 0.5705666705101432
Energy: 0.5460132282900382
Energy: 0.5006224529059732
Energy: 0.5528465295986679
Energy: 0.5301755622062144
Energy: 0.6191015567866687
Energy: 0.5140521705688493
Energy: 0.5168810030818921
Energy: 0.5139916677343652
Energy: 0.5517143406696974
Energy: 0.5184848492122164
Energy: 0.5570045674949471
Energy: 0.511214355233488
Energy: 0.5101187729532949
Energy: 0.5319478537681337
Energy: 0.5149582795002247
Energy: 0.5618874069623675
Energy: 0.5566310884016323
Energy: 0.5000894620651892
Energy: 0.5038518107073894
Energy: 0.5401459011024548
Energy: 0.5329823236069745
Energy: 0.5148879722181894
Energy: 0.5562027140274673
Energy: 0.49819855415049935
Energy: 0.4922496432842228
Energy: 0.53051223561319
Energy: 0.5114677089655595
Energy: 0.503663005750248
Energy: 0.6019394364869324
Energy: 0.4870724688325055
Energy: 0.49947737276907583
Energy: 0.5361962431654587
Energy: 0.5077387007378243
Energy: 0.5055633728037335
Energy: 0.5772826312841195
Energy: 0.4975860090531351
Energy: 0.4995379467832634
Energy: 0.5104871169954401
Energy: 0.5083798194234763
Energy: 0.5016946240098461
Energy: 0.5747574613466209
Energy: 0.5095131683423134
Energy: 0.49967537688160024
Energy: 0.509365699404457
Energy: 0.5091918227750563
Energy: 0.500912495544753
Energy: 0.576602367964648
Energy: 0.49879714761646426
Energy: 0.502767492041554
Energy: 0.5198839526883581
Energy: 0.5107596128129589
Energy: 0.49990977729050495
Energy: 0.5935582517740737
Energy: 0.5157737007092024
Energy: 0.5081646379361245
Energy: 0.5006068692920509
Energy: 0.5169111593769321
Energy: 0.516002274935151
Energy: 0.5909729930944503
Energy: 0.5179532326085718
Energy: 0.5112267291181534
Energy: 0.5320546134800772
Energy: 0.5305139058750432
Energy: 0.4815729368756592
Energy: 0.5764993793188644
Energy: 0.5264769036400567
Energy: 0.5139956632447638
Energy: 0.5271990499739367
Energy: 0.53970237403374
Energy: 0.5169676882765124
Energy: 0.7997313691123143
Energy: 0.5312324993687663
Energy: 0.5596908223243854
Energy: 0.5469065990978705
Energy: 0.5445457460984205
Energy: 0.5602194066718432
Energy: 0.5760903039655038
Energy: 0.5009059353229397
Energy: 0.5176669702882208
Energy: 0.5271139154347593
Energy: 0.5138656663316626
Energy: 0.5169000638050334
Energy: 0.5489018927356202
Energy: 0.5123622506108223
Energy: 0.5252963692354972
Energy: 0.5473800006576915
Energy: 0.5135858131413003
Energy: 0.5092510632945139
Energy: 0.5711585821289251
Energy: 0.5011574607214323
Energy: 0.4942272166652649
Energy: 0.5685350106579886
Energy: 0.5144207988619462
Energy: 0.4937679222491918
Energy: 0.5710423678531625
Energy: 0.5215771416816306
Energy: 0.5475465417705859
Energy: 0.5682319241641137
Energy: 0.5527303518410043
Energy: 0.548546114744874
Energy: 0.5479514276162034
Energy: 0.5338532018235107
Energy: 0.5289643888766754
Energy: 0.5296419092768775
Energy: 0.5330208883308225
Energy: 0.5018370855354327
Energy: 0.5307853745661728
Energy: 0.5067902667855049
Energy: 0.5347782571643194
Energy: 0.5703001539660567
Energy: 0.5392437139577579
Energy: 0.5432408271231962
Energy: 0.5304746084807359
Energy: 0.5517236214481057
Energy: 0.5182400555020558
Energy: 0.5433120823421358
Energy: 0.5517951096965233
Energy: 0.5052892573432749
Energy: 0.5636854054667465
Energy: 0.5608668408255832
Energy: 0.5562914864648901
Energy: 0.5583161101425281
Energy: 0.5680536403536062
Energy: 0.5335860806635905
Energy: 0.5631181316926891
Energy: 0.5515224151791855
Energy: 0.532309750132155
Energy: 0.5299149481822376
Energy: 0.5682232388980735
Energy: 0.4920375377942382
Energy: 0.5614896319825764
Energy: 0.5164107413315033
Energy: 0.501885475985459
Energy: 0.5561726972647592
Energy: 0.5549039422940649
Energy: 0.5165011890649038
Energy: 0.5641601073067758
Energy: 0.5093888338867725
Energy: 0.5008651334607603
Energy: 0.5420809818629585
Energy: 0.5120570712866793
Energy: 0.500257843455496
Energy: 0.5559025706158625
Energy: 0.530619489417419
Energy: 0.5027928054632264
Energy: 0.5409423435120242
Energy: 0.5442785625113752
Energy: 0.5184916551246608
Energy: 0.556474047574333
Energy: 0.5027390628426358
Energy: 0.5031576297367303
Energy: 0.5305760830868024
Energy: 0.5006159081809174
Energy: 0.5279435016441753
Energy: 0.5424244159352217
Energy: 0.5055286281425615
Energy: 0.5394278124131815
Energy: 0.5339112867095629
Energy: 0.4965380851198073
Energy: 0.537610868463931
Energy: 0.5777376499302004
Energy: 0.5025266588648579
Energy: 0.5032544047816561
Energy: 0.5298046233055081
Energy: 0.5020763847035846
Energy: 0.5052857005535579
Energy: 0.5724910950205132
Energy: 0.5024921677614981
Energy: 0.5034988382610972
Energy: 0.5090988052598941
Energy: 0.5003425283240381
Energy: 0.5012914038189816
Energy: 0.5772749155865288
Energy: 0.5102354284769923
Energy: 0.5145420785867095
Energy: 0.499133286997008
Energy: 0.5098005695110019
Energy: 0.4984507470440834
Energy: 0.5911732072442671
Energy: 0.5002677491016233
Energy: 0.5060560948072845
Energy: 0.5325705297299355
Energy: 0.5102838939127221
Energy: 0.4811859332168334

minimum gb energy = 0.4811859332168334 eV
minimum distance =  2.39257695564962 Angstroms
sigma value = 57


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

Energy: 0.5220255086731107
Energy: 0.475595827691428
Energy: 0.2524200578275827
Energy: 0.2491681256303126
Energy: 0.46634849945714835
Energy: 0.4979107946000949
Energy: 0.4507807371276716
Energy: 0.4331735420436298
Energy: 0.44407958582281953
Energy: 0.4794693257695356
Energy: 0.45018380846146483
Energy: 0.4486235599847347
Energy: 0.6373798489553081
Energy: 0.43786957170585333
Energy: 0.4387470328856633
Energy: 0.44369816229420944
Energy: 0.45279494166944323
Energy: 0.5744070481748533
Energy: 0.6374037049097456
Energy: 0.45268526899863637
Energy: 0.5742994589932733
Energy: 0.5707398468531071
Energy: 0.4858648045020377
Energy: 0.44764128192164304
Energy: 0.6319894807672848
Energy: 0.3810061109667827
Energy: 0.37817760754101337
Energy: 0.4867928864644241
Energy: 0.2507004726681861
Energy: 0.5766462103553703
Energy: 0.565992061609835
Energy: 0.38264788430593966
Energy: 0.3855263924394143
Energy: 0.5726737816133487
Energy: 0.25337585072678476
Energy: 0.26497166998531096
Energy: 0.5671400067031138
Energy: 0.5725952792271823
Energy: 0.5728534034265428
Energy: 0.5665771351679478
Energy: 0.584977645946212
Energy: 0.5728711826566718
Energy: 0.7302864440203329
Energy: 0.6643218990206616
Energy: 0.685245141332703
Energy: 0.6381041888999023
Energy: 0.6698124820329712
Energy: 0.7056034269134653
Energy: 0.6706404345857787
Energy: 0.47060407385387576
Energy: 0.6737263471149058
Energy: 0.6757926457443527
Energy: 0.666546516472214
Energy: 0.6845431859764431
Energy: 0.24967793964676271
Energy: 0.6854269497078146
Energy: 0.2537799722343115
Energy: 0.25008793930773165
Energy: 0.6945981236704395
Energy: 0.26494230688772846
Energy: 0.249742613416492
Energy: 0.47755059485683865
Energy: 0.6666376711029581
Energy: 0.2502938311972662
Energy: 0.6472034671990495
Energy: 0.25235829042983077
Energy: 0.6865218323149876
Energy: 0.6625206775181303
Energy: 0.6908751205087703
Energy: 0.6739211251508068
Energy: 0.668816341582772
Energy: 0.6809853064693665
Energy: 0.6851179332746449
Energy: 0.5864482504462717
Energy: 0.5748629948371049
Energy: 0.5933919602778887
Energy: 0.5985795722023665
Energy: 0.5978627418115541
Energy: 0.5849411189580834
Energy: 0.5861137121168137
Energy: 0.584473707502009
Energy: 0.5685020217542955
Energy: 0.5874542896216935
Energy: 0.5771286405965428
Energy: 0.5838455181848659
Energy: 0.2545967650913487
Energy: 0.2520670340282595
Energy: 0.5882785751924815
Energy: 0.3811417980907842
Energy: 0.38765208912312654
Energy: 0.6047719164202812
Energy: 0.5638279362960982
Energy: 0.5762248924532082
Energy: 0.47025338209058615
Energy: 0.38792493427797237
Energy: 0.5729626206381447
Energy: 0.6089460807068041
Energy: 0.44803971415598465
Energy: 0.43721563537217223
Energy: 0.5685783255450696
Energy: 0.5886976125076464
Energy: 0.45088421955835284
Energy: 0.6372486151454702
Energy: 0.4712310729367551
Energy: 0.45096534084402523
Energy: 0.45243632151025875
Energy: 0.4710709206546131
Energy: 0.4716796987922597
Energy: 0.501968285293799
Energy: 0.4323334463595483
Energy: 0.44374825200539764
Energy: 0.25042808058450144
Energy: 0.43329801369876886
Energy: 0.4507290432463489

minimum gb energy = 0.2491681256303126 eV
minimum distance =  2.3848395984424 Angstroms
sigma value = 11


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

Energy: 0.8495249764070926
Energy: 0.4391928342910206
Energy: 0.48749212427454874
Energy: 0.497527298544294
Energy: 0.4745531427280838
Energy: 0.48466440485389467
Energy: 0.4409758631438227
Energy: 0.43780882226227535
Energy: 0.43088355277806684
Energy: 0.4318612283806769
Energy: 0.4266979812612754
Energy: 0.43265178341914723
Energy: 0.4304180261490351
Energy: 0.43340420996852236
Energy: 0.4350648048926473
Energy: 0.42791608960381655
Energy: 0.433125761266318
Energy: 0.43261432474401756
Energy: 0.4299387312395264
Energy: 0.43820714223474094
Energy: 0.4397618852263484
Energy: 0.42754281984032266
Energy: 0.43119025168621783
Energy: 0.4340598562518274
Energy: 0.4277101777258266
Energy: 0.4846781584315719
Energy: 0.4619360829935162
Energy: 0.43838225510316753
Energy: 0.4685212384946207
Energy: 0.4381882355982474
Energy: 0.4665095142144448
Energy: 0.4656878223686046
Energy: 0.47212254154386946
Energy: 0.435801207649657
Energy: 0.43915030682103195
Energy: 0.46496777040710835
Energy: 0.4673717306210532
Energy: 0.42929112017968174
Energy: 0.43248008654744263
Energy: 0.42610277963120663
Energy: 0.43208469414560324
Energy: 0.429164966011139
Energy: 0.4455948892805565
Energy: 0.5140705422895231
Energy: 0.5144415367873294
Energy: 0.44062798342254217
Energy: 0.5146666001397324
Energy: 0.43327448049670914
Energy: 0.4675984610034456
Energy: 0.43411704717048555
Energy: 0.44256686114549154
Energy: 0.4408819113933923
Energy: 0.42694396307290955
Energy: 0.44285731991692384
Energy: 0.6204224064360248
Energy: 0.45595409158019984
Energy: 0.4662116871950279
Energy: 0.4304984080683958
Energy: 0.46256427097966585
Energy: 0.46636339038693625
Energy: 0.4941620128063342
Energy: 0.4536415982329576
Energy: 0.46098470000089015
Energy: 0.46405264031854965
Energy: 0.45972769275465447
Energy: 0.48426133172831
Energy: 0.5574968325391886
Energy: 0.4193521306267599
Energy: 0.4397380361575303
Energy: 0.4826286287545373
Energy: 0.41603838188243536
Energy: 0.43884505050357014
Energy: 0.6180376978198382
Energy: 0.4211757602641991
Energy: 0.4425782878789451
Energy: 0.5238994467314394
Energy: 0.41745074447018904
Energy: 0.4419341136991804
Energy: 0.5318183367393161
Energy: 0.48557476584337944
Energy: 0.4832163441040462
Energy: 0.4500438386837299
Energy: 0.48523296440716196
Energy: 0.48432290870258116
Energy: 0.5350668408170253
Energy: 0.46549829871426884
Energy: 0.46960796756855333
Energy: 0.4701221575352107
Energy: 0.4662043556104257
Energy: 0.46006374755858287
Energy: 0.6649701255241084
Energy: 0.48942082946982896
Energy: 0.48643904717197345
Energy: 0.45450762884844703
Energy: 0.4679151622272946
Energy: 0.484455483686554
Energy: 0.7257528488177718
Energy: 0.4648552919165681
Energy: 0.42538116726939
Energy: 0.43694491233128163
Energy: 0.47113927210192963
Energy: 0.4251101580706663
Energy: 0.502801733526484
Energy: 0.45501736564246886
Energy: 0.4877919849664604
Energy: 0.4435482661119299
Energy: 0.4601138736240916
Energy: 0.48832266808372893
Energy: 0.49871589855212456
Energy: 0.43068180218305097
Energy: 0.46653072695932524
Energy: 0.4343059319547146
Energy: 0.43458522332290556
Energy: 0.46698485336536893
Energy: 0.5888897663857714
Energy: 0.4438222386456819
Energy: 0.5242604473350612
Energy: 0.4441465038944866
Energy: 0.5525461290634942
Energy: 0.4536780167702368
Energy: 0.6643789220937139
Energy: 0.46619165695750303
Energy: 0.4655855801260747
Energy: 0.4645705849765609
Energy: 0.48786693695008526
Energy: 0.4555500927655484
Energy: 0.4293886779943175
Energy: 0.49470066757904535
Energy: 0.4936178695433111
Energy: 0.4578160260633065
Energy: 0.4989634475940753
Energy: 0.48764235729718997
Energy: 0.4295616253597651
Energy: 0.46443628387014907
Energy: 0.4618100057559095
Energy: 0.43238869490176046
Energy: 0.4637680750363009
Energy: 0.4555622297192377
Energy: 0.5149386597959542
Energy: 0.43090155811112485
Energy: 0.43261338922398235
Energy: 0.5152552512170744
Energy: 0.42921643895688183
Energy: 0.4326029983456476
Energy: 0.5151730082054713
Energy: 0.42800501761713144
Energy: 0.44275479757448155
Energy: 0.47008983133052
Energy: 0.42689329859139197
Energy: 0.4323534324335309
Energy: 0.49264461532387877
Energy: 0.4286502481360929
Energy: 0.4382042967639563
Energy: 0.4636235356561717
Energy: 0.4388497942718553
Energy: 0.46237729955511975

minimum gb energy = 0.41603838188243536 eV
minimum distance =  2.40551165803517 Angstroms
sigma value = 41


