Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Al__MO_519613893196_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.031999975442886
cohesive_energy=3.360958551709536
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.7874042746567398e-19, 2.49740885001384e-19, 2.9975923733822996e-19, 3.3831882238870793e-19, 3.6927607931085596e-19, 3.9479394656057395e-19, 4.1624709168983396e-19, 4.345711858528919e-19, 4.50408701879982e-19, 4.64205044875356e-19, 4.762822523424479e-19, 4.86879048599724e-19, 4.96173275253558e-19, 5.0430432167110795e-19, 5.11377931510218e-19, 5.174886331922939e-19, 5.22706922489232e-19, 5.270936821131239e-19, 5.30698579539624e-19, 5.33571282244386e-19, 5.357470381133579e-19, 5.37264299385756e-19, 5.38151905240992e-19, 5.38441899211746e-19, 5.38129474768116e-19, 5.37115296958794e-19, 5.35269589476426e-19, 5.324401455407819e-19, 5.284459191922199e-19, 5.23065810055248e-19, 5.16038663338524e-19, 5.07050452421784e-19, 4.957134505596e-19, 4.815630265281119e-19, 4.640207945624459e-19, 4.423641730006679e-19, 4.1569434075110396e-19, 3.82876956756882e-19, 3.4246044898759796e-19, 2.9257507731137394e-19, 2.30766307124922e-19, 1.537918135740162e-19, 5.7299444050059e-20, -6.4648628270217e-20, -2.20321717647876e-19, -4.2144615486716393e-19, -6.852685703047741e-19, -1.0380550476985019e-18, -1.52164322549199e-18, -2.20606905088728e-18, -3.2163535709886596e-18, -4.79353624949826e-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: 0.01041932970110028
Energy: 0.06504144517865879
Energy: 0.3546322788162804
Energy: 0.06504144517865879
Energy: 0.06504144517865879
Energy: 0.4382196981177508
Energy: 0.06504144517818261
Energy: 0.4382196981177508
Energy: 0.3546322788162804
Energy: 0.06504144517865879
Energy: 0.01041932970110028
Energy: 0.011015835811617459
Energy: 0.06504144517818261
Energy: 0.4382196981177508
Energy: 0.011015835811617459
Energy: 0.4382196981177508

minimum gb energy = 0.01041932970110028 eV
minimum distance =  2.80936271335826 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.7057744719437283
Energy: 0.5091305288004848
Energy: 0.5102091311130572
Energy: 0.5091305288010963
Energy: 0.4831424386147536
Energy: 0.5271768026312155
Energy: 0.483611929274146
Energy: 0.5271768026318269
Energy: 0.5095905124120718
Energy: 0.5091597155128862
Energy: 0.7675435288421872
Energy: 0.5091597155134977
Energy: 0.4847917754239549
Energy: 0.4822407947769576
Energy: 0.48348999092423045
Energy: 0.4822407947763461
Energy: 0.6570627668052886
Energy: 0.4833152372019149
Energy: 0.48474403775487385
Energy: 0.4833152372013034
Energy: 0.5110642937703452
Energy: 0.5381280604635837
Energy: 0.4838374883882703
Energy: 0.5381280604635837
Energy: 0.5046654099219738
Energy: 0.5227555650630019
Energy: 0.6556352604616266
Energy: 0.5227555650642249
Energy: 0.5045591012820007
Energy: 0.5033653809833958
Energy: 0.5257372190586902
Energy: 0.5033653809840072
Energy: 0.5701504636606601
Energy: 0.5518258506431454
Energy: 0.5135107406720038
Energy: 0.5518258506431454
Energy: 0.52280094184057
Energy: 0.5398331344945277
Energy: 0.5142082806670205
Energy: 0.5398331344951391
Energy: 0.5118783049062415
Energy: 0.5514866047168876
Energy: 0.5697054867073614
Energy: 0.5514866047168876
Energy: 0.5050525262975296
Energy: 0.5517793760788738
Energy: 0.5275207216229546
Energy: 0.5517793760788738
Energy: 0.5105859002487831
Energy: 0.5228491415728087
Energy: 0.4880658622965101
Energy: 0.5228491415715857
Energy: 0.5112689606606869
Energy: 0.5217958998004394
Energy: 0.506414996472487
Energy: 0.521795899799828
Energy: 0.4885142074239417
Energy: 0.48231826688012835
Energy: 0.48288095248246066
Energy: 0.4823182668807398
Energy: 0.5022712500870917
Energy: 0.48277103389461923
Energy: 0.4828094028391038
Energy: 0.48277103389584214
Energy: 0.5096869444817
Energy: 0.5091340135769856
Energy: 0.4767468833661144
Energy: 0.5091340135782086
Energy: 0.4833968540667222
Energy: 0.4847021666721466
Energy: 0.4882342427657522
Energy: 0.48470216667336957
Energy: 0.48387239326213516
Energy: 0.5093351086821662
Energy: 0.5110415569378312
Energy: 0.5093351086833892
Energy: 0.5107833320441725
Energy: 0.4829437376338846
Energy: 0.48438148706507517
Energy: 0.48294373763510756
Energy: 0.48431326062373853
Energy: 0.4830295475891436
Energy: 0.5028212011684304
Energy: 0.4830295475903666
Energy: 0.48356667666254655
Energy: 0.4831454941831448
Energy: 0.5110555876254428
Energy: 0.48314549418253333
Energy: 0.5029870693975447
Energy: 0.5236950496710141
Energy: 0.5029132782342599
Energy: 0.5236950496710141
Energy: 0.5259619115133436
Energy: 0.5232510665094328
Energy: 0.5041529598850834
Energy: 0.5232510665094328
Energy: 0.5140564031498528
Energy: 0.5529395350792824
Energy: 0.5702886786149868
Energy: 0.5529395350792824
Energy: 0.5150815224673007
Energy: 0.5514149154643964
Energy: 0.5240428369032959
Energy: 0.5514149154656193
Energy: 0.5708827095345697
Energy: 0.5521146988091429
Energy: 0.5121470034715353
Energy: 0.5521146988103658
Energy: 0.5256992798485703
Energy: 0.5509285733080149
Energy: 0.5041609119401703
Energy: 0.5509285733080149
Energy: 0.4886300675421523
Energy: 0.5229405193010102
Energy: 0.5106239595487728
Energy: 0.5229405193003988
Energy: 0.5062062648773737
Energy: 0.5217563084485145
Energy: 0.5118644030388164
Energy: 0.5217563084479029
Energy: 0.4824215430190124
Energy: 0.48228380816378846
Energy: 0.4887990000934884
Energy: 0.48228380816256555
Energy: 0.4825884769059882
Energy: 0.48253196868003556
Energy: 0.5021047375432803
Energy: 0.48253196867942405
Energy: 0.4766612196460373
Energy: 0.5092954173782511
Energy: 0.5101259761583081
Energy: 0.5092954173770281

minimum gb energy = 0.4766612196460373 eV
minimum distance =  2.57779816719799 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 0.8025879165663513
Energy: 0.5309389391733986
Energy: 0.5303146602722166
Energy: 0.5309389391733986
Energy: 0.502732288764546
Energy: 0.5486864972512794
Energy: 0.5028432917143458
Energy: 0.5486864972477935
Energy: 0.5313484796858926
Energy: 0.5312297224792238
Energy: 0.737740678134907
Energy: 0.5312297224764351
Energy: 0.5055753344452518
Energy: 0.5026416235789831
Energy: 0.5026915932859287
Energy: 0.5026416235789831
Energy: 0.5038143801583693
Energy: 0.5030568382095063
Energy: 0.5030954210198291
Energy: 0.5030568382067175
Energy: 0.5370412796514413
Energy: 0.5329142810161821
Energy: 0.5029901457805855
Energy: 0.5329142810133933
Energy: 0.5310933171206126
Energy: 0.5504624937893687
Energy: 0.6212811928184321
Energy: 0.5504624937907631
Energy: 0.5296787477357721
Energy: 0.5521927611999139
Energy: 0.5511908064089803
Energy: 0.5521927612027027
Energy: 0.5294580641109913
Energy: 0.5801766515420336
Energy: 0.5681814952218074
Energy: 0.5801766515385476
Energy: 0.5520372733263743
Energy: 0.5861163136062594
Energy: 0.5309941418496555
Energy: 0.586116313612534
Energy: 0.5111324883386898
Energy: 0.5513026933447981
Energy: 0.5416248880234161
Energy: 0.5513026933392206
Energy: 0.5316217516957933
Energy: 0.5502788918971373
Energy: 0.5373074321751327
Energy: 0.5502788918964401
Energy: 0.5032525910207759
Energy: 0.5029307791094799
Energy: 0.5117898834346516
Energy: 0.502930779113663
Energy: 0.502734762548221
Energy: 0.5030302554899477
Energy: 0.5236698231041288
Energy: 0.5030302554871591
Energy: 0.4940327158783141
Energy: 0.5310080414247081
Energy: 0.5314464822385756
Energy: 0.5310080414219195
Energy: 0.5113394558681222
Energy: 0.5053721486012395
Energy: 0.5027050849253398
Energy: 0.5053721486005424
Energy: 0.5308415874551863
Energy: 0.5311476434764655
Energy: 0.5044733328117388
Energy: 0.531147643475071
Energy: 0.5051371484167768
Energy: 0.5056471482130823
Energy: 0.5368353254942765
Energy: 0.505647148208202
Energy: 0.5032946974392084
Energy: 0.5034294642834948
Energy: 0.5039103552216702
Energy: 0.5034294642800088
Energy: 0.5370372414725885
Energy: 0.5034142974255277
Energy: 0.5031002934598073
Energy: 0.503414297426922
Energy: 0.5290644535854373
Energy: 0.5523652367405835
Energy: 0.5286223861341683
Energy: 0.5523652367384918
Energy: 0.5284422637549558
Energy: 0.552225934746031
Energy: 0.5521407296415168
Energy: 0.5522259347453339
Energy: 0.621477221802738
Energy: 0.5812067018761258
Energy: 0.536939076412101
Energy: 0.5812067018747314
Energy: 0.5515394794869306
Energy: 0.5807317379855921
Energy: 0.5298642393923265
Energy: 0.5807317379848947
Energy: 0.5108454954682434
Energy: 0.5512833389431278
Energy: 0.5417999790009832
Energy: 0.5512833389431278
Energy: 0.5314994647988035
Energy: 0.5503204707185559
Energy: 0.5390197951291765
Energy: 0.5503204707192532
Energy: 0.5027481167630599
Energy: 0.5027549473719669
Energy: 0.5121135318779982
Energy: 0.5027549473733612
Energy: 0.5031376315701519
Energy: 0.5028633399609159
Energy: 0.5237548384431492
Energy: 0.5028633399657962
Energy: 0.4938341337220824
Energy: 0.5310051029134819
Energy: 0.5304243877438173
Energy: 0.5310051029134819

minimum gb energy = 0.4938341337220824 eV
minimum distance =  2.57617651467501 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.7659057914475734
Energy: 0.554002843909358
Energy: 0.553576792871185
Energy: 0.554002843909358
Energy: 0.5260162907519833
Energy: 0.5709274891181242
Energy: 0.5255581250663576
Energy: 0.5709274891181242
Energy: 0.5533688909144274
Energy: 0.5541020218198556
Energy: 0.6954954564103113
Energy: 0.5541020218198556
Energy: 0.5290795248850156
Energy: 0.6004579997518174
Energy: 0.5255392561373285
Energy: 0.6004579997526278
Energy: 0.5244830767212777
Energy: 0.5254588658557088
Energy: 0.5264680354941572
Energy: 0.5254588658557088
Energy: 0.568074343220932
Energy: 0.5261703891634567
Energy: 0.5250851167215028
Energy: 0.5261703891634567
Energy: 0.5557692976302262
Energy: 0.5857071970850412
Energy: 0.5828352875324523
Energy: 0.5857071970850412
Energy: 0.5532554080325385
Energy: 0.5871041514306742
Energy: 0.5822992725859683
Energy: 0.5871041514306742
Energy: 0.5835498300816463
Energy: 0.5854894429329295
Energy: 0.5397876177871906
Energy: 0.5854894429329295
Energy: 0.5690308542758297
Energy: 0.5857158851346381
Energy: 0.5253845857156455
Energy: 0.5857158851338277
Energy: 0.5110564790722288
Energy: 0.5256672553704015
Energy: 0.5263062236758318
Energy: 0.5256672553704015
Energy: 0.5473457567908396
Energy: 0.5253347239214837
Energy: 0.5259521134761475
Energy: 0.5253347239222942
Energy: 0.5529931908736798
Energy: 0.5538708420914238
Energy: 0.5112097223877522
Energy: 0.5538708420914238
Energy: 0.5255123628189119
Energy: 0.5287155801023876