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

Energy: 0.711288686940071
Energy: 0.4961080122124774
Energy: 0.49197345106587326
Energy: 0.47703867234285025
Energy: 0.5188038660305475
Energy: 0.4878136925591132
Energy: 0.488842594252304
Energy: 0.47631332418524874
Energy: 0.46957851247422616
Energy: 0.4649200848553173
Energy: 0.4749702348164846
Energy: 0.46339947901846923
Energy: 0.4719716705622601
Energy: 0.47106768403089877
Energy: 0.46535055900243094
Energy: 0.4680953577751821
Energy: 0.47015799682609555
Energy: 0.4654324118002474
Energy: 0.4722133036877658
Energy: 0.4722023795897231
Energy: 0.4647979054867609
Energy: 0.46808431143900875
Energy: 0.4686987749546402
Energy: 0.46673083467881965
Energy: 0.4679808766171675
Energy: 0.479320149685833
Energy: 0.47727796761955976
Energy: 0.4747183120155735
Energy: 0.47883433877801035
Energy: 0.4636468880767512
Energy: 0.528764991652556
Energy: 0.4736483390197963
Energy: 0.6038576410111661
Energy: 0.47859223412788904
Energy: 0.46763135644340525
Energy: 0.6037999231622931
Energy: 0.5295180947055828
Energy: 0.46647578548211965
Energy: 0.4675279017885395
Energy: 0.46525200984419374
Energy: 0.4756128082697945
Energy: 0.4713549348542388
Energy: 0.49032774582522304
Energy: 0.6060737327402514
Energy: 0.6060799196290492
Energy: 0.4457556038530433
Energy: 0.6060973871365319
Energy: 0.4576478042033062
Energy: 0.5291311125739475
Energy: 0.4659706179901007
Energy: 0.4636183340775013
Energy: 0.4760767735239578
Energy: 0.46934900433987053
Energy: 0.4641996225913399
Energy: 0.5275612169056325
Energy: 0.4782587430388002
Energy: 0.472134582262811
Energy: 0.4665893569965707
Energy: 0.6042315065767141
Energy: 0.470853693054342
Energy: 0.527442765801613
Energy: 0.47588421936170916
Energy: 0.4770190084790123
Energy: 0.46607915210841344
Energy: 0.4667285882090856
Energy: 0.4776902255731574
Energy: 0.5328854652956481
Energy: 0.45631740191190084
Energy: 0.456644392194019
Energy: 0.4776542721570846
Energy: 0.44631165590718647
Energy: 0.4715202743827526
Energy: 0.6046487956681555
Energy: 0.44559156242681164
Energy: 0.4457698265021392
Energy: 0.6142601112343617
Energy: 0.4465204181085299
Energy: 0.44587143654718536
Energy: 0.4718692477237948
Energy: 0.4694837558276222
Energy: 0.4770300018033835
Energy: 0.4655152772003832
Energy: 0.4762005060847393
Energy: 0.46444126174560524
Energy: 0.6048705989821423
Energy: 0.47788545770875274
Energy: 0.46389067846101395
Energy: 0.605065667315431
Energy: 0.49238131757975667
Energy: 0.6057952457602335
Energy: 0.4684798206637363
Energy: 0.47667224376458894
Energy: 0.47093023726736133
Energy: 0.4751029518801577
Energy: 0.4747921810745941
Energy: 0.4656359983262325
Energy: 0.9531336958378578
Energy: 0.47620308802759465
Energy: 0.46551524608737066
Energy: 0.4452353117180384
Energy: 0.4699588466086232
Energy: 0.6285855540578029
Energy: 0.4883016880160522
Energy: 0.4675939305187674
Energy: 0.46813331293502963
Energy: 0.45687165461469825
Energy: 0.47841937088593567
Energy: 0.44697438831278946
Energy: 0.47135037355868514
Energy: 0.4689335586850731
Energy: 0.4681243310850368
Energy: 0.46669865156258833
Energy: 0.46859400737604345
Energy: 0.47139883381227576
Energy: 0.46975624912432096
Energy: 0.46738967357425154
Energy: 0.4641677121839384
Energy: 0.4677907137928819
Energy: 0.46822134456960485
Energy: 0.4665653812459403
Energy: 0.46821576302630424
Energy: 0.4678752633514242
Energy: 0.46307077804750085
Energy: 0.48225544173898033
Energy: 0.46529639117324156
Energy: 0.4644771682245182
Energy: 0.6732887392708448
Energy: 0.4824739667169948
Energy: 0.49140702097550026
Energy: 0.6719905732931388
Energy: 0.4915348793537031
Energy: 0.47458350066120164
Energy: 0.5289419776108566
Energy: 0.4688915770378712
Energy: 0.4648600458215871
Energy: 0.4744334727901897
Energy: 0.4689509969067717
Energy: 0.46442933210327
Energy: 0.49010342610938923
Energy: 0.4675679448244601
Energy: 0.6014404244774029
Energy: 0.4453580610686083
Energy: 0.6060624969996822
Energy: 0.457822305137635
Energy: 0.5296562980695929
Energy: 0.4673158305958981
Energy: 0.4676727634225401
Energy: 0.47533599866018716
Energy: 0.4660419802663858
Energy: 0.4706178209799411
Energy: 0.5271666586484579
Energy: 0.4674027687749388
Energy: 0.46805004044777204
Energy: 0.46654463980062555
Energy: 0.47505974427668074
Energy: 0.4787236273613347
Energy: 0.5270952156389903
Energy: 0.6152976975320709
Energy: 0.47180851013985386
Energy: 0.4664266844329024
Energy: 0.6025435417116494
Energy: 0.4707143417711509
Energy: 0.5271903026707335
Energy: 0.46552518757427314
Energy: 0.4733645630524048
Energy: 0.4737993277481831
Energy: 0.4569022389242331
Energy: 0.46669811310160614
Energy: 0.6045327213635168
Energy: 0.4452745979983441
Energy: 0.7509271517457243
Energy: 0.6194803215506344
Energy: 0.46547811535639405
Energy: 0.7508078274097693
Energy: 0.4707548097419597
Energy: 0.476319138058753
Energy: 0.4721235230244982
Energy: 0.46912216779425014
Energy: 0.4747520786811789
Energy: 0.47823703742886753
Energy: 0.6072114949654316
Energy: 0.46405110075381706
Energy: 0.46722957034423507
Energy: 0.6072072257929887
Energy: 0.46958080858310436
Energy: 0.6063040739146744
Energy: 0.4693135838052874
Energy: 0.4777704673179136
Energy: 0.4739107868426614
Energy: 0.46816536203787107
Energy: 0.46589967680224786
Energy: 0.4688703915374879
Energy: 0.561104598650535
Energy: 0.4753348374285428
Energy: 0.4474648367423367
Energy: 0.4491638899985088
Energy: 0.48720857390325645
Energy: 0.4482592137208844

minimum gb energy = 0.4452353117180384 eV
minimum distance =  2.4045314515095 Angstroms
sigma value = 33


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

Energy: 0.6175410869960672
Energy: 0.5487010259765583
Energy: 0.9679830904385464
Energy: 0.4979826736820328
Energy: 0.5546885727042558
Energy: 0.5023202163213867
Energy: 0.5524087963033026
Energy: 0.5180973473394409
Energy: 0.5168420040159232
Energy: 0.5162832064979903
Energy: 0.5153266189274236
Energy: 0.5048074104899152
Energy: 0.5272797038599901
Energy: 0.5091181146276146
Energy: 0.5084313941297397
Energy: 0.5189763180493615
Energy: 0.5079381343445778
Energy: 0.5082176823233472
Energy: 0.5287544867991162
Energy: 0.5185644044575374
Energy: 0.5064720413548867
Energy: 0.519470918865658
Energy: 0.5073830586637538
Energy: 0.5208712975288909
Energy: 0.5227273117116172
Energy: 0.5196164499260104
Energy: 0.4919544032831982
Energy: 0.5185195154142765
Energy: 0.5314994585853071
Energy: 0.49177404611088105
Energy: 0.6091532345100166
Energy: 0.5058146404562932
Energy: 0.5038126792409132
Energy: 0.5193789424092008
Energy: 0.5213819021541837
Energy: 0.5062387012073404
Energy: 0.5547338043327603
Energy: 0.5166667232033465
Energy: 0.5186081544012875
Energy: 0.515596891277276
Energy: 0.5307180372105528
Energy: 0.5048459832577257
Energy: 0.6149677513509637
Energy: 0.7364609064571214
Energy: 0.49803435405780905
Energy: 0.4911650733889983
Energy: 0.7387382701824295
Energy: 0.4993084868085451
Energy: 0.5545935015374351
Energy: 0.5067360359939289
Energy: 0.5073901252921665
Energy: 0.5357929116599589
Energy: 0.49093433434697237
Energy: 0.49340407740748804
Energy: 0.5566534604463919
Energy: 0.5102269415374081
Energy: 0.5098563627665874
Energy: 0.5223615994726493
Energy: 0.5066682822421081
Energy: 0.5092542516800029
Energy: 0.556184273505365
Energy: 0.50712591148056
Energy: 0.5063619245009328
Energy: 0.5166713397594607
Energy: 0.5324100922834979
Energy: 0.5048635428901048
Energy: 0.5552610046131399
Energy: 0.5306061504579028
Energy: 0.48851420206926904
Energy: 0.5376111350495726
Energy: 0.507589743013645
Energy: 0.48896802781412746
Energy: 0.5632316740299673
Energy: 0.48947489580149084
Energy: 0.4890288173714107
Energy: 0.5135983902932596
Energy: 0.49396037622142136
Energy: 0.4891651841823512
Energy: 0.524017558558543
Energy: 0.5172151630659335
Energy: 0.504280970927626
Energy: 0.5168647041974141
Energy: 0.530905773721986
Energy: 0.5039467992695107
Energy: 0.5011793929526323
Energy: 0.5075284193181766
Energy: 0.5078160582176922
Energy: 0.5080741652356825
Energy: 0.5071945486830992
Energy: 0.5181208139937106
Energy: 0.5224634274274056
Energy: 0.5305462286393892
Energy: 0.5176833928147185
Energy: 0.5303727915793178
Energy: 0.5156300333061107
Energy: 0.5039095120930949
Energy: 0.60206536603384
Energy: 0.5083065786345187
Energy: 0.5338690946577466
Energy: 0.5239657223870405
Energy: 0.5093350740342467
Energy: 0.5118538388189176
Energy: 0.5574666208597693
Energy: 0.4938120924711813
Energy: 0.4923285518249893
Energy: 0.530510606575201
Energy: 0.5363627861145197
Energy: 0.49184497761771523
Energy: 0.5269973616872624
Energy: 0.49507154693590394
Energy: 0.4904085445246987
Energy: 0.5078218511865306
Energy: 0.535069707839741
Energy: 0.5171725471661628
Energy: 0.49395668848056534
Energy: 0.4907652046139304
Energy: 0.49110293578169434
Energy: 0.49427410667492555
Energy: 0.5347786435161237
Energy: 0.506481071073592
Energy: 0.490358705258294
Energy: 0.5175765395355671
Energy: 0.4930929436462894
Energy: 0.4910639463388835
Energy: 0.493739493693958
Energy: 0.4920392880556731
Energy: 0.5317536016543262
Energy: 0.5094026631335663
Energy: 0.5093682100297381
Energy: 0.5076558097175671
Energy: 0.5108290628479201
Energy: 0.5101230989578395
Energy: 0.5227676812168185
Energy: 0.5169632536592549
Energy: 0.5156269412143601
Energy: 0.503613172998114
Energy: 0.5290373275689056
Energy: 0.49329914042185435
Energy: 0.5532531577570237
Energy: 0.5182546744680914
Energy: 0.4893754286766804
Energy: 0.49994128973931157
Energy: 0.5201113207268022
Energy: 0.4890568194026876
Energy: 0.5530317566030346
Energy: 0.5294607952197793
Energy: 0.5042793408681774
Energy: 0.5151383158324683
Energy: 0.517985735045668
Energy: 0.504572586911271
Energy: 0.5295094578139788
Energy: 0.5205550172077149
Energy: 0.5080090483670318
Energy: 0.519694453917606
Energy: 0.5221480429448947
Energy: 0.5082319218111029
Energy: 0.5269774459236526
Energy: 0.5060181582773974
Energy: 0.5048260907781397
Energy: 0.5187665458693809
Energy: 0.5182534725036201
Energy: 0.5068946809097411
Energy: 0.5230818603006813
Energy: 0.5060589872649308
Energy: 0.49180058100933544
Energy: 0.5172102631182883
Energy: 0.5286100121198908
Energy: 0.5039923916408788
Energy: 0.5339661056643821
Energy: 0.506381337134487
Energy: 0.5068533665356725
Energy: 0.5356295253089245
Energy: 0.5077263618418059
Energy: 0.5088626683192107
Energy: 0.5543344528770744
Energy: 0.5080563039043693
Energy: 0.5106019913123311
Energy: 0.5152505714133306
Energy: 0.5049495343866042
Energy: 0.5044630493968405
Energy: 0.6161842601867326
Energy: 0.506535911542394
Energy: 0.4977866191246268
Energy: 0.4906430403298861
Energy: 0.5067609174208564
Energy: 0.4984908336534019
Energy: 0.5558070515585539
Energy: 0.506708504938286
Energy: 0.5061285671834209
Energy: 0.5339186427687698
Energy: 0.49224831057207424
Energy: 0.49364152302679576
Energy: 0.5566541830585223
Energy: 0.5290574601332103
Energy: 0.5073615144332713
Energy: 0.5192883141428067
Energy: 0.522906788058538
Energy: 0.5065692951417886
Energy: 0.5563493797475919
Energy: 0.5410063747319492
Energy: 0.5072764075056857
Energy: 0.5189424956034505
Energy: 0.5280274232464843
Energy: 0.5058628745291893
Energy: 0.5560312064760792
Energy: 0.5235783305421325
Energy: 0.48949101241075044
Energy: 0.5366719171591933
Energy: 0.5246565747197307
Energy: 0.4929274279595108
Energy: 0.563877531369982
Energy: 0.4897044634441607
Energy: 0.48892059621187245
Energy: 0.5209845053751656
Energy: 0.49701178346425834
Energy: 0.489485125629239
Energy: 0.5228182215084267
Energy: 0.5156960564736075
Energy: 0.5171076043736679
Energy: 0.5166800112213309
Energy: 0.5160226045303818
Energy: 0.5038932432567433
Energy: 0.5046858520889846
Energy: 0.5093854607712871
Energy: 0.5195886525064772
Energy: 0.5062630443047833
Energy: 0.509009268182932
Energy: 0.5189097657875632
Energy: 0.5227000501265149
Energy: 0.5158109685245325
Energy: 0.5043285865300238
Energy: 0.5072301126775597
Energy: 0.515972575029725
Energy: 0.5036030452927212
Energy: 0.602230913359212
Energy: 0.5184447915978786
Energy: 0.4928444647855186
Energy: 0.5213131514337309
Energy: 0.5188533563841623
Energy: 0.5081095999801869
Energy: 0.554458521934157
Energy: 0.4940618272124505
Energy: 0.49259312449889725
Energy: 0.5323239729693798
Energy: 0.5380049622764367
Energy: 0.4925895984065401
Energy: 0.5244976690898211
Energy: 0.5171781742972805
Energy: 0.49112607804464503
Energy: 0.5077397785518237
Energy: 0.5340919149100477
Energy: 0.5052733863162959
Energy: 0.5310318632830477
Energy: 0.4931187800598557
Energy: 0.49035433317702315
Energy: 0.5086861693243984
Energy: 0.4937239010660484
Energy: 0.4920687360769157
Energy: 0.48929437496759637
Energy: 0.5364359706352865
Energy: 0.5164063697952479
Energy: 0.49008233832264436
Energy: 0.536029841384355
Energy: 0.5069902415936727
Energy: 0.7356532387361093
Energy: 0.509875990456775
Energy: 0.515383747351162
Energy: 0.7365552439330182
Energy: 0.511242415065962
Energy: 0.5179858844949986
Energy: 0.5226364381581193
Energy: 0.5177483783721442
Energy: 0.5058517671031887
Energy: 0.5305433502036414
Energy: 0.5284846289782611
Energy: 0.5195282945292976
Energy: 0.5556088987114044
Energy: 0.5179084426624371
Energy: 0.4893324459509113
Energy: 0.4956208721686991
Energy: 0.5169880239633311
Energy: 0.489373749996838

minimum gb energy = 0.48851420206926904 eV
minimum distance =  2.4158710738416 Angstroms
sigma value = 67


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

Energy: 0.7443317921257931
Energy: 0.53191297280638
Energy: 0.5319755564116354
Energy: 0.5327176883083331
Energy: 0.5841095252363571
Energy: 0.5318579647048252
Energy: 0.6296210361384125
Energy: 0.5463997692247511
Energy: 0.5453734094241475
Energy: 0.5483464041241486
Energy: 0.5481634134976594
Energy: 0.5452799250970566
Energy: 0.5865064260563084
Energy: 0.524430505568389
Energy: 0.5497160902181202
Energy: 0.5468835741374173
Energy: 0.5242590878715196
Energy: 0.5498037967122896
Energy: 0.5864543392022369
Energy: 0.5454290430484726
Energy: 0.544157212819429
Energy: 0.5466189712782246
Energy: 0.5458218708885232
Energy: 0.5441687513875394
Energy: 0.5776489266176059
Energy: 0.5484402191838684
Energy: 0.5482052236552765
Energy: 0.5759078367389255
Energy: 0.5481735954590907
Energy: 0.548536675923721
Energy: 0.5787682112567454
Energy: 0.5466549731942965
Energy: 0.5513987715124083
Energy: 0.5771105326369318
Energy: 0.5438328543214669
Energy: 0.5521025092319329
Energy: 0.6292705295046763
Energy: 0.5468630517280277
Energy: 0.5458244874178857
Energy: 0.5239275279342033
Energy: 0.5502034196683373
Energy: 0.5457332881709998

minimum gb energy = 0.5239275279342033 eV
minimum distance =  2.44891856011567 Angstroms
sigma value = 3