Energy: 0.5385834941519478
Energy: 0.5287155801023876
Energy: 0.5262670832586622
Energy: 0.5538749969210844
Energy: 0.5546478695506856
Energy: 0.5538749969210844
Energy: 0.5676277731914433
Energy: 0.5256629668942593
Energy: 0.5293311216115097
Energy: 0.5256629668942593
Energy: 0.5248846674064019
Energy: 0.5258749880686042
Energy: 0.5246678644763809
Energy: 0.5258749880686042
Energy: 0.5251477070361477
Energy: 0.525587782549745
Energy: 0.5675696171329853
Energy: 0.5255877825505555
Energy: 0.5828455046104555
Energy: 0.5881503695284162
Energy: 0.5564744793496406
Energy: 0.5881503695276057
Energy: 0.583296734761464
Energy: 0.5872143352594926
Energy: 0.5546075918998438
Energy: 0.5872143352603032
Energy: 0.5388941048819899
Energy: 0.5854739129520373
Energy: 0.5839711318304479
Energy: 0.5854739129520373
Energy: 0.5640497466684466
Energy: 0.5853922836380945
Energy: 0.5687477613536048
Energy: 0.585392283638905
Energy: 0.5259275991939745
Energy: 0.5256954880554727
Energy: 0.5109975130987892
Energy: 0.5256954880554727
Energy: 0.5256910597857762
Energy: 0.5254296355396375
Energy: 0.5474328498874517
Energy: 0.5254296355396375
Energy: 0.5109182129449168
Energy: 0.5536554363513007
Energy: 0.5537107733100654
Energy: 0.5536554363513007

minimum gb energy = 0.5109182129449168 eV
minimum distance =  2.57187323604521 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 0.7115749962498759
Energy: 0.5768856216411505
Energy: 0.5774518771004373
Energy: 0.5768856216421173
Energy: 0.5529256072192567
Energy: 0.5925777293497565
Energy: 0.5529807007529477
Energy: 0.5925777293497565
Energy: 0.5772630078755655
Energy: 0.5770641507580307
Energy: 0.553573702425435
Energy: 0.5770641507580307
Energy: 0.5554049002788911
Energy: 0.5933998115955456
Energy: 0.5530329379200305
Energy: 0.5933998115945788
Energy: 0.5515605007516482
Energy: 0.5531445679188478
Energy: 0.5545494672437443
Energy: 0.5531445679207815
Energy: 0.603803209954723
Energy: 0.5541973068374586
Energy: 0.553628777990808
Energy: 0.5541973068374586
Energy: 0.5785634363260463
Energy: 0.621148134022372
Energy: 0.5532616009433035
Energy: 0.6211481340233388
Energy: 0.5539048612030449
Energy: 0.6226852239342361
Energy: 0.6042815198055733
Energy: 0.6226852239323024
Energy: 0.552638059983446
Energy: 0.5530718087854666
Energy: 0.5264019527811482
Energy: 0.5530718087844998
Energy: 0.552958696325912
Energy: 0.5528186832953256
Energy: 0.5263266827346232
Energy: 0.552818683298226
Energy: 0.5273575129794865
Energy: 0.5768659931434821
Energy: 0.5767097530485017
Energy: 0.5768659931425153
Energy: 0.5809522896851526
Energy: 0.5565287594469411
Energy: 0.5527161084773085
Energy: 0.5565287594517753
Energy: 0.5771608168922582
Energy: 0.577564888755565
Energy: 0.5535842155418447
Energy: 0.5775648887536313
Energy: 0.5771198559650961
Energy: 0.5526026337983461
Energy: 0.6263199801311263
Energy: 0.5526026337973793
Energy: 0.5518559210632742
Energy: 0.5538245909513576
Energy: 0.5530535344463989
Energy: 0.5538245909561919
Energy: 0.6045882750316476
Energy: 0.5530815069072528
Energy: 0.5533515462315765
Energy: 0.5530815069091864
Energy: 0.5809816882390089
Energy: 0.6215048254627783
Energy: 0.553004132566967
Energy: 0.6215048254656789
Energy: 0.5808327249855815
Energy: 0.6209131196214969
Energy: 0.6047224257333992
Energy: 0.6209131196224636
Energy: 0.5519350790249287
Energy: 0.5528717513107345
Energy: 0.5262118117004944
Energy: 0.5528717513107345
Energy: 0.5527326499227214
Energy: 0.553930675195111
Energy: 0.5264483425221196
Energy: 0.5539306751980114
Energy: 0.5263088778914935
Energy: 0.5774940913479565
Energy: 0.5776739381991277
Energy: 0.5774940913489234

minimum gb energy = 0.5262118117004944 eV
minimum distance =  2.57042755718129 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.6361568395566211
Energy: 0.6032287362268294
Energy: 0.6036602425716464
Energy: 0.6032287362268294
Energy: 0.6034375533423865
Energy: 0.5919621523010223
Energy: 0.5616250800888636
Energy: 0.591962152302218
Energy: 0.6031147733676192
Energy: 0.6033103653899303
Energy: 0.5431555574474817
Energy: 0.6033103653899303
Energy: 0.6035589644220569
Energy: 0.5920426797222865
Energy: 0.5606252502302822
Energy: 0.5920426797210908
Energy: 0.5889118059156258
Energy: 0.6276844792419831
Energy: 0.5612469107978435
Energy: 0.6276844792419831
Energy: 0.5446695341605684
Energy: 0.5611716137431042
Energy: 0.5601837919128827
Energy: 0.5611716137419086
Energy: 0.6339392229603176
Energy: 0.5930113071905503
Energy: 0.5895673420843682
Energy: 0.5930113071905503
Energy: 0.5417934293411258
Energy: 0.6262615797836115
Energy: 0.5617146588648386
Energy: 0.6262615797836115
Energy: 0.6025745375693283
Energy: 0.6027796086517591
Energy: 0.541962978301005
Energy: 0.6027796086517591
Energy: 0.6035521872585691
Energy: 0.545388462089472
Energy: 0.5435969394699187
Energy: 0.5453884620906405
Energy: 0.5438839312667846
Energy: 0.6039693983138249
Energy: 0.6051795087316407
Energy: 0.6039693983150206
Energy: 0.6018896130590314
Energy: 0.5931119066558722
Energy: 0.6033235307684134
Energy: 0.5931119066546765
Energy: 0.5608817725381499
Energy: 0.6299104200387394
Energy: 0.5889832757412005
Energy: 0.6299104200387394
Energy: 0.5619761795402399
Energy: 0.5926645625186446