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

Energy: 0.8862091765605239
Energy: 0.7048253754912557
Energy: 0.663052309407471
Energy: 0.6726368525164155
Energy: 0.7073422680674547
Energy: 0.6832090103077086
Energy: 0.6636074366945227
Energy: 0.6508856017942133
Energy: 0.6545299510704863
Energy: 0.6457802123007561
Energy: 0.6498555079261784
Energy: 0.6366000654954589
Energy: 0.7250632224248451
Energy: 0.6645910163324705
Energy: 0.6640589196471811
Energy: 0.6542178295086918
Energy: 0.6667074084120549
Energy: 0.7028138721737023
Energy: 0.6942271635818983
Energy: 0.6471549584686088
Energy: 0.6474094668049969
Energy: 0.645219761906141
Energy: 0.6627237305534741
Energy: 0.6471852768509234
Energy: 0.6918793194519146
Energy: 0.6477895330587937
Energy: 0.6460315269802581
Energy: 0.6920178784386912
Energy: 0.6462411561508953
Energy: 0.6518558637364745
Energy: 0.7160248119341001
Energy: 0.685626581527223
Energy: 0.6481937349235458
Energy: 0.6997456015795268
Energy: 0.6498130148509202
Energy: 0.6952034085522695
Energy: 0.685551145279242
Energy: 0.6482562232208473
Energy: 0.6448103409861491
Energy: 0.635749490890351
Energy: 0.6507229892078416
Energy: 0.6496735928699252
Energy: 0.8192100806278279
Energy: 0.705997312474147
Energy: 0.6876907958780293
Energy: 0.6887334026510291
Energy: 0.7244315242635202
Energy: 0.7014891066992576
Energy: 0.6855979710656451
Energy: 0.6815681564300708
Energy: 0.6848151512697209
Energy: 0.6369283949675462
Energy: 0.6793842757334165
Energy: 0.6997050475316252
Energy: 0.7006112354973529
Energy: 0.6743714356699995
Energy: 0.6747816974246146
Energy: 0.7068650731435471
Energy: 0.6593732343163117
Energy: 0.6680856699456904
Energy: 0.7187826651150396
Energy: 0.6774241272877684
Energy: 0.66945730715312
Energy: 0.7148067963238786
Energy: 0.654813499612538
Energy: 0.697204576952934
Energy: 0.7374704782355871
Energy: 0.684444613171938
Energy: 0.6863269599061596
Energy: 0.685073311848583
Energy: 0.6942973425689151
Energy: 0.6927679482839303
Energy: 0.6884648866814302
Energy: 0.7020158276308396
Energy: 0.6930149618282034
Energy: 0.6557513274719332
Energy: 0.6971770826135819
Energy: 0.687676239793895
Energy: 0.7041146426193423
Energy: 0.6867308559682018
Energy: 0.6886175582039865
Energy: 0.6925089206328932
Energy: 0.6852551936151721
Energy: 0.6857399688963638
Energy: 0.7198972845711592
Energy: 0.7162191914841706
Energy: 0.7079690845933615
Energy: 0.6625720863842374
Energy: 0.7173025800380914
Energy: 0.7096205305530283
Energy: 0.7236039486685855
Energy: 0.7021840798201339
Energy: 0.702118756994191
Energy: 0.6985483418563458
Energy: 0.7010944154299933
Energy: 0.7029329951143457
Energy: 0.7949828534957731
Energy: 0.6757565699070675
Energy: 0.6684966268494473
Energy: 0.7171012964989637
Energy: 0.6756564403601043
Energy: 0.6842134040415212
Energy: 0.688339222226999
Energy: 0.6743491716360127
Energy: 0.6850003336991081
Energy: 0.686908079907015
Energy: 0.6533076585415746
Energy: 0.7012984222541282
Energy: 0.7847747071742436
Energy: 0.7121154582478851
Energy: 0.6808299175073482
Energy: 0.6928106226974896
Energy: 0.711514016995232
Energy: 0.6666037462117902
Energy: 0.7491126270619055
Energy: 0.6813045642440274
Energy: 0.6809565617198158
Energy: 0.6596825556296879
Energy: 0.6812131286563784
Energy: 0.6669359732731729
Energy: 0.7025250139605048
Energy: 0.684720093163187
Energy: 0.6835241549486331
Energy: 0.6833770207576382
Energy: 0.6813295912722396
Energy: 0.6832301453075094
Energy: 0.6952125722786577
Energy: 0.6856546212659693
Energy: 0.7078015986396121
Energy: 0.6830865244957275
Energy: 0.6903529128397339
Energy: 0.6926693342512203
Energy: 0.6943204395760535
Energy: 0.6812830253921431
Energy: 0.684820351802248
Energy: 0.694711278252869
Energy: 0.6829968331202635
Energy: 0.6849157182578915
Energy: 0.7083075418839229
Energy: 0.6850231114847124
Energy: 0.6839430001101515
Energy: 0.6958473068372704
Energy: 0.6786299347424215
Energy: 0.7054241973919121
Energy: 0.6851862094293985
Energy: 0.7068582967163318
Energy: 0.7037849707012181
Energy: 0.7175625638639891
Energy: 0.7009131920120033
Energy: 0.7038528006822576
Energy: 0.759441345398822
Energy: 0.6889336896434749
Energy: 0.6520581972593888
Energy: 0.6457415046248315
Energy: 0.7105227445395084
Energy: 0.6401134625076531
Energy: 0.6266173834495263
Energy: 0.6883300056991614
Energy: 0.6412748259623885
Energy: 0.6464732076354122
Energy: 0.6995116791663963
Energy: 0.6555316029852422
Energy: 0.6863985325064568
Energy: 0.7041399381667081
Energy: 0.7045523199740161
Energy: 0.7147862671208809
Energy: 0.7052725200663866
Energy: 0.7109959463217737
Energy: 0.6954399034632053
Energy: 0.664083177851819
Energy: 0.6641389673077767
Energy: 0.6947462569609776
Energy: 0.6661784901834933
Energy: 0.7083717084209308
Energy: 0.6864548808461747
Energy: 0.690055065746539
Energy: 0.6842891138455157
Energy: 0.6876781080402553
Energy: 0.6974329544636949
Energy: 0.6867296818587421
Energy: 0.7218395851991556
Energy: 0.6982062672102588
Energy: 0.6988875065315917
Energy: 0.6906230512433893
Energy: 0.6933698002527651
Energy: 0.693998838641704
Energy: 0.6910429749055851
Energy: 0.68279985794311
Energy: 0.6828078934769468
Energy: 0.6870890847434141
Energy: 0.6820134234664798
Energy: 0.6872975593074561
Energy: 0.7738380579384592
Energy: 0.7044717717387177
Energy: 0.7005715234474084
Energy: 0.6758400395572935
Energy: 0.7150326564397382
Energy: 0.6666578440163412
Energy: 0.7114873323304483
Energy: 0.689024138788703
Energy: 0.689847789742909
Energy: 0.6637589442618108
Energy: 0.6928367475812486
Energy: 0.6923508343655822
Energy: 0.69643211198135
Energy: 0.6652903578560294
Energy: 0.6623095417047151
Energy: 0.6896492229066187
Energy: 0.6648430622087328
Energy: 0.6863121634698148
Energy: 0.7356934737751408
Energy: 0.6744479424196604
Energy: 0.6669369045191473
Energy: 0.7292603694289936
Energy: 0.6593065879186032
Energy: 0.680030725071577
Energy: 0.7304485355081255
Energy: 0.6851333528014808
Energy: 0.6901886588180391
Energy: 0.7107084415350761
Energy: 0.6837193802885387
Energy: 0.6925266771595847
Energy: 0.7811871794982956
Energy: 0.7251390910641023
Energy: 0.7152546811946658
Energy: 0.657593528523297
Energy: 0.6915662943153756
Energy: 0.7157055879396199
Energy: 0.7073323739589312
Energy: 0.6896416510872857
Energy: 0.6940087000582444
Energy: 0.6903607247631108
Energy: 0.6873963905214073
Energy: 0.6940265712661635
Energy: 0.71919052090411
Energy: 0.6976171099025338
Energy: 0.6904641141141962
Energy: 0.6615438431164854
Energy: 0.6875777616952032
Energy: 0.6809521127331324
Energy: 0.7258752860292703
Energy: 0.7022560887537488
Energy: 0.6760214319400822
Energy: 0.6978719887550657
Energy: 0.7078196714890738
Energy: 0.6794630244006272
Energy: 0.7826305221289166
Energy: 0.6690685544731524
Energy: 0.6542996547795467
Energy: 0.7240684957510076
Energy: 0.6815630229932759
Energy: 0.6951843128661035
Energy: 0.7639599004887712
Energy: 0.6755532613067103
Energy: 0.6743494074911217
Energy: 0.7091649353627282
Energy: 0.6676848817478898
Energy: 0.6803166720620749
Energy: 0.6882250723144537
Energy: 0.7006174486212662
Energy: 0.6977039386449195
Energy: 0.6343235107929103
Energy: 0.6970952416757856
Energy: 0.6975887952616914
Energy: 0.8068176923232936
Energy: 0.6553017402864536
Energy: 0.7053733674718811
Energy: 0.68920350352818
Energy: 0.6584039466436825
Energy: 0.7048894307349465
Energy: 0.6923566645396348
Energy: 0.6323296255216303
Energy: 0.6335302661566538
Energy: 0.6405759292083782
Energy: 0.6322089006162561
Energy: 0.6447425214958683
Energy: 0.7523414501665991
Energy: 0.6464529207122816
Energy: 0.688494474391442
Energy: 0.6915711348355267
Energy: 0.6484150478408569
Energy: 0.6525880255853937
Energy: 0.6979984774451612
Energy: 0.6418132221370131
Energy: 0.641722487166281
Energy: 0.647768236637002
Energy: 0.6419990912347697
Energy: 0.6450925597053195
Energy: 0.6947839377449144
Energy: 0.6550679915715574
Energy: 0.6476592717046477
Energy: 0.6478332555677585
Energy: 0.6592449630951884
Energy: 0.646619504650782
Energy: 0.7092540842146408
Energy: 0.6557744343998407
Energy: 0.6560558945738354
Energy: 0.6499801251031126
Energy: 0.6617569749500839
Energy: 0.7020968191946989
Energy: 0.6635926115262631
Energy: 0.6405386053727745
Energy: 0.6395562321898528
Energy: 0.6381291775124657
Energy: 0.6412221275960889
Energy: 0.6414515200137533

minimum gb energy = 0.6266173834495263 eV
minimum distance =  2.38855224177558 Angstroms
sigma value = 81


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

Energy: 0.9802880822972965
Energy: 0.6047452934222612
Energy: 0.6056100038208437
Energy: 0.6033600818318335
Energy: 0.677965259830163
Energy: 0.6046110380998456
Energy: 0.5972158850412524
Energy: 0.6076123089113711
Energy: 0.6054271959281359
Energy: 0.60009113240119
Energy: 0.601375167390457
Energy: 0.6083418143490291
Energy: 0.5984077630669593
Energy: 0.6094649369758066
Energy: 0.6100622456896428
Energy: 0.607747155978228
Energy: 0.6099573614056589
Energy: 0.6089214558608019
Energy: 0.598713489397149
Energy: 0.6112260564068495
Energy: 0.6079497305403821
Energy: 0.5990021887181174
Energy: 0.6015771633342635
Energy: 0.6075371701773525
Energy: 0.5996916661204583
Energy: 0.6074610127215438
Energy: 0.6075530190315285
Energy: 0.6000850151683197
Energy: 0.6102177835328441
Energy: 0.6071446115347208
Energy: 0.6063972313657666
Energy: 0.6081880172783896
Energy: 0.6076548512990453
Energy: 0.6082846936100433
Energy: 0.6102829356167888
Energy: 0.6081287139601188
Energy: 0.5957813376834039
Energy: 0.6039703765687806
Energy: 0.6080571185540689
Energy: 0.6244867536818258
Energy: 0.6026072843521177
Energy: 0.6089178944280893
Energy: 0.7168649726208183
Energy: 0.6435645452061066
Energy: 0.6451875975938365
Energy: 0.6539004899976879
Energy: 0.643683383122159
Energy: 0.6208025972841645
Energy: 0.5968101837516944
Energy: 0.6042044480549876
Energy: 0.6085625955558407
Energy: 0.6271536469017539
Energy: 0.6014038488482183
Energy: 0.6083334928288234
Energy: 0.6228935164016903
Energy: 0.5963604516338857
Energy: 0.5960436263682584
Energy: 0.6322758826309914
Energy: 0.597201882121301
Energy: 0.5953635396722698
Energy: 0.6027659372698173
Energy: 0.5972812104989454
Energy: 0.5957464558241166
Energy: 0.6031647724780765
Energy: 0.6076746828316195
Energy: 0.6055677029960898
Energy: 0.5944444575815482
Energy: 0.6057647335944096
Energy: 0.6066828620889373
Energy: 0.5961737562859742
Energy: 0.6108335615638686
Energy: 0.6072141947292197
Energy: 0.5955099533261258
Energy: 0.606582927246493
Energy: 0.6054748235567669
Energy: 0.6073918719282966
Energy: 0.603202524342945
Energy: 0.6120929772333096
Energy: 0.6001662333548646
Energy: 0.5993018834913147
Energy: 0.605573291468367
Energy: 0.6012213593657832
Energy: 0.5975940994251364
Energy: 0.6070654327871785
Energy: 0.7262420444674549
Energy: 0.664919894654311
Energy: 0.6234100647412972
Energy: 0.6110635185498413
Energy: 0.6521034374079119
Energy: 0.6012864271186704
Energy: 0.6003163694503908
Energy: 0.6019312568924592
Energy: 0.6047045702089904
Energy: 0.6010190963232799
Energy: 0.6018064672781378
Energy: 0.6078062538640793
Energy: 0.6785251018777677
Energy: 0.6114019812021161
Energy: 0.6209848269149442
Energy: 0.6398021474363095
Energy: 0.5984811455080113
Energy: 0.622252563793914
Energy: 0.6004439510261467
Energy: 0.6101277543417095
Energy: 0.6096598837670973
Energy: 0.6027353594732467
Energy: 0.6005810727718807
Energy: 0.6092183131716817
Energy: 0.7009712292743978
Energy: 0.606236904589066
Energy: 0.5951677614683718
Energy: 0.6075079697182361
Energy: 0.6110439747894031
Energy: 0.5957666602074981
Energy: 0.7024144792327077
Energy: 0.6076748417438915
Energy: 0.5953646958794978
Energy: 0.5933178794297191
Energy: 0.6151596110585795
Energy: 0.5950771698715575
Energy: 0.5991630378867503
Energy: 0.6064365185221013
Energy: 0.6087361317706366
Energy: 0.6025679435627617
Energy: 0.6000826127871345
Energy: 0.6054733548394463
Energy: 0.6070944557315074
Energy: 0.608749949295077
Energy: 0.6446477803933011
Energy: 0.6032058551944893
Energy: 0.6086539819408161
Energy: 0.6108199917392347
Energy: 0.5961576432692263
Energy: 0.6060349820282345
Energy: 0.6075382450679124
Energy: 0.5962563878788745
Energy: 0.6021147639776019
Energy: 0.6052643309417549
Energy: 0.6046679374440538
Energy: 0.6015574863121119
Energy: 0.6068011435397913
Energy: 0.6100913384404651
Energy: 0.6017353893214621
Energy: 0.6130667581057523
Energy: 0.6002630187895418
Energy: 0.6089215881985195
Energy: 0.6079113801128482
Energy: 0.6278566521600722
Energy: 0.6053707769602702
Energy: 0.604069288899161
Energy: 0.6777543447734788
Energy: 0.6394030975443669
Energy: 0.638799113909693
Energy: 0.6068001444037736
Energy: 0.6398609381284757
Energy: 0.637513653170961
Energy: 0.6808201746984228
Energy: 0.6069999733062146
Energy: 0.6066888853515657
Energy: 0.6085152007737507
Energy: 0.6109283527594418
Energy: 0.610320350223788
Energy: 0.6005638568391307
Energy: 0.5973533777675689
Energy: 0.608429970577188
Energy: 0.6011280967139369
Energy: 0.606220357015017
Energy: 0.604945139641701
Energy: 0.6029426813992179
Energy: 0.5968735209942158
Energy: 0.5962970798313799
Energy: 0.6072150956304593
Energy: 0.5978318879452483
Energy: 0.630827699872712
Energy: 0.6004709334330935
Energy: 0.6056911575021683
Energy: 0.6077789349588231
Energy: 0.600257646917808
Energy: 0.6007979670373296
Energy: 0.6083889222472688
Energy: 0.5969421947630794
Energy: 0.6409850811108172
Energy: 0.6062332954474464
Energy: 0.6084171240746858
Energy: 0.6519920566525438
Energy: 0.6114170229159661
Energy: 0.6001029307051895
Energy: 0.6001747204704213
Energy: 0.6046089954843982
Energy: 0.6009033309790778
Energy: 0.5986091996752507
Energy: 0.6078686928660942
Energy: 0.6831285461797317
Energy: 0.6096283260598235
Energy: 0.6056010938946542
Energy: 0.6073955014693234
Energy: 0.6067408156162997
Energy: 0.6080778255924375
Energy: 0.6013488202089677
Energy: 0.6050271483008144
Energy: 0.6056200542874032
Energy: 0.6366553571301244
Energy: 0.6118035985842164
Energy: 0.6071043115980977
Energy: 0.6025572482928622
Energy: 0.6106645087254241
Energy: 0.6103133356911564
Energy: 0.6030710477608989
Energy: 0.6085786317468748
Energy: 0.609628812973897
Energy: 0.7161092352249161
Energy: 0.6095409743141057
Energy: 0.608969681422795
Energy: 0.6790674450707939
Energy: 0.6030484943103873
Energy: 0.6382960503848327
Energy: 0.5968324898333117
Energy: 0.6063430806997421
Energy: 0.6048201667812266
Energy: 0.6001581141750199
Energy: 0.6006479421912514
Energy: 0.6084480409189603
Energy: 0.8425143675667176
Energy: 0.5994062692027264
Energy: 0.6046974285296807
Energy: 0.5985480731847175
Energy: 0.617233655800365
Energy: 0.6046161348342697

minimum gb energy = 0.5933178794297191 eV
minimum distance =  2.41739469703878 Angstroms
sigma value = 43