Energy: 0.5453095338692987
Energy: 0.5926645625186446
Energy: 0.5896270003995026
Energy: 0.5931619697380746
Energy: 0.5416370817367843
Energy: 0.5931619697380746
Energy: 0.5603037649418157
Energy: 0.6269931828252037
Energy: 0.5417662416949869
Energy: 0.6269931828252037
Energy: 0.6571273600139896
Energy: 0.6037006093534544
Energy: 0.6041113284275876
Energy: 0.6037006093546501

minimum gb energy = 0.5416370817367843 eV
minimum distance =  2.57279419955692 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 0.8663692235729838
Energy: 0.6562213687210842
Energy: 0.6571640003922213
Energy: 0.6562213687217613
Energy: 0.624943634000284
Energy: 0.5981298179726143
Energy: 0.6639530371592856
Energy: 0.5981298179726143
Energy: 0.5911163272435848
Energy: 0.5906349136594633
Energy: 0.6643018170570041
Energy: 0.5906349136587861
Energy: 0.5907681879503601
Energy: 0.59738801805923
Energy: 0.5957614860465743
Energy: 0.5973880180585529
Energy: 0.6643963024513955
Energy: 0.6446731860985762
Energy: 0.6138092044518804
Energy: 0.6446731860992534
Energy: 0.5972062165382186
Energy: 0.6572157010186046
Energy: 0.5896864079626086
Energy: 0.6572157010186046
Energy: 0.6170511968987531
Energy: 0.589701077528325
Energy: 0.5905980689344315
Energy: 0.589701077528325
Energy: 0.716037646089176
Energy: 0.5961165393198384
Energy: 0.5898644493479409
Energy: 0.5961165393211926
Energy: 0.6583605985101333
Energy: 0.6568386555901569
Energy: 0.6665116087454379
Energy: 0.6568386555901569
Energy: 0.6595040070100509
Energy: 0.6595661312747312
Energy: 0.6625017048154539
Energy: 0.659566131274054
Energy: 0.6636073066705124
Energy: 0.5889980140461883
Energy: 0.5729113295406943
Energy: 0.5889980140461883
Energy: 0.6685350527992284
Energy: 0.5871657255477295
Energy: 0.5864962816622229
Energy: 0.5871657255477295
Energy: 0.617552886721139
Energy: 0.5864394683314428
Energy: 0.5860989520361627
Energy: 0.5864394683307658
Energy: 0.6175592785949302
Energy: 0.5966347072295368
Energy: 0.5727675240521646
Energy: 0.5966347072275052
Energy: 0.6578460174646439
Energy: 0.6676973636034268
Energy: 0.7142446758312372
Energy: 0.6676973636034268
Energy: 0.6569944161683546
Energy: 0.6565922950349113
Energy: 0.7142254512752266
Energy: 0.6565922950355886
Energy: 0.6666406403773502
Energy: 0.5900464901111419
Energy: 0.5908625397086121
Energy: 0.5900464901104647
Energy: 0.6675715463343299
Energy: 0.5902220883432658
Energy: 0.5899063035276112
Energy: 0.5902220883432658
Energy: 0.5970493067135874
Energy: 0.6557605566003634
Energy: 0.6300280510757262
Energy: 0.655760556599009
Energy: 0.6107224210855181
Energy: 0.6455320339527413
Energy: 0.5904916580882076
Energy: 0.6455320339534183
Energy: 0.5898576598191142
Energy: 0.5960470104079371
Energy: 0.6759157264311153
Energy: 0.5960470104086141
Energy: 0.5901607044164067
Energy: 0.5903245221454815
Energy: 0.7159750105062727
Energy: 0.5903245221448042
Energy: 0.6414669490371838
Energy: 0.636158082929268
Energy: 0.6571279970170433
Energy: 0.636158082929268
Energy: 0.6662893824782568
Energy: 0.6560622068947924
Energy: 0.656391967144554
Energy: 0.656062206896824
Energy: 0.5759380843233571
Energy: 0.5962519291380686
Energy: 0.6688291272231784
Energy: 0.5962519291373914
Energy: 0.5864362439685774
Energy: 0.5871038284059359
Energy: 0.6287402532604826
Energy: 0.5871038284045816
Energy: 0.5722897630606385
Energy: 0.591154502332043
Energy: 0.6322144299027925
Energy: 0.5911545023306888
Energy: 0.5894540273006702
Energy: 0.5870501424669158
Energy: 0.6177804045950079
Energy: 0.5870501424669158
Energy: 0.5891943451247055
Energy: 0.5977771648276423
Energy: 0.6177131693222008
Energy: 0.5977771648283196
Energy: 0.7152205746815563
Energy: 0.6561420403051307
Energy: 0.6566161812457079
Energy: 0.6561420403037762

minimum gb energy = 0.5722897630606385 eV
minimum distance =  2.55175324159457 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.7842450888328935
Energy: 0.6158140790282832
Energy: 0.6166682663720096
Energy: 0.6158140790298422
Energy: 0.6168489704315023
Energy: 0.5745745312684762
Energy: 0.6151006687154313
Energy: 0.5745745312700351
Energy: 0.616316639666095
Energy: 0.6158960373693286
Energy: 0.6321141278468619
Energy: 0.6158960373693286
Energy: 0.6164135750480891
Energy: 0.5747824512238326
Energy: 0.6174785662633173
Energy: 0.5747824512222737
Energy: 0.6158742337323352
Energy: 0.5740976426823133
Energy: 0.5311493357903478
Energy: 0.5740976426823133
Energy: 0.6180831645415278
Energy: 0.5757956578012965
Energy: 0.5315075719189762
Energy: 0.5757956577981787
Energy: 0.6880469937048737
Energy: 0.615053654960867
Energy: 0.6145234802010545
Energy: 0.6150536549639848
Energy: 0.687749352870886
Energy: 0.6187284391756668
Energy: 0.6171584427784648
Energy: 0.6187284391772258
Energy: 0.6163368454105623
Energy: 0.6161516813097806
Energy: 0.6320828454516877
Energy: 0.6161516813097806
Energy: 0.6187762994587807
Energy: 0.5756128928213106
Energy: 0.6154292213573531
Energy: 0.5756128928228695
Energy: 0.6174548688574497
Energy: 0.5759411039375761
Energy: 0.5423796868655173
Energy: 0.5759411039375761
Energy: 0.6169324554789755
Energy: 0.5740234721211787
Energy: 0.533024534203748
Energy: 0.5740234721196197
Energy: 0.6878665191040083
Energy: 0.6172790778102276
Energy: 0.6176376158784699
Energy: 0.6172790778071097

minimum gb energy = 0.5311493357903478 eV
minimum distance =  2.58137599826657 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.767350666259065
Energy: 0.6908405008709353
Energy: 0.6901216686269276
Energy: 0.6908405008697813
Energy: 0.5958529754787637
Energy: 0.5848240506583069
Energy: 0.7002385565885058
Energy: 0.5848240506583069
Energy: 0.5899827957937005
Energy: 0.5862633349431242
Energy: 0.7153667469377633
Energy: 0.5862633349425473
Energy: 0.5872485684184005
Energy: 0.5861280711590284
Energy: 0.6983146810911678
Energy: 0.5861280711590284
Energy: 0.5864871383211652
Energy: 0.584767921084731
Energy: 0.7520819760391805
Energy: 0.584767921084154
Energy: 0.5855364506985654
Energy: 0.5848429260931303
Energy: 0.7490364935669055
Energy: 0.5848429260937074
Energy: 0.6894646023070974
Energy: 0.6892508587153672
Energy: 0.6955304813387501
Energy: 0.6892508587165211
Energy: 0.6882633568170105
Energy: 0.6929334672460258
Energy: 0.6900719204424253
Energy: 0.6929334672466027
Energy: 0.6191214559717151
Energy: 0.6576690768500977
Energy: 0.6230363230194914
Energy: 0.6576690768500977
Energy: 0.5803477194403643
Energy: 0.6251241117737
Energy: 0.6924382240208464
Energy: 0.6251241117737
Energy: 0.6180029242384197
Energy: 0.6179947113076681
Energy: 0.6477633112509253
Energy: 0.6179947113065142
Energy: 0.6185553952317854
Energy: 0.6292482736111397
Energy: 0.7311020167820003
Energy: 0.6292482736128706
Energy: 0.6884722824607313
Energy: 0.6181898568276298
Energy: 0.6242377386484018
Energy: 0.6181898568270529
Energy: 0.6884858560292078
Energy: 0.618503519618088
Energy: 0.6211147941510207
Energy: 0.618503519618665
Energy: 0.6901210436553529
Energy: 0.6258715536581373
Energy: 0.6193074189074516
Energy: 0.6258715536587144
Energy: 0.6648707111907398
Energy: 0.6616465690095811
Energy: 0.626596252171587
Energy: 0.6616465690095811
Energy: 0.6912852842216671
Energy: 0.5883466807369683
Energy: 0.6204009634126404
Energy: 0.5883466807363912
Energy: 0.6923219775273057
Energy: 0.69025517780855
Energy: 0.7667039246664588
Energy: 0.69025517780855
Energy: 0.7029761078517734
Energy: 0.5849416014191109
Energy: 0.5931912652137267
Energy: 0.5849416014185339
Energy: 0.7164417529836621
Energy: 0.586503049112606
Energy: 0.5861565149745079
Energy: 0.5865030491131829
Energy: 0.6983601083882027
Energy: 0.5859691567027824
Energy: 0.5858891645858707
Energy: 0.5859691567022054
Energy: 0.7494818377824445
Energy: 0.5845997183771531
Energy: 0.5850959050926706
Energy: 0.5845997183765761
Energy: 0.7513100626454512
Energy: 0.5851744300967588
Energy: 0.5862865370402911
Energy: 0.5851744300967588
Energy: 0.6973188724501708
Energy: 0.6889899771926069
Energy: 0.689480075983348
Energy: 0.6889899771920298
Energy: 0.6895474793878563
Energy: 0.6899111939053989
Energy: 0.6879055004928485
Energy: 0.6899111939059759
Energy: 0.6240557587942255
Energy: 0.6591685483858186
Energy: 0.6179021105159681
Energy: 0.6591685483858186
Energy: 0.6938889702365775
Energy: 0.6258525112166267
Energy: 0.5800467991107118
Energy: 0.6258525112166267
Energy: 0.6472418066522184
Energy: 0.6183331291146522
Energy: 0.6182792650466629
Energy: 0.6183331291152293
Energy: 0.7644048049145492
Energy: 0.6202299371232312
Energy: 0.619051849775943
Energy: 0.620229937123808
Energy: 0.6287738931348559
Energy: 0.6178778684562886
Energy: 0.6880931942295357
Energy: 0.6178778684580196
Energy: 0.6220018690844197
Energy: 0.6191162810697103
Energy: 0.7113868700586732
Energy: 0.6191162810679792
Energy: 0.6226014507685362
Energy: 0.6359587741465444
Energy: 0.6987320297109394
Energy: 0.6359587741476984
Energy: 0.6259570765690646
Energy: 0.6603141125745221
Energy: 0.66492782357552
Energy: 0.6603141125756761
Energy: 0.6192914393884086
Energy: 0.588441126527957
Energy: 0.6485666644463581
Energy: 0.588441126527957
Energy: 0.7647025741737284
Energy: 0.6899087310624634
Energy: 0.6914191344713666
Energy: 0.6899087310624634

minimum gb energy = 0.5800467991107118 eV
minimum distance =  2.55145958655983 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 0.8086190763683494
Energy: 0.670368929254191
Energy: 0.6698546054137996
Energy: 0.6703689292551065
Energy: 0.5995835806264475
Energy: 0.5972862383102798
Energy: 0.660319868106506
Energy: 0.5972862383111953
Energy: 0.5968256974823749
Energy: 0.5976124319537593
Energy: 0.691258117137755
Energy: 0.5976124319519284
Energy: 0.5971169559530857
Energy: 0.5980375323681703
Energy: 0.727437521112046
Energy: 0.5980375323663394
Energy: 0.599434356845627
Energy: 0.5987157820890161
Energy: 0.6971277781337247
Energy: 0.5987157820881005
Energy: 0.6323915248294852
Energy: 0.5980584432892632
Energy: 0.6951658178320432
Energy: 0.5980584432892632
Energy: 0.6278386483952557
Energy: 0.6795657051620305
Energy: 0.6899100148845769
Energy: 0.6795657051620305
Energy: 0.6293382908180781
Energy: 0.6811294387799497
Energy: 0.6782080938320707
Energy: 0.6811294387790342
Energy: 0.6212936755576258
Energy: 0.6687970000735783
Energy: 0.692848087000779
Energy: 0.6687970000717476
Energy: 0.6173486451742944
Energy: 0.6583141042129937
Energy: 0.6799158113606697
Energy: 0.6583141042139092
Energy: 0.6216701091195823
Energy: 0.5909120325029044
Energy: 0.5851253489340966
Energy: 0.590912032501989