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

Energy: 0.8799131900672987
Energy: 0.6377791351138924
Energy: 0.6267602748957326
Energy: 0.6337908088638867
Energy: 0.6566968046672936
Energy: 0.633766233789839
Energy: 0.6113290942227604
Energy: 0.6320848714212335
Energy: 0.6226616924744933
Energy: 0.6477681175246641
Energy: 0.6193435425031817
Energy: 0.625932563400124
Energy: 0.6232783424666983
Energy: 0.6285105536849659
Energy: 0.6125191490603062
Energy: 0.6232412986363914
Energy: 0.6125108953595548
Energy: 0.6231719098727242
Energy: 0.622506564891336
Energy: 0.6291350137915069
Energy: 0.623509871875133
Energy: 0.6223492485460591
Energy: 0.6125349443361644
Energy: 0.6227597040060335
Energy: 0.6259222263376872
Energy: 0.6288266310649675
Energy: 0.627211203141697
Energy: 0.6242989456416356
Energy: 0.6237815013493719
Energy: 0.6249878897797204
Energy: 0.6244194045580682
Energy: 0.6245264137897695
Energy: 0.6256287533376391
Energy: 0.6235535674091566
Energy: 0.6268847857523235
Energy: 0.6263730652512589
Energy: 0.6256013284362094
Energy: 0.6225847793096121
Energy: 0.6222782631484288
Energy: 0.6244934565705847
Energy: 0.6235349872762395
Energy: 0.6238070579668394
Energy: 0.6936247086845818
Energy: 0.6232393796393241
Energy: 0.623257321746883
Energy: 0.6164367894618821
Energy: 0.6233680633345351
Energy: 0.6932587456302644
Energy: 0.6203658978061564
Energy: 0.6244859024027681
Energy: 0.6238366162069916
Energy: 0.6207631448711269
Energy: 0.6247240903937816
Energy: 0.6233640379772609
Energy: 0.618336554152695
Energy: 0.6236080659330742
Energy: 0.6236936516722245
Energy: 0.6254596174199721
Energy: 0.6233099954215333
Energy: 0.6237984262371373
Energy: 0.618634410688317
Energy: 0.6302688254797327
Energy: 0.6171893768771498
Energy: 0.618306590153108
Energy: 0.6269462650950343
Energy: 0.6214541005567762
Energy: 0.6275618055003915
Energy: 0.6236950570900746
Energy: 0.623649519976746
Energy: 0.6190966022940219
Energy: 0.6574274195973909
Energy: 0.6320828879912729
Energy: 0.7165888724923202
Energy: 0.6233578375500844
Energy: 0.6306725221235822
Energy: 0.6133783628260513
Energy: 0.623395961458046
Energy: 0.630701727639836
Energy: 0.6192379524956966
Energy: 0.6325836319915698
Energy: 0.6348529246328503
Energy: 0.6184023251724262
Energy: 0.625165387293873
Energy: 0.6228915876705691
Energy: 0.6184663751386065
Energy: 0.6171913533332892
Energy: 0.6172873761372263
Energy: 0.6232394594679231
Energy: 0.6105121602539031
Energy: 0.622449299859893
Energy: 0.618007952078792
Energy: 0.6325187262645837
Energy: 0.6272096213999256
Energy: 0.6177205329708211
Energy: 0.634761950143849
Energy: 0.6223882805619441
Energy: 0.618865740346981
Energy: 0.6182444562587305
Energy: 0.630606181085044
Energy: 0.6189158296992872
Energy: 0.6213280667424709
Energy: 0.6188262671669532
Energy: 0.6183967338979809
Energy: 0.6235109657110346
Energy: 0.6176816249238288
Energy: 0.6361936807717296
Energy: 0.6443876738588035
Energy: 0.6182280701850013
Energy: 0.6189684510354361
Energy: 0.6181646444336879
Energy: 0.6180757566255184
Energy: 0.624753336906166
Energy: 0.6192443605791865
Energy: 0.623567250617435
Energy: 0.6934857896559316
Energy: 0.6181056876582568
Energy: 0.6185838059945854
Energy: 0.6240813005171749
Energy: 0.6358514868403055
Energy: 0.6320737982105005
Energy: 0.6177417709340318
Energy: 0.6245425136089521
Energy: 0.6193948572970135
Energy: 0.6352705149605531
Energy: 0.624981644923849
Energy: 0.6183192790384197
Energy: 0.6973093494429408
Energy: 0.6662940784356294
Energy: 0.6618354002098565
Energy: 0.6345610465799341
Energy: 0.6123435408316823
Energy: 0.6620216315165137
Energy: 0.6325627019431006
Energy: 0.6245815234398754
Energy: 0.6246061289321571
Energy: 0.6273623326589874
Energy: 0.6397030204345253
Energy: 0.6430251767893347
Energy: 0.6736795300046658
Energy: 0.6545101809901369
Energy: 0.6179565111584108
Energy: 0.6198212887741934
Energy: 0.7080379807720808
Energy: 0.6186658805196096
Energy: 0.6373396356839865
Energy: 0.6175886088244262
Energy: 0.6179894894946684
Energy: 0.6308653746872107
Energy: 0.617662909125504
Energy: 0.6233475111799279
Energy: 0.6605169962068398
Energy: 0.6240257747776962
Energy: 0.623097771140736
Energy: 0.6185044731244791
Energy: 0.6192351378990314
Energy: 0.6180592196262078
Energy: 0.6598354075908509
Energy: 0.6248494463659988
Energy: 0.6228926748693786
Energy: 0.6332623804074402
Energy: 0.6272487569078256
Energy: 0.6224359966017254
Energy: 0.6503250891826228
Energy: 0.6313776536485538
Energy: 0.6328176392408669
Energy: 0.6235228425911684
Energy: 0.6238893106330832
Energy: 0.6235708644799125
Energy: 0.6267587706945145
Energy: 0.6229193765046158
Energy: 0.6225674158288504
Energy: 0.6268060350346318
Energy: 0.615659826016895
Energy: 0.6687173411303691
Energy: 0.621784477787133
Energy: 0.6242537247618282
Energy: 0.6342140852766669
Energy: 0.6480010092072398
Energy: 0.6188786158387118
Energy: 0.625285425473146
Energy: 0.8234640372622404
Energy: 0.6459830636569617
Energy: 0.6136616819292144
Energy: 0.6319990445062957
Energy: 0.6169345195179541
Energy: 0.6136675045498119

minimum gb energy = 0.6105121602539031 eV
minimum distance =  2.38183913359149 Angstroms
sigma value = 57


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

Energy: 0.7609156068830591
Energy: 0.6335241819910769
Energy: 0.6333654052113682
Energy: 0.5871943153674994
Energy: 0.7275683986911728
Energy: 0.6332524701772639
Energy: 0.588038219529942
Energy: 0.6116179742393791
Energy: 0.614286708786105
Energy: 0.6321841651782297
Energy: 0.6285301398824683
Energy: 0.6173659406652158
Energy: 0.6215141844414314
Energy: 0.5937993892427611
Energy: 0.5936689455490562
Energy: 0.62608349447372
Energy: 0.59432484944605
Energy: 0.5940692586292654
Energy: 0.6220854139093019
Energy: 0.5933279473390868
Energy: 0.5939691793909246
Energy: 0.620697278674711
Energy: 0.593677292049185
Energy: 0.6132121925513113
Energy: 0.6228614608774287
Energy: 0.6112134539994977
Energy: 0.6091688735184809
Energy: 0.6112300486151441
Energy: 0.611157828370605
Energy: 0.6120119307504956
Energy: 0.5845143788003536
Energy: 0.6128768839086415
Energy: 0.6113245400361882
Energy: 0.6128233183523849
Energy: 0.6103444869540733
Energy: 0.6109113039936863
Energy: 0.633073356521315
Energy: 0.6135982541399685
Energy: 0.612009452614626
Energy: 0.6172629798957299
Energy: 0.6214561789899838
Energy: 0.6098677120526718
Energy: 0.6215831106274791
Energy: 0.6151285421440533
Energy: 0.6163079652138284
Energy: 0.6083425236014506
Energy: 0.6149645288816377
Energy: 0.615618250201148
Energy: 0.6295095712169674
Energy: 0.6133290157771629
Energy: 0.6176727314703176
Energy: 0.6172256494587844
Energy: 0.6137814061294878
Energy: 0.6134695239123084
Energy: 0.6258374869676907
Energy: 0.6103164639128433
Energy: 0.612093107474675
Energy: 0.6325103052689713
Energy: 0.6067661956425175
Energy: 0.6149082123372347
Energy: 0.6605843916753652
Energy: 0.6076263035780656
Energy: 0.6231234945239401
Energy: 0.6272308798338383
Energy: 0.6160324061007997
Energy: 0.612117813969114
Energy: 0.5831399333313919
Energy: 0.6145640559320134
Energy: 0.6127897306604353
Energy: 0.5850998430058034
Energy: 0.6188876475818103
Energy: 0.5943935155858618
Energy: 0.5846267399718811
Energy: 0.620364764116851
Energy: 0.6438268944818405
Energy: 0.5937162719428625
Energy: 0.6205104516025531
Energy: 0.5988661610964442
Energy: 0.6195479696668779
Energy: 0.6143154138671233
Energy: 0.6140961930234302
Energy: 0.6272227581446298
Energy: 0.6172418439820403
Energy: 0.6144886382281791
Energy: 0.6195632688135551
Energy: 0.5851823656950084
Energy: 0.5883613840440586
Energy: 0.6195034585848223
Energy: 0.5850306677784605
Energy: 0.5864247342633951
Energy: 0.6242503430243493
Energy: 0.6075315095447364
Energy: 0.6067454965785685
Energy: 0.6210914362244399
Energy: 0.6132872371234815
Energy: 0.6091228161384139
Energy: 0.6235536160756592
Energy: 0.6105471416771862
Energy: 0.610839434772251
Energy: 0.6117683115424832
Energy: 0.6104436059664847
Energy: 0.6090205042705374
Energy: 0.6228904069233563
Energy: 0.6160539809576141
Energy: 0.6097776979330013
Energy: 0.6113022451758451
Energy: 0.6106151395372815
Energy: 0.6079101133468066
Energy: 0.6333973565887567
Energy: 0.6207327037157775
Energy: 0.616221796793485
Energy: 0.6124783397079115
Energy: 0.6208847282334097
Energy: 0.6134983966639156
Energy: 0.6334005440902768
Energy: 0.6200645983127522
Energy: 0.6158522343276033
Energy: 0.6126863978773415
Energy: 0.6217904120852855
Energy: 0.6145163598016165
Energy: 0.6270074425893452
Energy: 0.6168388768228796
Energy: 0.6146856106789258
Energy: 0.6270724966262109
Energy: 0.6126214293294271
Energy: 0.6119610049605982
Energy: 0.6801141128555007
Energy: 0.6126729466299335
Energy: 0.6151058472238744
Energy: 0.6486893911113476
Energy: 0.6107798369700562
Energy: 0.6135290042361927
Energy: 0.6193611580231373
Energy: 0.6168732257620628
Energy: 0.6156578494917954
Energy: 0.6270739549114047
Energy: 0.6305954523548003
Energy: 0.6137667033010982
Energy: 0.583171322578812
Energy: 0.6205440007873357
Energy: 0.643766969858655
Energy: 0.5937280746448049
Energy: 0.6176264646668764
Energy: 0.5961416611959603

minimum gb energy = 0.5831399333313919 eV
minimum distance =  2.42083729666472 Angstroms
sigma value = 17


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

Energy: 0.9273096453999388
Energy: 0.6754469638154269
Energy: 0.725391706595043
Energy: 0.5802286157107868
Energy: 0.6314021949609213
Energy: 0.5845935451728346
Energy: 0.581859818211657
Energy: 0.6447344586883217
Energy: 0.6143313299742197
Energy: 0.6542170001598386
Energy: 0.6551722674934791
Energy: 0.6083786058918694
Energy: 0.6289867573710852
Energy: 0.5892758149632994
Energy: 0.5899770620978491
Energy: 0.63870281235888
Energy: 0.5892396390658031
Energy: 0.5827444955950872
Energy: 0.643547378743403
Energy: 0.5858939416333783
Energy: 0.5827998802191698
Energy: 0.6440068475090882
Energy: 0.5799964426131107
Energy: 0.609072614738149
Energy: 0.5745997869075279
Energy: 0.5785356273915117
Energy: 0.576764191852553
Energy: 0.5748676454636766
Energy: 0.5779751837260411
Energy: 0.5767358972693788
Energy: 0.5905894022030266
Energy: 0.5767383879132063
Energy: 0.5764666459542303
Energy: 0.5832136028477922
Energy: 0.5676853144804422
Energy: 0.5571546554899812
Energy: 0.5660238537609041
Energy: 0.5663977753396114
Energy: 0.5656239908921001
Energy: 0.5761458311018766
Energy: 0.5697997074260157
Energy: 0.5651650064557767
Energy: 0.5808881963303787
Energy: 0.5593189144816684
Energy: 0.5592212432259731
Energy: 0.5583504971562496
Energy: 0.5611355257462771
Energy: 0.5972709501129005
Energy: 0.5686553284483652
Energy: 0.5594377517763891
Energy: 0.5590553930737348
Energy: 0.5697963604895946
Energy: 0.5584898345777571
Energy: 0.565314742755533
Energy: 0.5671733007979219
Energy: 0.5762727991586377
Energy: 0.5765704024737353
Energy: 0.5665225698179832
Energy: 0.5767014478397702
Energy: 0.577883810488668
Energy: 0.5794662472501821
Energy: 0.5762919951768675
Energy: 0.5767916987806563
Energy: 0.5778698996210263
Energy: 0.6127217055315419
Energy: 0.5767970153467754
Energy: 0.5719689566763099
Energy: 0.6416489657005348
Energy: 0.6409982273855548
Energy: 0.5625614663547464
Energy: 0.6413485144779341
Energy: 0.6089665262831242
Energy: 0.6417086832385063
Energy: 0.6378272381514749
Energy: 0.6423676319231612
Energy: 0.5762150305906194
Energy: 0.6371715719274951
Energy: 0.6434454818613965
Energy: 0.5709033701861995
Energy: 0.6455401499044492
Energy: 0.6081056134426789
Energy: 0.5678451318570928
Energy: 0.6554420793334366
Energy: 0.6070845755379708
Energy: 0.6310676797761205
Energy: 0.640708422693593
Energy: 0.6091247529386865
Energy: 0.6327406177861703
Energy: 0.6357299899093766
Energy: 0.6093736667504647
Energy: 0.5914535272136219
Energy: 0.6561211399485853
Energy: 0.6095909794160791
Energy: 0.6559522319886415
Energy: 0.6521053238918431
Energy: 0.6448232538562062
Energy: 0.6326888887997323
Energy: 0.6325171181684984
Energy: 0.6766297468145751
Energy: 0.5804588663615352
Energy: 0.6331729795058503
Energy: 0.5892364175739303

minimum gb energy = 0.5571546554899812 eV
minimum distance =  2.42344875206851 Angstroms
sigma value = 17


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

Energy: 0.9816022396145282
Energy: 0.6815586372441022
Energy: 0.5985212790241791
Energy: 0.59753759254813
Energy: 0.9012129455444244
Energy: 0.5995283997473115
Energy: 0.5785149497350992
Energy: 0.5590167899176319
Energy: 0.5549003081507543
Energy: 0.6184364179764392
Energy: 0.5664263765840686
Energy: 0.5930582980579402
Energy: 0.7336476323974785
Energy: 0.5301180907191101
Energy: 0.5757258540251212
Energy: 0.6401598747134137
Energy: 0.5466210575720113
Energy: 0.5787065089586907
Energy: 0.5656066744339125
Energy: 0.5774586922231196
Energy: 0.5777701340438339
Energy: 0.5739901626027466
Energy: 0.5374157508551057
Energy: 0.5771621516917664
Energy: 0.5595294255070645
Energy: 0.5578500138608282
Energy: 0.555607949187374
Energy: 0.5601628795975568
Energy: 0.5563849903404825
Energy: 0.5501274568402025
Energy: 0.574569109896393
Energy: 0.55702794581679
Energy: 0.5298928054589439
Energy: 0.5290700630376508
Energy: 0.5513798334597301
Energy: 0.5289389937244925
Energy: 0.5157026792350298
Energy: 0.5507280714720695
Energy: 0.5506520087876717
Energy: 0.5213919822962132
Energy: 0.5544539181398586
Energy: 0.5218556359103632
Energy: 0.5170992497869501
Energy: 0.5119732798864471
Energy: 0.522006062765461
Energy: 0.5219293350072904
Energy: 0.5120307824325692
Energy: 0.5214584051248737
Energy: 0.5160556167100371
Energy: 0.5239483779472446
Energy: 0.5232546612394179
Energy: 0.5169201260453593
Energy: 0.518965410714652
Energy: 0.5163698121740377
Energy: 0.5156766204647972
Energy: 0.5107573174942257
Energy: 0.5112850204216643
Energy: 0.5154856414634422
Energy: 0.5126473797108433
Energy: 0.5115323077131616
Energy: 0.5162933955678413
Energy: 0.5114272153226032
Energy: 0.5113879299403277
Energy: 0.511485180315199
Energy: 0.5152961679829171
Energy: 0.510842535548739
Energy: 0.5647129274788901
Energy: 0.5163706926691881
Energy: 0.516221842569751
Energy: 0.525013075788914
Energy: 0.5189759092192451
Energy: 0.5242042505470691
Energy: 0.5264924639812423
Energy: 0.5511962970152915
Energy: 0.5220296076021125
Energy: 0.5248719285978256
Energy: 0.5225732989913916
Energy: 0.5223674481035844
Energy: 0.5542030399453958
Energy: 0.5299649456425559
Energy: 0.5219025386751848
Energy: 0.5552637548754921
Energy: 0.5207462105311265
Energy: 0.5506084016814506
Energy: 0.5518127794617051
Energy: 0.5219747789050533
Energy: 0.5243733413435168
Energy: 0.5518442911465827
Energy: 0.522942315132553
Energy: 0.5557605855349526
Energy: 0.6237840952253951
Energy: 0.5529095158381266
Energy: 0.5589115565713638
Energy: 0.5608092656184098
Energy: 0.5598148481285834
Energy: 0.558885664867582
Energy: 0.516123313628963
Energy: 0.6356210817357316
Energy: 0.6220702168115735
Energy: 0.5186809152022875
Energy: 0.6391564186167453
Energy: 0.5569608639098677
Energy: 0.5169874520424115
Energy: 0.6335141590650363
Energy: 0.6197673950402818
Energy: 0.5562994542533084
Energy: 0.6394669650334165
Energy: 0.5572317930315563
Energy: 0.5554628182163004
Energy: 0.6189783718424474
Energy: 0.5945705303309852
Energy: 0.575460874747666
Energy: 0.5645314160600041
Energy: 0.556919546297457
Energy: 0.7410272663088205
Energy: 0.5569571237145615
Energy: 0.5575035989526499
Energy: 0.6350888620326791
Energy: 0.5508936852770853
Energy: 0.6162898488795011
Energy: 0.685055715786003
Energy: 0.6167764415251517
Energy: 0.6340273261832604
Energy: 0.6352037500352056
Energy: 0.6221155500440007
Energy: 0.6174234251548721
Energy: 0.5230587740821007
Energy: 0.6220964659119104
Energy: 0.6595420265881692
Energy: 0.5770965353870356
Energy: 0.6211225565801786
Energy: 0.5783699862258571
Energy: 0.5253909578615116
Energy: 0.6371916400594815
Energy: 0.6445297269979475
Energy: 0.5268971016184277
Energy: 0.6371587498003145
Energy: 0.6511558276948611
Energy: 0.7354920155933832
Energy: 0.5658477570681008
Energy: 0.6057190047957683
Energy: 0.6362233518374968
Energy: 0.525020003002869
Energy: 0.6170766900057649
Energy: 0.6338238109489196
Energy: 0.5245017323975377
Energy: 0.5762887296089197
Energy: 0.6355444324762003
Energy: 0.5286838951866951
Energy: 0.576722420629799
Energy: 0.5600106859043796
Energy: 0.5645007824096712
Energy: 0.5597611064904626
Energy: 0.5610660780298227
Energy: 0.5613495280700698
Energy: 0.561140958300349
Energy: 0.5794733860333566
Energy: 0.5962821440792981
Energy: 0.5747909894945568
Energy: 0.5237945064411381
Energy: 0.5534278493223096
Energy: 0.5227258823966974
Energy: 0.5125703323641516
Energy: 0.5554624413199623
Energy: 0.5518311428838221
Energy: 0.5128523295792645
Energy: 0.5522403484611955
Energy: 0.5509708496788965
Energy: 0.5168842756275622
Energy: 0.519974688092967
Energy: 0.519591783728192
Energy: 0.5239341220045693
Energy: 0.5530386210790047
Energy: 0.5194767142338399
Energy: 0.5239204516045998
Energy: 0.511125165489115
Energy: 0.521669502266613
Energy: 0.5160845131111109
Energy: 0.5112240977555985
Energy: 0.5215315065109866
Energy: 0.519570654327821
Energy: 0.5117162659161273
Energy: 0.5107180112740833
Energy: 0.5206003144677166
Energy: 0.5111932421619534
Energy: 0.510027773476252
Energy: 0.5273665092218275
Energy: 0.5111444071213498
Energy: 0.5113249233189378
Energy: 0.5170058723045204
Energy: 0.5110753274996781
Energy: 0.5112743945336844
Energy: 0.5682075834158548
Energy: 0.5199958350317629
Energy: 0.5159041883442533
Energy: 0.5676611023076489
Energy: 0.5167264522242965
Energy: 0.5153651319849577
Energy: 0.5516252946446369
Energy: 0.5209949426644884
Energy: 0.5236577194515326
Energy: 0.5201599222793948
Energy: 0.5217443494857102
Energy: 0.5207515072457528
Energy: 0.557994278923668
Energy: 0.5250818048341251
Energy: 0.5194979882494808
Energy: 0.5588950793955665
Energy: 0.5243443547215135
Energy: 0.5204409348003852
Energy: 0.5560423419953783
Energy: 0.5220056574296308
Energy: 0.5590160324813462
Energy: 0.5567010776249756
Energy: 0.520981080743214
Energy: 0.5583648451328875
Energy: 0.6934723424302269
Energy: 0.5559869634825819
Energy: 0.5555882565579775
Energy: 0.5542050236473204
Energy: 0.5693734216934329
Energy: 0.5557754991198839
Energy: 0.5204481652961055
Energy: 0.6384156973209537
Energy: 0.5618790023257871
Energy: 0.5531105027244778
Energy: 0.6353851094202284
Energy: 0.5576685226408419
Energy: 0.6155260178709869
Energy: 0.6229821420052774
Energy: 0.5628584327429794
Energy: 0.5732902588221168
Energy: 0.6457233461214911
Energy: 0.5607382554345182
Energy: 0.5517088120166929
Energy: 0.6102681596382897
Energy: 0.6161069128777622
Energy: 0.5506754154150099
Energy: 0.6370163251606255
Energy: 0.6010086260408136
Energy: 0.7001442794962037
Energy: 0.5610363035575018
Energy: 0.6119151215783869
Energy: 0.6404923775776613
Energy: 0.5607015797557073
Energy: 0.619081076249538
Energy: 0.7340215908106935
Energy: 0.5950746413424167
Energy: 0.5971951097907872
Energy: 0.6373440729446913
Energy: 0.5550911144155943
Energy: 0.6169503111375428
Energy: 0.5259863065842508
Energy: 0.6592354227709352
Energy: 0.6340545908489795
Energy: 0.5260528330755642
Energy: 0.6372846825311448
Energy: 0.6555243536842629

minimum gb energy = 0.510027773476252 eV
minimum distance =  2.35525350356448 Angstroms
sigma value = 57