Energy: 0.6213293497123246
Energy: 0.6028156399689286
Energy: 0.7251331616827682
Energy: 0.6028156399670975
Energy: 0.6877422195936908
Energy: 0.5915386641030034
Energy: 0.6113915332654806
Energy: 0.5915386641030034
Energy: 0.6897923352471574
Energy: 0.6248812315116777
Energy: 0.6215807853052
Energy: 0.6248812315107624
Energy: 0.6898717302105958
Energy: 0.6113780656314179
Energy: 0.6114906127031076
Energy: 0.6113780656314179
Energy: 0.6982915867014077
Energy: 0.6116941677203387
Energy: 0.611418589706319
Energy: 0.6116941677212541
Energy: 0.695953000741045
Energy: 0.6116692558646475
Energy: 0.6244777083148084
Energy: 0.6116692558664784
Energy: 0.6728006837355971
Energy: 0.6727843207185292
Energy: 0.6283784982111503
Energy: 0.6727843207185292
Energy: 0.667005304089584
Energy: 0.6442230611610656
Energy: 0.6276339736615443
Energy: 0.6442230611601503
Energy: 0.6653092557091891
Energy: 0.6398216549268451
Energy: 0.6674688610604645
Energy: 0.6398216549268451
Energy: 0.6664610722467456
Energy: 0.6394493216465658
Energy: 0.6188891204604369
Energy: 0.6394493216447348
Energy: 0.687641805702995
Energy: 0.664424167589032
Energy: 0.6647994699910009
Energy: 0.664424167589032

minimum gb energy = 0.5851253489340966 eV
minimum distance =  2.54952691540982 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 0.9303156305693923
Energy: 0.6739619323382625
Energy: 0.6750140208130789
Energy: 0.6739619323389098
Energy: 0.6049669627917765
Energy: 0.5957631075227879
Energy: 0.6579975176892255
Energy: 0.5957631075247298
Energy: 0.6006039115231272
Energy: 0.5954421257122251
Energy: 0.6482268117605448
Energy: 0.595442125714167
Energy: 0.5946222417770116
Energy: 0.5958022049931999
Energy: 0.6581441938743308
Energy: 0.5958022049964365
Energy: 0.6063360352855961
Energy: 0.6055023106783616
Energy: 0.6998834423159656
Energy: 0.6055023106764197
Energy: 0.5962354847619242
Energy: 0.6054976596703234
Energy: 0.7002340295188978
Energy: 0.6054976596632029
Energy: 0.6541817963854268
Energy: 0.6053490299690824
Energy: 0.5971889586155227
Energy: 0.605349029966493
Energy: 0.6544768363089587
Energy: 0.6061670049667747
Energy: 0.6054952702158688
Energy: 0.6061670049667747
Energy: 0.6573394174734435
Energy: 0.5943218742445813
Energy: 0.5941516627260379
Energy: 0.5943218742478178
Energy: 0.7015710468008467
Energy: 0.5966853697562635
Energy: 0.6036052577216551
Energy: 0.5966853697562635
Energy: 0.6586138190896671
Energy: 0.6629093629325931
Energy: 0.593583309907989
Energy: 0.6629093629319459
Energy: 0.6703812105121919
Energy: 0.6660575315999597
Energy: 0.6534041232372558
Energy: 0.6660575315980473
Energy: 0.6593938055088305
Energy: 0.634489376394231
Energy: 0.6684284746806959
Energy: 0.634489376394231
Energy: 0.6515984856630269
Energy: 0.6306947959470057
Energy: 0.5998543827718219
Energy: 0.630694795945711
Energy: 0.66892854464644
Energy: 0.633201753865046
Energy: 0.609082715157579
Energy: 0.6332017538676351
Energy: 0.5972094186774545
Energy: 0.6672314004753844
Energy: 0.6702538160095233
Energy: 0.6672314004818577
Energy: 0.5959275653311147
Energy: 0.6625097732617393
Energy: 0.6579803452727739
Energy: 0.6625097732604741
Energy: 0.6049730800427012
Energy: 0.5963244493987032
Energy: 0.6481121713775035
Energy: 0.5963244494012925
Energy: 0.5946761075916369
Energy: 0.5947954191811354
Energy: 0.6591420424719481
Energy: 0.5947954191876087
Energy: 0.6054418935256519
Energy: 0.6056961449056175
Energy: 0.5997270334960887
Energy: 0.6056961449069121
Energy: 0.597873287247718
Energy: 0.6048134505282504
Energy: 0.6994341581944435
Energy: 0.6048134505250138
Energy: 0.6543791357638559
Energy: 0.6057962267176342
Energy: 0.5953989761460946
Energy: 0.6057962267189289
Energy: 0.6541759898085733
Energy: 0.6062871527264365
Energy: 0.6064749129433423
Energy: 0.6062871527251419
Energy: 0.7199629796997599
Energy: 0.5955329831443613
Energy: 0.5944733642492779
Energy: 0.5955329831443613
Energy: 0.7012287198084268
Energy: 0.5963573379401198
Energy: 0.5978688521525827
Energy: 0.5963573379407673
Energy: 0.7090649442004229
Energy: 0.5953105148393414
Energy: 0.6048671861961277
Energy: 0.5953105148373995
Energy: 0.6748271641153204
Energy: 0.6736277929223552
Energy: 0.8142871508692899
Energy: 0.6736277929204132
Energy: 0.6651716714000001
Energy: 0.6387239047726346
Energy: 0.6063335820582778
Energy: 0.6387239047700454
Energy: 0.649643468424432
Energy: 0.6316364246061007
Energy: 0.6576577782241667
Energy: 0.6316364246002748
Energy: 0.6671634750626189
Energy: 0.6330713481107464
Energy: 0.5995836781736387
Energy: 0.6330713481107464
Energy: 0.596042619396519
Energy: 0.666564744901905
Energy: 0.6681315982342307
Energy: 0.6665647449031995

minimum gb energy = 0.593583309907989 eV
minimum distance =  2.55109994483071 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.543392299180929
Energy: 0.6517185953056812
Energy: 0.559423158546807
Energy: 0.6517185953063326
Energy: 0.5625320063302158
Energy: 0.6099972996097294
Energy: 0.5613484364782009
Energy: 0.6099972996095039
Energy: 0.5579643255593412
Energy: 0.5930825351998082
Energy: 0.5476709454668255
Energy: 0.5930825351995826
Energy: 0.546898411025161
Energy: 0.5570334088866364
Energy: 0.5612010157674561
Energy: 0.5570334088870874
Energy: 0.5563500653962016