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

Energy: 0.8807881991334183
Energy: 0.6270975277420647
Energy: 0.564146407176069
Energy: 0.49836412044135325
Energy: 0.8213461658876124
Energy: 0.5657144433327266
Energy: 0.5750311777485453
Energy: 0.5325734123287671
Energy: 0.5222965703020925
Energy: 0.6017362406784271
Energy: 0.5378018813050814
Energy: 0.5666894080257883
Energy: 0.7000263634037449
Energy: 0.5048538173938456
Energy: 0.5079038002126524
Energy: 0.5980752813846038
Energy: 0.5081988899095031
Energy: 0.5435937698140343
Energy: 0.6080449453009095
Energy: 0.5043625536269248
Energy: 0.5535879173984111
Energy: 0.5401561589710165
Energy: 0.5006454629294158
Energy: 0.5639249365551036
Energy: 0.5340114772590431
Energy: 0.5236455003667878
Energy: 0.5204223837277656
Energy: 0.5341897261606685
Energy: 0.5566578084401871
Energy: 0.5203164553599489
Energy: 0.5056301433841253
Energy: 0.5279448912401725
Energy: 0.5055357655559015
Energy: 0.4839235540298847
Energy: 0.5503871673742837
Energy: 0.5051726315567832
Energy: 0.4958703681579827
Energy: 0.543305736484927
Energy: 0.547788304981508
Energy: 0.4965030734179772
Energy: 0.5435244723133894
Energy: 0.49421831909444053
Energy: 0.4997980586378993
Energy: 0.48119442999248874
Energy: 0.48181715471986136
Energy: 0.5268932431477112
Energy: 0.4812390326123392
Energy: 0.4937601380511429
Energy: 0.4970457120067034
Energy: 0.4990999823174184
Energy: 0.49577014181332707
Energy: 0.4983582088072691
Energy: 0.4999565770764651
Energy: 0.49571430810190353
Energy: 0.5080540807780293
Energy: 0.5040175228832784
Energy: 0.47650857142913583
Energy: 0.5082465417762978
Energy: 0.5059651744256713
Energy: 0.4763854720205372
Energy: 0.4811247141358584
Energy: 0.47754765468495514
Energy: 0.47742708035422793
Energy: 0.4719138763386878
Energy: 0.4869788086306931
Energy: 0.4758188465605633
Energy: 0.4848813352791695
Energy: 0.48203119349896806
Energy: 0.4865038871347906
Energy: 0.47291686913649705
Energy: 0.4824635960924979
Energy: 0.47007911476303127
Energy: 0.47664592637236564
Energy: 0.49538934457332484
Energy: 0.4924469619244559
Energy: 0.48132955335403343
Energy: 0.4755652832709069
Energy: 0.49111593858131947
Energy: 0.4765511891075084
Energy: 0.4920471584254584
Energy: 0.4781997294801978
Energy: 0.47768879912569306
Energy: 0.4862910806855672
Energy: 0.48614511391897686
Energy: 0.4763699161654542
Energy: 0.4752959727894031
Energy: 0.47546544134514923
Energy: 0.47601554241008176
Energy: 0.4773581587230532
Energy: 0.475909656891309
Energy: 0.505352230816196
Energy: 0.5064705000066062
Energy: 0.4757533918340743
Energy: 0.47647996178563945
Energy: 0.5033877802751969
Energy: 0.47601950541106236
Energy: 0.4780336334711795
Energy: 0.5029741427201113
Energy: 0.49563922947701233
Energy: 0.47660164871680516
Energy: 0.5033933213619505
Energy: 0.49413527698427134
Energy: 0.4788119641326218
Energy: 0.4945005838051634
Energy: 0.4926419274708227
Energy: 0.5051652314435318
Energy: 0.49978223980554515
Energy: 0.4938178675250785
Energy: 0.5386306873632597
Energy: 0.5054727167558412
Energy: 0.526464857691959
Energy: 0.5397007989507404
Energy: 0.5006469419358189
Energy: 0.5492853220452214
Energy: 0.602589012807055
Energy: 0.49171137865973263
Energy: 0.49518823818393104
Energy: 0.537469948066196
Energy: 0.4957168803212085
Energy: 0.5263674607602518
Energy: 0.6614512235364467
Energy: 0.5387097443020367
Energy: 0.5413210078636956
Energy: 0.5566317458255926
Energy: 0.5471930932383614
Energy: 0.5409321359785993
Energy: 0.4761705656701401
Energy: 0.6046175466371173
Energy: 0.5371981534879092
Energy: 0.49682301725573974
Energy: 0.6010346748398184
Energy: 0.5332173639578885
Energy: 0.49959653988572883
Energy: 0.5887300672998703
Energy: 0.5900197565873571
Energy: 0.4994628268201313
Energy: 0.6002690896237548
Energy: 0.5754705833410657
Energy: 0.6594173871610761
Energy: 0.53871638399772
Energy: 0.5226509344347594
Energy: 0.5420099606159009
Energy: 0.5374465833371667
Energy: 0.5589747575111541
Energy: 0.7045889249446349
Energy: 0.5216314091370147
Energy: 0.5316589260913902
Energy: 0.6000550978821927
Energy: 0.5196183712595873
Energy: 0.5817662040149003
Energy: 0.6953780047790504
Energy: 0.5828857884900268
Energy: 0.5738299475103142
Energy: 0.5988204108273798
Energy: 0.6001153967763259
Energy: 0.5773785840044372
Energy: 0.4805127455337836
Energy: 0.5959361011815794
Energy: 0.5789242507899588
Energy: 0.4976565288207167
Energy: 0.6005921275282073
Energy: 0.5590299624670638

minimum gb energy = 0.47007911476303127 eV
minimum distance =  2.39090359355748 Angstroms
sigma value = 43


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

Energy: 0.8177363738903499
Energy: 0.515595718511519
Energy: 0.4972575899928524
Energy: 0.4518122522846418
Energy: 0.5321139686602595
Energy: 0.46404004813909633
Energy: 0.583087326712491
Energy: 0.44271654491275714
Energy: 0.4405007251669227
Energy: 0.5169105721872687
Energy: 0.46658120068132375
Energy: 0.43558689407825724
Energy: 0.602763249862723
Energy: 0.4282025378356231
Energy: 0.4200481628661281
Energy: 0.478092510931682
Energy: 0.4277753875853495
Energy: 0.4335332599450768
Energy: 0.5319394239054521
Energy: 0.42408102266192316
Energy: 0.4474163221878754
Energy: 0.46815756824392685
Energy: 0.4371342664883966
Energy: 0.4847901381813043
Energy: 0.4798555896167943
Energy: 0.43639316636555364
Energy: 0.4388759570815402
Energy: 0.471297314941722
Energy: 0.45951478279423635
Energy: 0.43128245109552804
Energy: 0.4303731289536319
Energy: 0.44105442134510087
Energy: 0.4252062833557615
Energy: 0.4157073217112318
Energy: 0.4805157453500385
Energy: 0.40974476084328376
Energy: 0.5602264231993165
Energy: 0.45588487936271577
Energy: 0.48049955090599117
Energy: 0.4509012319462356
Energy: 0.48399181706289673
Energy: 0.4121351592706354
Energy: 0.5511212209954431
Energy: 0.398402206196534
Energy: 0.40525939087032037
Energy: 0.41420175104852847
Energy: 0.3991422992328866
Energy: 0.40522400935860364
Energy: 0.44515698219216354
Energy: 0.42252020069269053
Energy: 0.4307731335466321
Energy: 0.4455975484669132
Energy: 0.40637666146312784
Energy: 0.4435089360176649
Energy: 0.4435426214846276
Energy: 0.41699903051639936
Energy: 0.3963850548066402
Energy: 0.4435620048512442
Energy: 0.41311435180543543
Energy: 0.3968877758732615
Energy: 0.39799266439143355
Energy: 0.4220115535340639
Energy: 0.39752578321975296
Energy: 0.4059136156190544
Energy: 0.4208722193346577
Energy: 0.39267800780776313
Energy: 0.4473423017664756
Energy: 0.4201509900617418
Energy: 0.42045323136811186
Energy: 0.41097095116532545
Energy: 0.4201597356663713
Energy: 0.40304629689529287
Energy: 0.44720842467863003
Energy: 0.40527854218301923
Energy: 0.40831912141735993
Energy: 0.4087910172757653
Energy: 0.40562821285192385
Energy: 0.4098660586255662
Energy: 0.4065105067786916
Energy: 0.4147364134567713
Energy: 0.41083191229163896
Energy: 0.4076387237089099
Energy: 0.40059963888059685
Energy: 0.4065355655437811
Energy: 0.40651309369251604
Energy: 0.39531473716753385
Energy: 0.39884085507873823
Energy: 0.406602311563857
Energy: 0.4045230203749531
Energy: 0.39876909872880306
Energy: 0.40233419049584135
Energy: 0.4007523673110327
Energy: 0.4043512103863452
Energy: 0.40291026895604826
Energy: 0.40039750801291163
Energy: 0.4045729383547216
Energy: 0.40926634683835356
Energy: 0.4006655864985386
Energy: 0.40138450005057735
Energy: 0.401403178871031
Energy: 0.4007203980062654
Energy: 0.40439677206670477
Energy: 0.4007153382756885
Energy: 0.4029146328724594
Energy: 0.4039779780997735
Energy: 0.41014419633825133
Energy: 0.4028492778584309
Energy: 0.4043945274345029
Energy: 0.40053605455541935
Energy: 0.40980064250810155
Energy: 0.4041543070157136
Energy: 0.40184022393217184
Energy: 0.4422064974982311
Energy: 0.4001591117327431
Energy: 0.4000410731361689
Energy: 0.4050750017222368
Energy: 0.4051356756751663
Energy: 0.4111738128276868
Energy: 0.405374412922521
Energy: 0.40721852840827394
Energy: 0.4231668189199418
Energy: 0.4068689362307119
Energy: 0.4090404187219786
Energy: 0.40424852404300093
Energy: 0.40662118656380325
Energy: 0.40912276263997477
Energy: 0.401223370261627
Energy: 0.40721137357154585
Energy: 0.3885281476644097
Energy: 0.39144017592616015
Energy: 0.40706027181282917
Energy: 0.38905162138774657
Energy: 0.4204763405468453
Energy: 0.38890547240132517
Energy: 0.39326241956727265
Energy: 0.42053815219975627
Energy: 0.3986628528198088
Energy: 0.3936712205621017
Energy: 0.4204007355354865
Energy: 0.3884375545302067
Energy: 0.42455713704358267
Energy: 0.4216437098249499
Energy: 0.4018107366838025
Energy: 0.4205780023239792
Energy: 0.5390664569245444
Energy: 0.40029305341557975
Energy: 0.397796714404815
Energy: 0.3974650274463964
Energy: 0.393551428744263
Energy: 0.3974416067499467
Energy: 0.5409049155864775
Energy: 0.4431467671609155
Energy: 0.4437742868966021
Energy: 0.40996809758156066
Energy: 0.44330755322427773
Energy: 0.39714475420019424
Energy: 0.3997998138509418
Energy: 0.444675932489719
Energy: 0.4153390697606055
Energy: 0.4099003789322183
Energy: 0.4438484151740531
Energy: 0.4006432503838115
Energy: 0.4418276028595588
Energy: 0.4179108727601921
Energy: 0.4138570153675837
Energy: 0.4576293554628822
Energy: 0.4355786398227135
Energy: 0.4130565537931997
Energy: 0.4811880951092957
Energy: 0.43180048668439563
Energy: 0.466150333822484
Energy: 0.4821611302623391
Energy: 0.4014075891930391
Energy: 0.48073202355083205
Energy: 0.5702492052739181
Energy: 0.4068044412827302
Energy: 0.41759901313793346
Energy: 0.4410696652317841
Energy: 0.4068761355915101
Energy: 0.41751363369138417
Energy: 0.5743488674090924
Energy: 0.43739962032430074
Energy: 0.46551317132441794
Energy: 0.4720094086641153
Energy: 0.46664548637387243
Energy: 0.42753996140164247
Energy: 0.4424681756561078
Energy: 0.48532088527349715
Energy: 0.44286100224611424
Energy: 0.4254231151498292
Energy: 0.5106614465305601
Energy: 0.4190159511276068
Energy: 0.4936393976574497
Energy: 0.4769470832512993
Energy: 0.4723459941701169
Energy: 0.4814800576254921
Energy: 0.4770302613312187
Energy: 0.4703735490764734
Energy: 0.571992445428019
Energy: 0.459347933643745
Energy: 0.461807698585959
Energy: 0.470435685412095
Energy: 0.44913996648305016
Energy: 0.5152825076682687
Energy: 0.6047120688605344
Energy: 0.44292353746147634
Energy: 0.47137630206181824
Energy: 0.5021096270509977
Energy: 0.44755119891744777
Energy: 0.4710719332642367
Energy: 0.5660008308833258
Energy: 0.4812219781432967
Energy: 0.4695357704431263
Energy: 0.5176226604497162
Energy: 0.5053092971828363
Energy: 0.4817883929439223

minimum gb energy = 0.3884375545302067 eV
minimum distance =  2.41504612017508 Angstroms
sigma value = 81


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

Energy: 0.02833373178894466
Energy: 0.05752424528128167
Energy: 0.028624507945854173
Energy: 0.03042282035808292
Energy: 0.08613517641947564
Energy: 0.02899769265744105
Energy: 0.05784531144470985
Energy: 0.029018450205859005
Energy: 0.029116399405455354
Energy: 0.05800817437322452
Energy: 0.03064695432965243
Energy: 0.029292513872681974
Energy: 0.05691984767010835
Energy: 0.02887911327573866
Energy: 0.028776640751362798
Energy: 0.05690903270054629
Energy: 0.02865025790635028
Energy: 0.05723689390757699
Energy: 0.031568412001700456
Energy: 0.028984972525567303
Energy: 0.029002060148164432
Energy: 0.03077207838205533
Energy: 0.028781489637612383
Energy: 0.05761180845140377
Energy: 0.05710598809703957
Energy: 0.0567983347186366
Energy: 0.056911407789456823
Energy: 0.05776425967262174
Energy: 0.056993805637835765
Energy: 0.058219489635020084
Energy: 0.029132465682904334
Energy: 0.029015569599498008
Energy: 0.028976351767008836
Energy: 0.030606740440465664
Energy: 0.02932356692804879
Energy: 0.029117034700470616
Energy: 0.05732737601648891
Energy: 0.029340615537289078
Energy: 0.02913322629358115
Energy: 0.05687383093264822
Energy: 0.02890306717580859
Energy: 0.029140701827664338
Energy: 0.05704777205110864
Energy: 0.028746851655920985
Energy: 0.029266223521930302
Energy: 0.05693491121971264
Energy: 0.02867211654593005
Energy: 0.05871443207709451
Energy: 0.029983986835062426
Energy: 0.02890290415664011
Energy: 0.05914107927896901
Energy: 0.031535558323392
Energy: 0.029104804428284035
Energy: 0.05868102031965183
Energy: 0.029205101754648834
Energy: 0.05683643631463691
Energy: 0.05676444248234337
Energy: 0.02911728052928564
Energy: 0.05692415513125112
Energy: 0.05678906670023661

minimum gb energy = 0.02833373178894466 eV
minimum distance =  2.53438416047204 Angstroms
sigma value = 3


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

Energy: 0.4742528807064636
Energy: 0.4892442884366452
Energy: 0.4681839325766589
Energy: 0.4318451029253346
Energy: 0.46296437107992283
Energy: 0.43168861673089126
Energy: 0.46157553205792745
Energy: 0.47625756159289895
Energy: 0.47442769172399923
Energy: 0.47039290244534326
Energy: 0.4724079610992942
Energy: 0.47512615366379096
Energy: 0.4754201779995345
Energy: 0.44224704263365244
Energy: 0.44248066358750554
Energy: 0.46784793120959695
Energy: 0.4383912720505016
Energy: 0.4626050519413514
Energy: 0.4493691420327252
Energy: 0.4421632651545643
Energy: 0.4423379203670556
Energy: 0.4493602488415764
Energy: 0.40788081555845146
Energy: 0.46561257068419626
Energy: 0.40460161607901324
Energy: 0.4757473417435171
Energy: 0.4745259775524232
Energy: 0.40512634291302946
Energy: 0.47322526065645326
Energy: 0.47422600652283514
Energy: 0.45226464035613584
Energy: 0.4808912140435709
Energy: 0.4521046352698416
Energy: 0.3739647233186895
Energy: 0.4798682642249701
Energy: 0.42527058959300507
Energy: 0.4522736717291891
Energy: 0.4120467968515159
Energy: 0.4600248072151797
Energy: 0.4520037110239291
Energy: 0.4167532414404361
Energy: 0.45907629059778204
Energy: 0.4472943856380716
Energy: 0.43623290111146484
Energy: 0.4346746074808784
Energy: 0.4473572750799094
Energy: 0.3540205870684302
Energy: 0.4351743509664023
Energy: 0.4745604821620379
Energy: 0.4354992319357411
Energy: 0.46155998217835154
Energy: 0.4607574259987381
Energy: 0.3767740026449376
Energy: 0.46375284083200574
Energy: 0.38504355130023954
Energy: 0.41376189782097644
Energy: 0.41459696235420807
Energy: 0.42897171429590336
Energy: 0.4172555509110381
Energy: 0.42757717895634084
Energy: 0.45230175994150906
Energy: 0.4412243488777813
Energy: 0.4421328623435378
Energy: 0.36192452611344283
Energy: 0.45651661390687903
Energy: 0.4164614248672891
Energy: 0.38298353816924785
Energy: 0.44426559876995403
Energy: 0.4444053052859535
Energy: 0.38294052536352163
Energy: 0.4333111566785896
Energy: 0.38280348284454535
Energy: 0.386189874279116
Energy: 0.3852555622001292
Energy: 0.4228301368247586
Energy: 0.386096958984942
Energy: 0.3496086737886879
Energy: 0.40533760116210604
Energy: 0.4436091001244249
Energy: 0.41647062116185846
Energy: 0.4231723211164324
Energy: 0.38729568398232056
Energy: 0.3648135568384421
Energy: 0.4229751938917386
Energy: 0.4437753467414617
Energy: 0.36320798365849705
Energy: 0.36301852830722525
Energy: 0.44387690455567147
Energy: 0.36732608775527525
Energy: 0.36432253832936523
Energy: 0.4425654568166241
Energy: 0.4125346142109196
Energy: 0.4113358882777878
Energy: 0.35524519559667606
Energy: 0.4373490685687891
Energy: 0.4114116411269301
Energy: 0.35737472033023493
Energy: 0.41156635757596133
Energy: 0.4098912833689032
Energy: 0.3529864572859235
Energy: 0.36598689074260493
Energy: 0.3519918166809218
Energy: 0.3538266492582881
Energy: 0.3873495787762345
Energy: 0.4064199924686731
Energy: 0.35412228204886315
Energy: 0.3554118105913938
Energy: 0.40707272381959164
Energy: 0.4476345480463392
Energy: 0.39237628820403136
Energy: 0.4060944254765982
Energy: 0.3559551486451022
Energy: 0.35431344241852525
Energy: 0.4060047816386474
Energy: 0.4384855746079562
Energy: 0.3525484691380747
Energy: 0.3522709413804916
Energy: 0.4381861339419726
Energy: 0.35745976107250105
Energy: 0.35340883995205097
Energy: 0.43755416548866705
Energy: 0.4120370836468086
Energy: 0.41119612723321725
Energy: 0.3652932948714534
Energy: 0.41066368198413894
Energy: 0.4101664269850619
Energy: 0.3680699449656066
Energy: 0.41224314833348163
Energy: 0.41026822813585856
Energy: 0.3664260751839279
Energy: 0.4097419883938288
Energy: 0.36343202884384895
Energy: 0.3637083536062578
Energy: 0.3871205433798152
Energy: 0.4237967876326139
Energy: 0.3636641596897541
Energy: 0.38931987731896683
Energy: 0.38638061929995493
Energy: 0.44510476431882073
Energy: 0.3851599887451019
Energy: 0.42271742054382566
Energy: 0.3554558249825432
Energy: 0.3847822598603103
Energy: 0.4117332214304906
Energy: 0.45908240078734536
Energy: 0.38289052191715695
Energy: 0.38305826191753073
Energy: 0.4567635893710413
Energy: 0.38975149604092796
Energy: 0.3842001143092753
Energy: 0.4597926372797287
Energy: 0.4274014378238861
Energy: 0.42773393190947406
Energy: 0.4571406898469297
Energy: 0.4077133784844716
Energy: 0.4424930083045808
Energy: 0.41593776226546886
Energy: 0.4269329040122874
Energy: 0.4293650537577764
Energy: 0.41641417543265474
Energy: 0.4624542813458274
Energy: 0.4282010230980319
Energy: 0.3916646882815256
Energy: 0.40714433000998124
Energy: 0.40918715149924606
Energy: 0.3917390251680571
Energy: 0.4090138716627399
Energy: 0.4615320110257338
Energy: 0.4580235323400788
Energy: 0.45510327535375616
Energy: 0.45186664888852407
Energy: 0.3665197049620217
Energy: 0.44771299138626347
Energy: 0.42095513145339775
Energy: 0.4199702822326767
Energy: 0.4596195955635577
Energy: 0.4564011684449216
Energy: 0.41930742085554273
Energy: 0.45046504759594963
Energy: 0.4691507644311269
Energy: 0.4638695518348622
Energy: 0.4426722044451914
Energy: 0.44052655762662574
Energy: 0.4635325900636349
Energy: 0.358002455527409
Energy: 0.44052313847542024
Energy: 0.5137387225358179
Energy: 0.4418259079311122
Energy: 0.4715050412545658
Energy: 0.4780232536986229
Energy: 0.3859164578078164
Energy: 0.5012124948059425
Energy: 0.41255628527511706
Energy: 0.44654493945455714
Energy: 0.4549961381674365
Energy: 0.41287918601901014
Energy: 0.45101224542752244
Energy: 0.4438958878693988

minimum gb energy = 0.3496086737886879 eV
minimum distance =  2.35943756345088 Angstroms
sigma value = 67


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

Energy: 0.5582834954854947
Energy: 0.5604766773537069
Energy: 0.5450281478300272
Energy: 0.45945370729976326
Energy: 0.624709537452746
Energy: 0.5453995701508819
Energy: 0.5296436825882767
Energy: 0.5699719829395364
Energy: 0.566780914163229
Energy: 0.5550550796216143
Energy: 0.5763121965062867
Energy: 0.5541753388212985
Energy: 0.5658609042555178
Energy: 0.5005108971365538
Energy: 0.5402636326839582
Energy: 0.5532811194675122
Energy: 0.5003750368001204
Energy: 0.5450064265188629
Energy: 0.5225233417101215
Energy: 0.5410584804083759
Energy: 0.5398434409067877
Energy: 0.5231518709765994
Energy: 0.5257958244990798
Energy: 0.5477191101469431
Energy: 0.5193394001301591
Energy: 0.5632879604232865
Energy: 0.5625286239809909
Energy: 0.5198071842201927
Energy: 0.5632099965115205
Energy: 0.5749386599519606
Energy: 0.5396397501961098
Energy: 0.548807968478759
Energy: 0.5362314892698828
Energy: 0.4776470958165697
Energy: 0.5552501902733505
Energy: 0.5265276830151498
Energy: 0.5314890385979871
Energy: 0.5334831666030697
Energy: 0.5301573092892132
Energy: 0.5330852128663724
Energy: 0.5348720229358042
Energy: 0.5278714551351495
Energy: 0.522810538475327
Energy: 0.4603868267380014
Energy: 0.5117234777522036
Energy: 0.5230151134831224
Energy: 0.4559782324491588
Energy: 0.5406927011978488
Energy: 0.5505207866633506
Energy: 0.5411407168486025
Energy: 0.5420856677585749
Energy: 0.5356193549102971
Energy: 0.4855788303128737
Energy: 0.5405051331743738
Energy: 0.512912119291729
Energy: 0.48635890448805064
Energy: 0.48746919998585647
Energy: 0.5107274336481925
Energy: 0.4856438940470588
Energy: 0.49925868466151735
Energy: 0.5119775628290434
Energy: 0.5167811764028344
Energy: 0.5160061958243758
Energy: 0.4599831877428755
Energy: 0.5393537035827216
Energy: 0.516401922622097
Energy: 0.4649881935783516
Energy: 0.4894212442721569
Energy: 0.51268414024193
Energy: 0.46530351858693675
Energy: 0.48701364260779234
Energy: 0.46071811826020387
Energy: 0.4640438991477264
Energy: 0.4655690382233213
Energy: 0.46000643889892695
Energy: 0.4645343421181878
Energy: 0.4616634911012841
Energy: 0.45997611282123446
Energy: 0.5407378635457591
Energy: 0.5072333411604806
Energy: 0.504957697947126
Energy: 0.4600533779951638
Energy: 0.5030554483625449
Energy: 0.5042371070788321
Energy: 0.539565431162441
Energy: 0.46200386244173786
Energy: 0.4644923586348803
Energy: 0.5391124461307778
Energy: 0.4610352380952543
Energy: 0.46013057954864095
Energy: 0.5408057625617396
Energy: 0.5173149111075412
Energy: 0.5142802702635643
Energy: 0.4840204115966729
Energy: 0.5099722714527959
Energy: 0.5126135643053314
Energy: 0.48417687461145575
Energy: 0.45645751800761153
Energy: 0.5029967997849766
Energy: 0.4848574098921634
Energy: 0.45258848891766745
Energy: 0.4982704143063034
Energy: 0.49073176514124534
Energy: 0.5419330269325087
Energy: 0.5406859388067533
Energy: 0.4829091636322782
Energy: 0.53624474604866
Energy: 0.4846557540974695
Energy: 0.5364825791758809
Energy: 0.535644061540865
Energy: 0.5277292638227655
Energy: 0.4645434374944822
Energy: 0.5532746837696226
Energy: 0.5285905614813625
Energy: 0.4878026857893536
Energy: 0.5314636169209873
Energy: 0.5308431313265255
Energy: 0.5322276546376988
Energy: 0.5287109207734172
Energy: 0.5431448319950786
Energy: 0.5328553565309452
Energy: 0.5050519231344289
Energy: 0.5545302369617268
Energy: 0.5326728372455143
Energy: 0.5247368055358103
Energy: 0.5526374943440312
Energy: 0.5647990837073362
Energy: 0.5227330439099488
Energy: 0.548475590972707
Energy: 0.5540568383762978
Energy: 0.46350402585526607
Energy: 0.5525528342664733
Energy: 0.5295365698910228
Energy: 0.5294023475368345
Energy: 0.53121925674559
Energy: 0.5304095061135043
Energy: 0.5231248676873422
Energy: 0.5275078165586837

minimum gb energy = 0.45258848891766745 eV
minimum distance =  2.35215885278048 Angstroms
sigma value = 33


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

Energy: 0.6423747907363871
Energy: 0.6502554435946092
Energy: 0.6524865747077698
Energy: 0.5581039178779907
Energy: 0.6596160661235144
Energy: 0.607840336785153
Energy: 0.6046865938641156
Energy: 0.6365911478217864
Energy: 0.6362547982567887
Energy: 0.6379325278195069
Energy: 0.6311443388842751
Energy: 0.6389110773723653
Energy: 0.6495263299272379
Energy: 0.5783363562361069
Energy: 0.5981836822929939
Energy: 0.6312555191144791
Energy: 0.5746903894755582
Energy: 0.598360155374908
Energy: 0.5838475276890221
Energy: 0.5800471282337993
Energy: 0.5964302323754663
Energy: 0.5838414784480055
Energy: 0.5911484100014863
Energy: 0.6143703147694057
Energy: 0.5834429801072917
Energy: 0.6328338356842245
Energy: 0.6365182618546087
Energy: 0.5844317956850784
Energy: 0.6329367594712368
Energy: 0.6376304317800766
Energy: 0.5746002601764223
Energy: 0.6304040259420391
Energy: 0.6106210756261317
Energy: 0.5377059478459298
Energy: 0.6337893968942242
Energy: 0.5345138395522492
Energy: 0.5828360953244048
Energy: 0.6372809211634066
Energy: 0.6404729065061071
Energy: 0.5835121697621539
Energy: 0.6357105166702659
Energy: 0.5836725678756419
Energy: 0.5845625548583366
Energy: 0.5421880135544316
Energy: 0.5428960364445651
Energy: 0.5843866434768176
Energy: 0.5463134289170188
Energy: 0.5674851178224676
Energy: 0.6120127685940705
Energy: 0.5432140244878603
Energy: 0.5796878933860115
Energy: 0.5868811702169817
Energy: 0.5435152086217286
Energy: 0.5907529345360373
Energy: 0.6146773773609538
Energy: 0.5451416290447431
Energy: 0.5417350252807243
Energy: 0.612037178700043
Energy: 0.5431408301437676
Energy: 0.5445938191375569
Energy: 0.5768580948674191
Energy: 0.5438522679630027
Energy: 0.5509332830979383
Energy: 0.5456102069731021
Energy: 0.5786164630901105
Energy: 0.5439347432958852
Energy: 0.5429763440440255
Energy: 0.5423812536777538
Energy: 0.5433697915874187
Energy: 0.5430702032728068
Energy: 0.5543637775694188
Energy: 0.5424068975091997
Energy: 0.5438349460803161
Energy: 0.5885057886609414
Energy: 0.5656290817048953
Energy: 0.5440188971135952
Energy: 0.5871185778786545
Energy: 0.542258831127896
Energy: 0.5260631905446421
Energy: 0.5922264312905067
Energy: 0.5439320290158707
Energy: 0.5293432549517988
Energy: 0.6181355982830257
Energy: 0.5272538946921035
Energy: 0.5733479069940687
Energy: 0.5830509181827426
Energy: 0.5879808318199559
Energy: 0.5773175152861958
Energy: 0.5834023957961045
Energy: 0.5684007810442353
Energy: 0.585304939565266
Energy: 0.5879228217194047
Energy: 0.6070650118963705
Energy: 0.5854846880775941
Energy: 0.5498671829871675
Energy: 0.584433177314029
Energy: 0.6471234211942483
Energy: 0.5477839900550159
Energy: 0.5690019498051968
Energy: 0.6304660511664518
Energy: 0.5531192015394822
Energy: 0.5506166398918942
Energy: 0.651848262677117
Energy: 0.6377018763283254
Energy: 0.5846440062545212
Energy: 0.6335405558920122
Energy: 0.6374366710694384
Energy: 0.6196767127797234
Energy: 0.6169232699170619
Energy: 0.6314047013447921
Energy: 0.6432715895079368
Energy: 0.5455170305049971
Energy: 0.6324233787905658
Energy: 0.540286742789068
Energy: 0.6044565141296288
Energy: 0.6366661675715239
Energy: 0.6368183404551135
Energy: 0.608312739753261
Energy: 0.632777919378831
Energy: 0.6384436988527812
Energy: 0.648979431926528
Energy: 0.5926063303461224
Energy: 0.6026892839123978
Energy: 0.6326878866874944
Energy: 0.5877537205026588
Energy: 0.6169822051392595
Energy: 0.6318274999053809
Energy: 0.578736203137566
Energy: 0.5786329389978052
Energy: 0.6309691568022792
Energy: 0.5747060126842815
Energy: 0.6128442321550367
Energy: 0.5836821574002545
Energy: 0.6322436090096599
Energy: 0.6364472941158204
Energy: 0.5841892544135351
Energy: 0.6324430786463562
Energy: 0.6398832486452637
Energy: 0.5766359584228298
Energy: 0.5544692680079443
Energy: 0.6115106200906391
Energy: 0.532110228898735
Energy: 0.6323677311697753
Energy: 0.5335333947307503
Energy: 0.5826234623943469
Energy: 0.586727885830317
Energy: 0.5872614353477409
Energy: 0.5838635022335525
Energy: 0.6346993028687504
Energy: 0.582535748039776
Energy: 0.5853436696107887
Energy: 0.5424933898379217
Energy: 0.5419810539571152
Energy: 0.5836671859761879
Energy: 0.5456170181726049
Energy: 0.568024601654166
Energy: 0.6121343846473545
Energy: 0.5432061624652319
Energy: 0.542733517288357
Energy: 0.5889114109140374
Energy: 0.57836226454027
Energy: 0.5901421551678298
Energy: 0.6123822834392292
Energy: 0.5454086746308978
Energy: 0.5423830102882639
Energy: 0.5888220752371518
Energy: 0.5434933823135588
Energy: 0.5436908159952976
Energy: 0.5761216289289599
Energy: 0.5682230335747188
Energy: 0.5428081333261665
Energy: 0.5464505863210113
Energy: 0.5779475817662036
Energy: 0.5442451641576079
Energy: 0.5426452260862928
Energy: 0.541698567307748
Energy: 0.543187007646235
Energy: 0.5426779396344835
Energy: 0.5487461294426291
Energy: 0.5414478953265787
Energy: 0.5448826051202794
Energy: 0.5880896276683234
Energy: 0.5689773386266543
Energy: 0.5447020082941403
Energy: 0.5883520468790041
Energy: 0.5418875531683244
Energy: 0.524399799680265
Energy: 0.5852205114967804
Energy: 0.5439120213423032
Energy: 0.5289978094390415
Energy: 0.6141825343031629
Energy: 0.5280819302027493
Energy: 0.5254200335583905
Energy: 0.5832825963860241
Energy: 0.5883872220558006
Energy: 0.5732191761134482
Energy: 0.5838981641310972
Energy: 0.5733212980861832
Energy: 0.5849428324962335
Energy: 0.6112875346242681
Energy: 0.5865340442956103
Energy: 0.5844551962600262
Energy: 0.5504223454031066
Energy: 0.5853237339696354
Energy: 0.647698057685237
Energy: 0.548152416177435
Energy: 0.570207476264024
Energy: 0.6298733585392896
Energy: 0.5239218644482436
Energy: 0.5507163372636901
Energy: 0.6535230099865591
Energy: 0.637750381079286
Energy: 0.6204001850876176
Energy: 0.6334892062864849
Energy: 0.6387300078089865
Energy: 0.6359471178305754
Energy: 0.5375577118259917
Energy: 0.6318492970341041
Energy: 0.6473271849355502
Energy: 0.5437392520058487
Energy: 0.6314749557961368
Energy: 0.5408722095093763

minimum gb energy = 0.5239218644482436 eV
minimum distance =  2.35942109436668 Angstroms
sigma value = 41