Energy: 0.559372955892682
Energy: 0.5462859293149157
Energy: 0.5593729558924564
Energy: 0.5649420104988633
Energy: 0.5958653573078674
Energy: 0.5463901674603941
Energy: 0.595865357307642
Energy: 0.5477478530709836
Energy: 0.5916717293148634
Energy: 0.5588439010842963
Energy: 0.5916717293144375
Energy: 0.5641350215888853
Energy: 0.5602757938099836
Energy: 0.563859442963518
Energy: 0.5602757938095326
Energy: 0.5464248180079159
Energy: 0.5582717905729638
Energy: 0.5624844650003328
Energy: 0.5582717905731643

minimum gb energy = 0.543392299180929 eV
minimum distance =  2.58027317294982 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.7331911609740682
Energy: 0.6355675287611526
Energy: 0.6365659435131581
Energy: 0.6355675287605411
Energy: 0.6600177368712354
Energy: 0.5527401588088052
Energy: 0.6436139583902399
Energy: 0.5527401588094166
Energy: 0.6433373981394744
Energy: 0.5987104264914823
Energy: 0.6431768539859883
Energy: 0.5987104264902593
Energy: 0.5636762847814724
Energy: 0.5510731791087936
Energy: 0.6578316390113139
Energy: 0.5510731791100165
Energy: 0.6572425498499107
Energy: 0.5723624538263382
Energy: 0.6429017250108207
Energy: 0.5723624538251153
Energy: 0.5719557273389384
Energy: 0.5598792799433349
Energy: 0.6433343047973279
Energy: 0.5598792799439463
Energy: 0.5510939047120355
Energy: 0.5508947232946423
Energy: 0.6575630654132671
Energy: 0.5508947232952538
Energy: 0.5575491792146142
Energy: 0.553219777524257
Energy: 0.7250922963394344
Energy: 0.553219777524257
Energy: 0.6445486868877819
Energy: 0.576519469308883
Energy: 0.713104271917473
Energy: 0.5765194693082716
Energy: 0.6471846158780724
Energy: 0.5404426351700281
Energy: 0.5436982697476329
Energy: 0.540442635171251
Energy: 0.6327529383534239
Energy: 0.5395768741300648
Energy: 0.540440828521106
Energy: 0.5395768741288419
Energy: 0.718430920023014
Energy: 0.5419628420712386
Energy: 0.5388255390366172
Energy: 0.5419628420712386
Energy: 0.7223431926498871
Energy: 0.539129005979839
Energy: 0.5406444234063696
Energy: 0.539129005981062
Energy: 0.6073529410083868
Energy: 0.5708510691314959
Energy: 0.6446184749962185
Energy: 0.5708510691314959
Energy: 0.5527359994107566
Energy: 0.551400699097779
Energy: 0.6444364460950825
Energy: 0.5514006990971675
Energy: 0.554551126066417
Energy: 0.5528245305815307
Energy: 0.6846792204203974
Energy: 0.5528245305803078
Energy: 0.5511311022060837
Energy: 0.5510604475654178
Energy: 0.5619210386510256
Energy: 0.5510604475635834
Energy: 0.6623156678888061
Energy: 0.5526533191068688
Energy: 0.5399668825590255
Energy: 0.5526533191062574
Energy: 0.6448475883893438
Energy: 0.5997531899600673
Energy: 0.644533323452139
Energy: 0.5997531899600673
Energy: 0.6584329375340262
Energy: 0.6010240931895359
Energy: 0.5620562760412542
Energy: 0.6010240931889244
Energy: 0.6435749506866134
Energy: 0.5562965754652828
Energy: 0.6583160246542836
Energy: 0.5562965754658943
Energy: 0.6427224003167218
Energy: 0.5726784938953453
Energy: 0.5727708656974861
Energy: 0.5726784938959568
Energy: 0.6582929733493988
Energy: 0.5511978917850824
Energy: 0.5521422799129115
Energy: 0.5511978917838595
Energy: 0.7220747308652999
Energy: 0.5531119142833799
Energy: 0.5553215886495898
Energy: 0.553111914282157
Energy: 0.7209293266103801
Energy: 0.5748477478781061
Energy: 0.6325453442369843
Energy: 0.5748477478768832
Energy: 0.5403235015249899
Energy: 0.5408128755168456
Energy: 0.6471408153605184
Energy: 0.5408128755174572
Energy: 0.5409920839484159
Energy: 0.5403777038216022
Energy: 0.5764146092100816
Energy: 0.5403777038222137
Energy: 0.5389687346240284
Energy: 0.5399063213296761
Energy: 0.5624859943148728
Energy: 0.5399063213302876
Energy: 0.554556696166788
Energy: 0.5398132112036315
Energy: 0.7235275469034208
Energy: 0.5398132112011855
Energy: 0.643827055430784
Energy: 0.5707201022663704
Energy: 0.6078647920157665
Energy: 0.5707201022657589
Energy: 0.6443736244733387
Energy: 0.5518358848878926
Energy: 0.5528538938043347
Energy: 0.5518358848872812
Energy: 0.6595029719160909
Energy: 0.5522160731437494
Energy: 0.5522745515037322
Energy: 0.552216073144361
Energy: 0.5631913219167451
Energy: 0.5509782267142868
Energy: 0.5753147761243751
Energy: 0.5509782267142868

minimum gb energy = 0.5388255390366172 eV
minimum distance =  2.5462222100583 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 0.7743182164843275
Energy: 0.5267844568363428
Energy: 0.6204585319263882
Energy: 0.5267844568211437
Energy: 0.5264548829673825
Energy: 0.5260240681291694
Energy: 0.63160309742214
Energy: 0.5260240681300149
Energy: 0.6310705880385113
Energy: 0.585474915320795
Energy: 0.6464914349567799
Energy: 0.5854749153191042
Energy: 0.5373544021349537
Energy: 0.5859479172247409
Energy: 0.5430420270949797
Energy: 0.5859479172230498
Energy: 0.5630644406032455
Energy: 0.5462439893687567
Energy: 0.6429635794392465
Energy: 0.5462439893704478
Energy: 0.5469564769658986
Energy: 0.532689114556882
Energy: 0.6436256903666336
Energy: 0.532689114556882
Energy: 0.5231846042523673
Energy: 0.5242408820334169
Energy: 0.54058730879748
Energy: 0.5242408820308806
Energy: 0.525726935019682
Energy: 0.5269062664353805
Energy: 0.7401989530266011
Energy: 0.5269062664336895
Energy: 0.6445165048000204