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

Energy: 0.8597458942385747
Energy: 0.6606708208543793
Energy: 0.6666863775763617
Energy: 0.6585762077580359
Energy: 0.7089863873409206
Energy: 0.6655442853274224
Energy: 0.6835798924955103
Energy: 0.6965620191103705
Energy: 0.6604040410912538
Energy: 0.7017446719402486
Energy: 0.7072193188373017
Energy: 0.6604718983382177
Energy: 0.7433530468659294
Energy: 0.6533357263157171
Energy: 0.6517031502064535
Energy: 0.6689359395803844
Energy: 0.6498024680025244
Energy: 0.6514351607280846
Energy: 0.7096501361645386
Energy: 0.6533412043265758
Energy: 0.6514791301110647
Energy: 0.7103884392794836
Energy: 0.6500828501765905
Energy: 0.6585514761611084
Energy: 0.6677448000614447
Energy: 0.6567549066479835
Energy: 0.6597719944428313
Energy: 0.6585034763544451
Energy: 0.6983510187141717
Energy: 0.6592640960527391
Energy: 0.6816064295982152
Energy: 0.6600294085456634
Energy: 0.6586195667661595
Energy: 0.6488212606163816
Energy: 0.6569044496242427
Energy: 0.6584186632128595
Energy: 0.6664882616583137
Energy: 0.7149487445864661
Energy: 0.6590140279531302
Energy: 0.6578838166249675
Energy: 0.6986214741017349
Energy: 0.6569398518545349
Energy: 0.6714096622876544
Energy: 0.657282875288404
Energy: 0.6595804553151775
Energy: 0.6719639064887569
Energy: 0.6553926837087631
Energy: 0.6613160453876251
Energy: 0.702919331121957
Energy: 0.6607064155221468
Energy: 0.6599419026403044
Energy: 0.6543989853874527
Energy: 0.6692773410927659
Energy: 0.6595811558938537
Energy: 0.6912325728646803
Energy: 0.6557872262371491
Energy: 0.6579709122383842
Energy: 0.6555000477223393
Energy: 0.6666942582933771
Energy: 0.6571781747587727
Energy: 0.7161289364705039
Energy: 0.6711173855350845
Energy: 0.6712870764854143
Energy: 0.7023547290934334
Energy: 0.6413392340672484
Energy: 0.6989873464537308
Energy: 0.7431693520115858
Energy: 0.6551540469659799
Energy: 0.6536882642161483
Energy: 0.668710937955261
Energy: 0.6479848567994935
Energy: 0.6540862589525762
Energy: 0.7496779686538237
Energy: 0.6991444197671053
Energy: 0.6699430446139413
Energy: 0.709287484412524
Energy: 0.7001683466257619
Energy: 0.660489566118014
Energy: 0.6764715151861145
Energy: 0.6745217238914576
Energy: 0.6544737553497099
Energy: 0.6423568574410119
Energy: 0.6694286238235965
Energy: 0.6561952310458407

minimum gb energy = 0.6413392340672484 eV
minimum distance =  2.38550734367032 Angstroms
sigma value = 11


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

Energy: 0.7802203481732647
Energy: 0.8530831795434121
Energy: 0.8207703055994765
Energy: 0.8079652832017525
Energy: 0.7905152685361423
Energy: 0.8012103231883362
Energy: 0.825613754754247
Energy: 0.7665027547440927
Energy: 0.7513349494773572
Energy: 0.7395031171285137
Energy: 0.7688390792943661
Energy: 0.7445936042069049
Energy: 0.8642571148487376
Energy: 0.7354472449484535
Energy: 0.7352681235112284
Energy: 0.7459113009356623
Energy: 0.735574726134108
Energy: 0.7391487124187167
Energy: 0.7750924358009628
Energy: 0.7361774481078333
Energy: 0.7395952038128717
Energy: 0.7500562734796581
Energy: 0.7350199635838162
Energy: 0.7389064890998306
Energy: 0.7815256969238614
Energy: 0.7494136639927614
Energy: 0.7448782811500732
Energy: 0.7449021001533478
Energy: 0.7635884877231864
Energy: 0.7437961274095711
Energy: 0.7778724548444877
Energy: 0.7412891902110326
Energy: 0.7413463121212466
Energy: 0.7441519706744809
Energy: 0.7871247772931067
Energy: 0.7419434301686529
Energy: 0.7791121799157098
Energy: 0.7410864948680389
Energy: 0.7409386359508509
Energy: 0.7831013174065751
Energy: 0.7393279142246338
Energy: 0.7411584979497869
Energy: 0.7750345926516411
Energy: 0.7437458199394235
Energy: 0.7435390052768086
Energy: 0.7630871680377012
Energy: 0.7417022052541095
Energy: 0.7450703527908433
Energy: 0.7914325129652068
Energy: 0.7398192364089085
Energy: 0.7395793823801255
Energy: 0.7301339059619023
Energy: 0.7495260887449747
Energy: 0.7413532683400116
Energy: 0.7977057919634862
Energy: 0.7399173841851392
Energy: 0.7395331696584477
Energy: 0.7308512090383221
Energy: 0.7411421075550523
Energy: 0.7413642765405006
Energy: 0.7834405890827751
Energy: 0.7485821288030031
Energy: 0.7565294750025733
Energy: 0.7678072800907187
Energy: 0.7431841359148277
Energy: 0.7502742336961237
Energy: 0.7706772399175603
Energy: 0.7361913894530026
Energy: 0.7363028704451483
Energy: 0.770414305741679
Energy: 0.7373668426602827
Energy: 0.736645644263395
Energy: 0.7707473347261395
Energy: 0.7388454731801654
Energy: 0.738973093551832
Energy: 0.7705110832953206
Energy: 0.7396235170406067
Energy: 0.738751804182168
Energy: 0.7654402004543245
Energy: 0.7409361709019372
Energy: 0.7390758667660144
Energy: 0.7351774885143947
Energy: 0.7458623217433511
Energy: 0.7385890354068464
Energy: 0.7632930779677783
Energy: 0.7405732186983068
Energy: 0.7392652811305523
Energy: 0.7541453686344055
Energy: 0.7392999022919109
Energy: 0.7385417659568634
Energy: 0.762802027698928
Energy: 0.7421284955209859
Energy: 0.7385557667069121
Energy: 0.7627845994663766
Energy: 0.7385967964690867
Energy: 0.7392089897273442
Energy: 0.7624451771103342
Energy: 0.740645938916325
Energy: 0.7398372691292509
Energy: 0.7604095899182579
Energy: 0.739709059825078
Energy: 0.7389375471730425
Energy: 0.7816006600532194
Energy: 0.7900937008583485
Energy: 0.7908712853789738
Energy: 0.7504409323281019
Energy: 0.8004281173202731
Energy: 0.7585560490859632
Energy: 0.7692813781154362
Energy: 0.7398654182886277
Energy: 0.740348445899125
Energy: 0.7697452458927952
Energy: 0.7534341853252234
Energy: 0.7384131192193826
Energy: 0.7614923753914837
Energy: 0.737576121724697
Energy: 0.7373639399644103
Energy: 0.754450471206606
Energy: 0.7378132259313458
Energy: 0.733855804457585
Energy: 0.8073851239601672
Energy: 0.7384385083173903
Energy: 0.7333331315670181
Energy: 0.7530339964754682
Energy: 0.7375426121776628
Energy: 0.7394216003822681
Energy: 0.8032404142257048
Energy: 0.7556002458649503
Energy: 0.7429621693422006
Energy: 0.7476638102852696
Energy: 0.7603915548984865
Energy: 0.7380109988297966
Energy: 0.7798697317763815
Energy: 0.7565639826835121
Energy: 0.7404477352568533
Energy: 0.7326602205795518
Energy: 0.7527256340643212
Energy: 0.7400916095026957
Energy: 0.8062837279748495
Energy: 0.7458335342859063
Energy: 0.7391507550332742
Energy: 0.753287231634897
Energy: 0.7690398090196858
Energy: 0.7385786859153252
Energy: 0.7862768047891883
Energy: 0.7386937682761919
Energy: 0.7388599978849298
Energy: 0.790430216270488
Energy: 0.7399762315585758
Energy: 0.7404928539890818
Energy: 0.7900751628625299
Energy: 0.7407166260924812
Energy: 0.7398693370403233
Energy: 0.7401698208628119
Energy: 0.7382780166731286
Energy: 0.7393446834469706
Energy: 0.7877616388712203
Energy: 0.7635948161865327
Energy: 0.740404012656248
Energy: 0.7388969575903319
Energy: 0.7629588653568348
Energy: 0.7382354908058573
Energy: 0.7875098142766868
Energy: 0.7410334958882314
Energy: 0.7394782246645984
Energy: 0.738976458523098
Energy: 0.741203226986236
Energy: 0.7389498985573192
Energy: 0.8606972873531854
Energy: 0.7329175633701022
Energy: 0.7326427836836849
Energy: 0.7955253763088026
Energy: 0.7373164610966366
Energy: 0.7333061627528882
Energy: 0.8578669839638017
Energy: 0.7584735697122684
Energy: 0.7393069690768757
Energy: 0.7396223046988039
Energy: 0.7724133316795093
Energy: 0.7388022489075072
Energy: 0.7927667667805522
Energy: 0.7680957180638268
Energy: 0.7384594434929834
Energy: 0.7350832459199639
Energy: 0.7687172457102686
Energy: 0.7382277165429301

minimum gb energy = 0.7301339059619023 eV
minimum distance =  2.38171699986342 Angstroms
sigma value = 57


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

Energy: 1.0274461425393744
Energy: 0.7922222932937825
Energy: 0.7961483951614423
Energy: 0.7948156605505222
Energy: 0.7711879930646557
Energy: 0.7970221075609222
Energy: 0.8125991663228042
Energy: 0.779827849763216
Energy: 0.7756284427452129
Energy: 0.7710236311621171
Energy: 0.77370747236689
Energy: 0.7750159715011617
Energy: 0.8409479286154672
Energy: 0.765120120310165
Energy: 0.7689579793878181
Energy: 0.7763280755640645
Energy: 0.7652885616725551
Energy: 0.782305939001285
Energy: 0.7699527897560834
Energy: 0.7738548734492213
Energy: 0.7728714500215774
Energy: 0.7712521989125752
Energy: 0.7648505659022452
Energy: 0.7742023674536743
Energy: 0.8106768327276763
Energy: 0.7781497239140472
Energy: 0.7743764715305705
Energy: 0.7727237254049237
Energy: 0.7739651327681634
Energy: 0.7733306004460327
Energy: 0.7693911718624112
Energy: 0.792791768460267
Energy: 0.7734923706707313
Energy: 0.7702907048343003
Energy: 0.7881251618735483
Energy: 0.7741356834243897
Energy: 0.7884700598139868
Energy: 0.7561772061816312
Energy: 0.7673754563343361
Energy: 0.788878631089659
Energy: 0.7530169758136797
Energy: 0.7910754647047571
Energy: 0.8369408143950912
Energy: 0.7737023381651065
Energy: 0.7736780511039053
Energy: 0.7727519948737362
Energy: 0.7704774224208714
Energy: 0.7747292425008904
Energy: 0.8483731088462962
Energy: 0.7791159248990596
Energy: 0.7672716361681501
Energy: 0.7680435768183577
Energy: 0.7745643215562432
Energy: 0.7669562912868457
Energy: 0.8476246368016762
Energy: 0.7796829435925943
Energy: 0.7671401076594996
Energy: 0.7681332752241975
Energy: 0.7764362100674986
Energy: 0.7668676776823661
Energy: 0.8384966756229614
Energy: 0.7759972940915894
Energy: 0.776646227061165
Energy: 0.7722138052755623
Energy: 0.7698041703567493
Energy: 0.7828667629631862
Energy: 0.7731036914068162
Energy: 0.7642529565395092
Energy: 0.7650296339760535
Energy: 0.7735390743572367
Energy: 0.7638610357367959
Energy: 0.7820734167591195
Energy: 0.7714500922890508
Energy: 0.781734945710015
Energy: 0.7735901456922382
Energy: 0.7725404017640394
Energy: 0.7709557344270079
Energy: 0.7732658660639722
Energy: 0.769507755562545
Energy: 0.7740742269515836
Energy: 0.7735055827806481
Energy: 0.7701762788964059
Energy: 0.7790913764136392
Energy: 0.7730007468572452
Energy: 0.7877727198157717
Energy: 0.7615984422852922
Energy: 0.7738408998628187
Energy: 0.7725086668397875
Energy: 0.7547303137736728
Energy: 0.7739831454092679
Energy: 0.837486583962038
Energy: 0.7631137692160749
Energy: 0.7668881790109887
Energy: 0.77569075713573
Energy: 0.7552206243706395
Energy: 0.7731193064867811
Energy: 0.8128984978740159
Energy: 0.7768446365326217
Energy: 0.7749809507913626
Energy: 0.7847532183098368
Energy: 0.7718036405211043
Energy: 0.7740825042361372

minimum gb energy = 0.7530169758136797 eV
minimum distance =  2.38726267340627 Angstroms
sigma value = 9


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

Energy: 0.8863792290465613
Energy: 0.8065221358298454
Energy: 0.791484900934509
Energy: 0.8421287731872716
Energy: 0.8695505787625528
Energy: 0.8433427662252367
Energy: 0.8820234402018613
Energy: 0.8144650203560718
Energy: 0.8134244370600473
Energy: 0.8005833207065098
Energy: 0.8228748940493512
Energy: 0.8122546924011834
Energy: 0.8440188166634851
Energy: 0.8054455741354459
Energy: 0.8061983937394273
Energy: 0.8142464365045177
Energy: 0.801025894440306
Energy: 0.8042948443045942
Energy: 0.8081077100922591
Energy: 0.8043072884414978
Energy: 0.7958203516302857
Energy: 0.8093273461340995
Energy: 0.8060144715203141
Energy: 0.7958596053089751
Energy: 0.793987540431437
Energy: 0.8140483314741241
Energy: 0.8198759098983923
Energy: 0.7947409763237304
Energy: 0.8243736014345123
Energy: 0.8204607949758546
Energy: 0.79165547173147
Energy: 0.7956084897148206
Energy: 0.7933425399649683
Energy: 0.7925698524977617
Energy: 0.7953474655868604
Energy: 0.7928843576952834
Energy: 0.8039706502359977
Energy: 0.7925695239418711
Energy: 0.7908469106530447
Energy: 0.8035692067636271
Energy: 0.7934022934845476
Energy: 0.8175686757911181
Energy: 0.8564443917055589
Energy: 0.7964912391812302
Energy: 0.7972622118211333
Energy: 0.7999557509538153
Energy: 0.7999159437405814
Energy: 0.7978232920266951
Energy: 0.8425504181824695
Energy: 0.8114735740223485
Energy: 0.8055899945169369
Energy: 0.800653082809077
Energy: 0.8035736089135839
Energy: 0.7984083692489707
Energy: 0.8438171432693417
Energy: 0.8108224169857454
Energy: 0.8052614372486278
Energy: 0.8000748153709419
Energy: 0.8042054105732306
Energy: 0.8018409430943375
Energy: 0.8521065576706921
Energy: 0.8024527829451955
Energy: 0.8006396670395944
Energy: 0.8103469983724433
Energy: 0.808662852962389
Energy: 0.7997425113157747
Energy: 0.8463957226833934
Energy: 0.8093642027601112
Energy: 0.8164211531862161
Energy: 0.8303666285100033
Energy: 0.7943242429698522
Energy: 0.817017363816542
Energy: 0.841595350704273
Energy: 0.8069916157207127
Energy: 0.8036146866192946
Energy: 0.7941760749862282
Energy: 0.8085818053328678
Energy: 0.7916212608636837
Energy: 0.8450794540136617
Energy: 0.7986580132469887
Energy: 0.7975577423610495
Energy: 0.79806991431857
Energy: 0.7957201869728459
Energy: 0.7953804197820533
Energy: 0.8374896184156541
Energy: 0.7915456706068519
Energy: 0.7968225857393261
Energy: 0.8231903752286991
Energy: 0.792004466394977
Energy: 0.8188702496006984
Energy: 0.8225526216599561
Energy: 0.7892567527394674
Energy: 0.8044315441057136
Energy: 0.8238599506958042
Energy: 0.8002493344541654
Energy: 0.8017434422406204
Energy: 0.823756023034697
Energy: 0.8072598468150622
Energy: 0.7999093237974222
Energy: 0.8253909488925516
Energy: 0.8070225736137425
Energy: 0.801058603611569
Energy: 0.8218290986718237
Energy: 0.8106020186256053
Energy: 0.8149257656077759
Energy: 0.7998296314692901
Energy: 0.8270745373881083
Energy: 0.8183739151474895
Energy: 0.8259081518732666
Energy: 0.8079082755201519
Energy: 0.8018974369155963
Energy: 0.82626516257357
Energy: 0.8071269109978679
Energy: 0.8048214541929892
Energy: 0.8403356428070343
Energy: 0.8085691831513407
Energy: 0.8003858289233925
Energy: 0.8093581419794025
Energy: 0.8042127076697291
Energy: 0.8042800089244793
Energy: 0.8552931261788356
Energy: 0.815476651257591
Energy: 0.817493872541354
Energy: 0.8004744962650722
Energy: 0.8240840265026464
Energy: 0.8192974442743803

minimum gb energy = 0.7892567527394674 eV
minimum distance =  2.33322168298082 Angstroms
sigma value = 27


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

Energy: 0.7857482024190714
Energy: 0.7766683646600228
Energy: 0.7769424531662986
Energy: 0.7872123402587227
Energy: 1.205969702146325
Energy: 0.7784389724908708
Energy: 0.767777795260513
Energy: 0.7719239835493455
Energy: 0.770090719926538
Energy: 0.7681482461867184
Energy: 0.7724475793656328
Energy: 0.7708911027534718
Energy: 0.7811147441711286
Energy: 0.7698699031687625
Energy: 0.7691612985990938
Energy: 0.770479211684429
Energy: 0.7508376699026733
Energy: 0.7695592914217979
Energy: 0.7968134146606546
Energy: 0.7744662718590254
Energy: 0.773012038405953
Energy: 0.7954374312115777
Energy: 0.7700402014707711
Energy: 0.7725790200356892
Energy: 0.7516568573645059
Energy: 0.775827621504311
Energy: 0.7733340512199779
Energy: 0.7530068982007796
Energy: 0.7781385920559438
Energy: 0.7729273903073215
Energy: 0.7718235817584918
Energy: 0.7696906862261288
Energy: 0.7679931510715103
Energy: 0.7724412418909085
Energy: 0.7736614175207409
Energy: 0.7678663685287664
Energy: 0.8034734542149963
Energy: 0.7651615017615558
Energy: 0.776015141705011
Energy: 0.7762684763967181
Energy: 0.7517456271634125
Energy: 0.7734400099208008
Energy: 0.8066469711261041
Energy: 0.7679973087935843
Energy: 0.7719297558074071
Energy: 0.7837315504139363
Energy: 0.7605863463701695
Energy: 0.7715626751147012
Energy: 0.8464913828266686
Energy: 0.7683990102861341
Energy: 0.7772069482253546
Energy: 0.7765040773604255
Energy: 0.7668875948006794
Energy: 0.7739668192975336
Energy: 0.8503909819814988
Energy: 0.7759036874558055
Energy: 0.774146326621771
Energy: 0.773678158572764
Energy: 0.7787115587004813
Energy: 0.7736324738125705
Energy: 0.8073023732886544
Energy: 0.7755369391029034
Energy: 0.773438281901426
Energy: 0.7840396450513518
Energy: 0.7541258776695738
Energy: 0.7725258558957622
Energy: 0.8524629905421339
Energy: 0.772574564497104
Energy: 0.7702679164005929
Energy: 0.7760911797727242
Energy: 0.7647555990011695
Energy: 0.7689040359063299
Energy: 0.7522360251157552
Energy: 0.7738783225812831
Energy: 0.7686321576803756
Energy: 0.7531109295745321
Energy: 0.7757436027532004
Energy: 0.7694408329246302
Energy: 0.751911946844299
Energy: 0.7760597500911982
Energy: 0.7731633836983917
Energy: 0.7541458673347787
Energy: 0.7821101496254685
Energy: 0.7631381759533056
Energy: 0.8076158991628926
Energy: 0.7757975058737171
Energy: 0.7739518524718054
Energy: 0.7844443782528302
Energy: 0.7738057217940376
Energy: 0.7740811732068841
Energy: 0.773890217038532
Energy: 0.774981456286041
Energy: 0.7743696415566351
Energy: 0.7729776218284132
Energy: 0.7757134705500164
Energy: 0.7762925798366672
Energy: 0.7536469163154035
Energy: 0.7731304719730868
Energy: 0.7709280853672204
Energy: 0.7550639785136625
Energy: 0.7765772505916466
Energy: 0.7710579006330116
Energy: 0.7758460701027245
Energy: 0.7735016185229117
Energy: 0.7715062837629331
Energy: 0.7661210330816338
Energy: 0.7771303073321614
Energy: 0.7719383820629739
Energy: 0.7933610784449718
Energy: 0.7661873562396797
Energy: 0.7655554315089158
Energy: 0.7927109569645092
Energy: 0.7520880602682543
Energy: 0.7654393763023114
Energy: 0.8079059892153475
Energy: 0.7660884150912962
Energy: 0.7653988489016562
Energy: 0.7759829225799648
Energy: 0.7521415141309306
Energy: 0.7652067941386748
Energy: 0.8506988460006867
Energy: 0.7752766820477529
Energy: 0.772999333638051
Energy: 0.7715058897702964
Energy: 0.7774291905494892
Energy: 0.7726669875543578
Energy: 0.7497789535843505
Energy: 0.7645953172909742
Energy: 0.7673102995889363
Energy: 0.7508863936336756
Energy: 0.7651410435849051
Energy: 0.769067640919529
Energy: 0.8523267465912329
Energy: 0.7745099306883613
Energy: 0.7708876587071514
Energy: 0.7829387321712341
Energy: 0.7674547721131979
Energy: 0.7690462272187999
Energy: 0.8096298699241044
Energy: 0.7773312847881808
Energy: 0.7742260542001844
Energy: 0.776125665487057
Energy: 0.7774867127318972
Energy: 0.7736826023590673
Energy: 0.7515519602188138
Energy: 0.7761259772334833
Energy: 0.7733794168032184
Energy: 0.7537449119384039
Energy: 0.77715860649213
Energy: 0.7631535971468303

minimum gb energy = 0.7497789535843505 eV
minimum distance =  2.36053233005128 Angstroms
sigma value = 19


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

Energy: 0.8048698192870768
Energy: 0.7800504154520622
Energy: 0.790531399612833
Energy: 0.7914973540022056
Energy: 0.7775422488666492
Energy: 0.7747261810979578
Energy: 0.8698431007635654
Energy: 0.7675618831404455
Energy: 0.773617885471406
Energy: 0.7673130876011948
Energy: 0.7785713528106638
Energy: 0.7730737017682571
Energy: 0.7963972938369331
Energy: 0.7709796866278562
Energy: 0.7676636583592623
Energy: 0.7612152893461965
Energy: 0.7691812491413343
Energy: 0.772995264321217
Energy: 0.7940460647602408
Energy: 0.77176684589834
Energy: 0.7704221709786455
Energy: 0.7895655975076046
Energy: 0.7677510883861216
Energy: 0.7704862993952066
Energy: 0.779865986514265
Energy: 0.7764820168170857
Energy: 0.7795600942843124
Energy: 0.7758438914099247
Energy: 0.7656525650468785
Energy: 0.7796926084138992
Energy: 0.7774988691885963
Energy: 0.7708847038135391
Energy: 0.7702534631484418
Energy: 0.76930475680825
Energy: 0.7685150755253672
Energy: 0.773439506609143
Energy: 0.7791192958884123
Energy: 0.7561300667299865
Energy: 0.7560171156968251
Energy: 0.7658488396940684
Energy: 0.7623591404291471
Energy: 0.7614949636163199
Energy: 0.7858747364404551
Energy: 0.7577275019027203
Energy: 0.7711047588536625
Energy: 0.78176509731602
Energy: 0.760419351108082
Energy: 0.7718209885698736
Energy: 0.7657483220881418
Energy: 0.7726122456863076
Energy: 0.7684532196865215
Energy: 0.7662092014701264
Energy: 0.779532973731565
Energy: 0.7682745008294295
Energy: 0.7670998972531968
Energy: 0.7623458907544425
Energy: 0.7599324850896018
Energy: 0.767603361422862
Energy: 0.761149120203036
Energy: 0.7596904316902268
Energy: 0.7966297633313371
Energy: 0.7645944284162692
Energy: 0.7629821193580145
Energy: 0.797207905995288
Energy: 0.7568629238364394
Energy: 0.7627759678458824
Energy: 0.802036201331598
Energy: 0.7594141702898851
Energy: 0.7652226185251184
Energy: 0.7625761872516342
Energy: 0.7530620571480339
Energy: 0.7633149379919167
Energy: 0.7900009630461243
Energy: 0.7569103224708568
Energy: 0.7513580823338544
Energy: 0.7603475516780513
Energy: 0.7621411237740422
Energy: 0.7524057019384107
Energy: 0.8064081115973045
Energy: 0.7624600699474373
Energy: 0.7621035488672946
Energy: 0.7513060527493881
Energy: 0.765166012517897
Energy: 0.7624950149395651
Energy: 0.8058148731815795
Energy: 0.7578941393933682
Energy: 0.7602438314079178
Energy: 0.7738279897097551
Energy: 0.7517623576640707
Energy: 0.7602607855032256
Energy: 0.8105675059157958
Energy: 0.7596004493274475
Energy: 0.7567401735851301
Energy: 0.7510428192805765
Energy: 0.7517871924445678
Energy: 0.7523228525623079
Energy: 0.7749571952594682
Energy: 0.7610511075831198
Energy: 0.7688565450856134
Energy: 0.7502837161281011
Energy: 0.7738808307478162
Energy: 0.7690306618586689
Energy: 0.7916286339745711
Energy: 0.750100480445058
Energy: 0.7498331969204616
Energy: 0.7470405253420663
Energy: 0.7501527927042371
Energy: 0.7585097305623255
Energy: 0.8082974851208153
Energy: 0.7576045491482424
Energy: 0.7597066150847475
Energy: 0.7682263960634628
Energy: 0.7685947387360625
Energy: 0.7636283248602055
Energy: 0.7715735767477846
Energy: 0.7588916279753654
Energy: 0.7603051978889638
Energy: 0.754221899929636
Energy: 0.7521457987983773
Energy: 0.7633764786650072
Energy: 0.7499792181364849
Energy: 0.7630384618075334
Energy: 0.7619860759715456
Energy: 0.7514733268634503
Energy: 0.7523545565557086
Energy: 0.7611808389575644
Energy: 0.7476072517101079
Energy: 0.7679368921998337
Energy: 0.765331944157462
Energy: 0.7493441684901465
Energy: 0.7652931211516553
Energy: 0.7640796685745133
Energy: 0.7616728073222577
Energy: 0.7543381186923926
Energy: 0.7539037077174264
Energy: 0.763448989803924
Energy: 0.7791566614424115
Energy: 0.7526307780433167
Energy: 0.7853332047338035
Energy: 0.753727877462379
Energy: 0.7497734115689264
Energy: 0.7808427797549561
Energy: 0.7445346024069968
Energy: 0.7594310561313592
Energy: 0.7874280611784938
Energy: 0.7666733044687667
Energy: 0.7654060742097448
Energy: 0.7545838788745706
Energy: 0.7735064434274982
Energy: 0.7645969698503795
Energy: 0.776182796635473
Energy: 0.7698339299846706
Energy: 0.763948858456837
Energy: 0.7633640572343147
Energy: 0.7681064899017993
Energy: 0.7633346695215375
Energy: 0.8011394753606861
Energy: 0.7729483668282453
Energy: 0.7603526323614993
Energy: 0.7605777824898257
Energy: 0.7672002731372264
Energy: 0.7603411883452365
Energy: 0.7985145008967034
Energy: 0.7677819889962989
Energy: 0.7676682535455811
Energy: 0.7769122031540925
Energy: 0.7668450275680136
Energy: 0.770316861123744
Energy: 0.7884868771221194
Energy: 0.7918059503923963
Energy: 0.7909681678925605
Energy: 0.7433070269019812
Energy: 0.791448800328892
Energy: 0.7564922402612697

minimum gb energy = 0.7433070269019812 eV
minimum distance =  2.34309144099491 Angstroms
sigma value = 101


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

Energy: 0.7592910459719996
Energy: 0.7542158089313793
Energy: 0.7522190704067923
Energy: 0.7272435142237837
Energy: 0.7294358361900182
Energy: 0.7478357789454778
Energy: 0.8032583041147543
Energy: 0.7290556091645175
Energy: 0.7293662082939528
Energy: 0.7260780542509996
Energy: 0.7244812700501098
Energy: 0.7281304746386709
Energy: 0.7699445377918308
Energy: 0.7318655825447016
Energy: 0.7309978841768792
Energy: 0.7635035717866333
Energy: 0.7248596177860832
Energy: 0.7465583630838507
Energy: 0.7587083639453257
Energy: 0.728436533389874
Energy: 0.7271544725052456
Energy: 0.7359071496547238
Energy: 0.7252502322632799
Energy: 0.7271619341784232
Energy: 0.7462463527350287
Energy: 0.753177016460679
Energy: 0.7535786150657365
Energy: 0.7573033610625689
Energy: 0.7655723993521112
Energy: 0.7529853523853577
Energy: 0.7429157059352984
Energy: 0.7291918969992811
Energy: 0.7279519814355632
Energy: 0.7414214142564525
Energy: 0.7283810452375606
Energy: 0.7280351658136597
Energy: 0.764178609257312
Energy: 0.7249487006145319
Energy: 0.7235267209352314
Energy: 0.7507241348262959
Energy: 0.720631749917734
Energy: 0.7385327340095493
Energy: 0.7300082349418394
Energy: 0.72827764039729
Energy: 0.7280008210992008
Energy: 0.7397498804211412
Energy: 0.7295228640377467
Energy: 0.7258746839058156
Energy: 0.7237716515090282
Energy: 0.7290337181327642
Energy: 0.7285785865725329
Energy: 0.7248924814430896
Energy: 0.7499089426291795
Energy: 0.7305412989892898
Energy: 0.7280921451627029
Energy: 0.7281916532514355
Energy: 0.7271630427600134
Energy: 0.7258631533834135
Energy: 0.7268281601638502
Energy: 0.7282557838556959
Energy: 0.7626713526066096
Energy: 0.7203462400975434
Energy: 0.7359119730648365
Energy: 0.7554463918765909
Energy: 0.7073652475319083
Energy: 0.734817354697568
Energy: 0.7717479326124609
Energy: 0.7254883574508473
Energy: 0.7296716075225428
Energy: 0.7439705659780135
Energy: 0.7269057764636555
Energy: 0.7296173130548991
Energy: 0.7418138153054843
Energy: 0.7417734251285742
Energy: 0.7410181080113304
Energy: 0.7237120787843044
Energy: 0.7408791243714923
Energy: 0.7266388810197518
Energy: 0.7384790339333008
Energy: 0.7313841915766452
Energy: 0.7307830530974481
Energy: 0.7193100083859851
Energy: 0.7297356107878064
Energy: 0.7305914649919757
Energy: 0.7736852889362241
Energy: 0.7367634672846409
Energy: 0.7376658703525217
Energy: 0.7651846029325327
Energy: 0.7328803477844716
Energy: 0.739759288603443
Energy: 0.7695922655427916
Energy: 0.7243665280711085
Energy: 0.7284975722400803
Energy: 0.730119768484637
Energy: 0.7290168238293239
Energy: 0.7285533025103178
Energy: 0.7423908254953787
Energy: 0.7483460208640125
Energy: 0.7243349565667969
Energy: 0.7053372483245247
Energy: 0.7558520232351827
Energy: 0.7204428484343409
Energy: 0.8073007473886681
Energy: 0.7314753200640299
Energy: 0.7300756649679541
Energy: 0.7234287895036401
Energy: 0.729861155812294
Energy: 0.7246183776698123
Energy: 0.7696738130912822
Energy: 0.730074441181681
Energy: 0.725305577378014
Energy: 0.764343069199657
Energy: 0.7271605360364813
Energy: 0.7262453748545482
Energy: 0.7577541812002943
Energy: 0.7316268889871783
Energy: 0.7278729356975395
Energy: 0.7292093616458035
Energy: 0.7237023231520633
Energy: 0.7284902156605267
Energy: 0.7427704878939915
Energy: 0.7289230304665402
Energy: 0.746437686116916
Energy: 0.7432835597164477
Energy: 0.7288366015165874
Energy: 0.7238305456304356
Energy: 0.740104776108424
Energy: 0.7304398652645221
Energy: 0.7280995908092038
Energy: 0.730852961613507
Energy: 0.7288743434350385
Energy: 0.7275811724388028
Energy: 0.7468776958205592
Energy: 0.7219125346317717
Energy: 0.7224816202769001
Energy: 0.7398425613559031
Energy: 0.7186083768416386
Energy: 0.7239591974215759
Energy: 0.7488450863046255
Energy: 0.7263503615478915
Energy: 0.7266301070182752
Energy: 0.7421033078131448
Energy: 0.7174659539860334
Energy: 0.7407412029149332
Energy: 0.7266001502378346
Energy: 0.7321516352996204
Energy: 0.7294273551147573
Energy: 0.7287840543008761
Energy: 0.727586434769367
Energy: 0.7274476432545437
Energy: 0.72429628332803
Energy: 0.7328844414225867
Energy: 0.7308894972535654
Energy: 0.728015523177258
Energy: 0.7374691029327387
Energy: 0.7312573708084141
Energy: 0.7408846212102935
Energy: 0.7209633794063772
Energy: 0.7229889372374184
Energy: 0.7233110909805399
Energy: 0.7083889307806526
Energy: 0.7255659328152471
Energy: 0.7701519933175954
Energy: 0.7241706675338466
Energy: 0.7257938901023938
Energy: 0.749557178085345
Energy: 0.7073380096870318
Energy: 0.7330282993167881
Energy: 0.7395705065102499
Energy: 0.7328012918686883
Energy: 0.7322971573995593
Energy: 0.7255210543137326
Energy: 0.7518522815546541
Energy: 0.7325612743422217
Energy: 0.7401677056524484
Energy: 0.7326320164804592
Energy: 0.7329457985384433
Energy: 0.7267283400083397
Energy: 0.7272158873197584
Energy: 0.7321657535220535
Energy: 0.7699730228897161
Energy: 0.7286860352874471
Energy: 0.7334216739875892
Energy: 0.7303886039601718
Energy: 0.725587862748475
Energy: 0.7341204614395334
Energy: 0.7708344438739702
Energy: 0.720297887639343
Energy: 0.7265449280868864
Energy: 0.740916871752048
Energy: 0.7238823879964419
Energy: 0.7270480210120686
Energy: 0.7374395211940495
Energy: 0.7374208098178868
Energy: 0.7245019012209852
Energy: 0.7047189992362491
Energy: 0.732817465343959
Energy: 0.7236945281231627

minimum gb energy = 0.7047189992362491 eV
minimum distance =  2.35720471124788 Angstroms
sigma value = 33


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

Energy: 0.015448913062078325
Energy: 0.016477006967009666
Energy: 0.0161496487872234
Energy: 0.017163037930619143
Energy: 0.9046206321802993
Energy: 0.0160657911558867
Energy: 0.01644093485755094
Energy: 0.10361686276683611
Energy: 0.10236150860997145
Energy: 0.10436168119921083
Energy: 0.10353394259768756
Energy: 0.10207879401623193
Energy: 1.1903027169534162
Energy: 0.9037939861301336
Energy: 0.9026664058132936
Energy: 0.902018347316092
Energy: 0.9050224155852565
Energy: 0.9023587750529276
Energy: 0.37801337320753964
Energy: 0.10361686276511133
Energy: 0.10236150861125275
Energy: 0.10436168119921083
Energy: 0.10353394259596277
Energy: 0.10207879401798138

minimum gb energy = 0.015448913062078325 eV
minimum distance =  2.52279900776715 Angstroms
sigma value = 1