Energy: 0.5599069311691244
Energy: 0.7423749522398189
Energy: 0.5599069311691244
Energy: 0.6545565308506632
Energy: 0.5282680200257224
Energy: 0.5271547848705618
Energy: 0.528268020024877
Energy: 0.6455559906017596
Energy: 0.5240421806555666
Energy: 0.523488456040825
Energy: 0.5240421806572575
Energy: 0.7428603854981747
Energy: 0.529976815219451
Energy: 0.5252333543787514
Energy: 0.529976815221142
Energy: 0.7389585600481248
Energy: 0.5244607454865067
Energy: 0.5358234916810177
Energy: 0.5244607454865067
Energy: 0.647960082834541
Energy: 0.5851327335566192
Energy: 0.6456854446645197
Energy: 0.5851327335549281
Energy: 0.5386493556350271
Energy: 0.5845491565711886
Energy: 0.6457982698207899
Energy: 0.5845491565711886
Energy: 0.5357466627750024
Energy: 0.5252046640560177
Energy: 0.5247035556729291
Energy: 0.5252046640568633
Energy: 0.5632330231726176
Energy: 0.5614602160050407
Energy: 0.6429179271870742
Energy: 0.5614602160016589
Energy: 0.5303188996880702
Energy: 0.5269345922489613
Energy: 0.6588753068782971
Energy: 0.5269345922489613
Energy: 0.5237935115314574
Energy: 0.5247610787821398
Energy: 0.7421518636063105
Energy: 0.5247610787838309
Energy: 0.5266902282116768
Energy: 0.5395327929240086
Energy: 0.740996384146101
Energy: 0.5395327929248541
Energy: 0.642893301637492
Energy: 0.5633855765126377
Energy: 0.5525854332565195
Energy: 0.5633855765151741
Energy: 0.643027156062923
Energy: 0.525418311089972
Energy: 0.526339155791511
Energy: 0.5254183110916629
Energy: 0.529592077923689
Energy: 0.5239984986296854
Energy: 0.5248632268234183
Energy: 0.5239984986305308
Energy: 0.7387056659876404
Energy: 0.524662302859742
Energy: 0.5244189878976233
Energy: 0.5246623028605877

minimum gb energy = 0.5231846042523673 eV
minimum distance =  2.55416908740363 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.8260493588232247
Energy: 0.6227384276444923
Energy: 0.6257397822938529
Energy: 0.6227384276471051
Energy: 0.5293783018751756
Energy: 0.522487362575811
Energy: 0.6023933712905936
Energy: 0.522487362576856
Energy: 0.6684825013178405
Energy: 0.5226700904480757
Energy: 0.6005300858572439
Energy: 0.5226700904459853
Energy: 0.6694681237526664
Energy: 0.5520048754268655
Energy: 0.6039680016778753
Energy: 0.5520048754237302
Energy: 0.5846914695934772
Energy: 0.5118392589802468
Energy: 0.7214126802801086
Energy: 0.511839258977634
Energy: 0.5122095799714602
Energy: 0.5202345227885427
Energy: 0.7185994540018659
Energy: 0.5202345227890653
Energy: 0.512587762981498
Energy: 0.5116432464381734
Energy: 0.5544609412293005
Energy: 0.5116432464392185
Energy: 0.517423393387302
Energy: 0.5134891642075101
Energy: 0.5098810113630299
Energy: 0.5134891642122132
Energy: 0.5839735333674769
Energy: 0.5139557753048051
Energy: 0.6588656817178494
Energy: 0.5139557753042825
Energy: 0.5992533638245008
Energy: 0.5537627703657939
Energy: 0.612810741123199
Energy: 0.5537627703642262
Energy: 0.5867641321729353
Energy: 0.5205487600334082
Energy: 0.5270609135755563
Energy: 0.5205487600339307
Energy: 0.7155628356535062
Energy: 0.5226293671902256
Energy: 0.5990626543567018
Energy: 0.5226293671902256
Energy: 0.7223579177165931
Energy: 0.5384336202790593
Energy: 0.5416405964409393
Energy: 0.5384336202785367
Energy: 0.5239251288383157
Energy: 0.5203046346441923
Energy: 0.521890408660778
Energy: 0.5203046346441923
Energy: 0.6666788193288999
Energy: 0.5221930594891098
Energy: 0.5271471010613523
Energy: 0.5221930594891098
Energy: 0.7730663269848529
Energy: 0.5213940170058616
Energy: 0.5216967260108709
Energy: 0.5213940170048166
Energy: 0.528900053599687
Energy: 0.5237258285828997
Energy: 0.727847372892667
Energy: 0.5237258285818547
Energy: 0.5238294237375652
Energy: 0.5207276385388857
Energy: 0.7036216051186287
Energy: 0.5207276385394082
Energy: 0.544795044745729
Energy: 0.5215327030220733
Energy: 0.6637989148924633
Energy: 0.5215327030231185
Energy: 0.547882638646008
Energy: 0.5844917637856325
Energy: 0.5208903324071861
Energy: 0.5844917637845873
Energy: 0.602908340794067
Energy: 0.521836007252261
Energy: 0.5232974419380889
Energy: 0.5218360072517383
Energy: 0.6011939948612528
Energy: 0.6231857412504668
Energy: 0.6672868845549875
Energy: 0.623185741252557
Energy: 0.6068110025084055
Energy: 0.5507471420919907
Energy: 0.6678754857563041
Energy: 0.5507471420930359
Energy: 0.72309165601695
Energy: 0.5128843866247417
Energy: 0.5830575718877201
Energy: 0.5128843866247417
Energy: 0.716181608546855
Energy: 0.5146274786419889
Energy: 0.5212009137906287
Energy: 0.5146274786404212
Energy: 0.6134787305086956
Energy: 0.5123304016026252
Energy: 0.5146700653828665
Energy: 0.5123304016036703
Energy: 0.5233677250236946
Energy: 0.5142205175396233
Energy: 0.5197159689084196
Energy: 0.5142205175385781
Energy: 0.6653202838828208
Energy: 0.5131402631453297
Energy: 0.7154763316268434
Energy: 0.5131402631442845
Energy: 0.599013453313065
Energy: 0.5529335308469043
Energy: 0.5993729532721014
Energy: 0.5529335308479495
Energy: 0.5280102632207114
Energy: 0.5201290374550863
Energy: 0.5857968367198221
Energy: 0.5201290374524734
Energy: 0.6004535593727155
Energy: 0.5268110674758101
Energy: 0.7182592972403515
Energy: 0.5268110674758101
Energy: 0.5390757310604545
Energy: 0.5374253389037412
Energy: 0.7193623856822211
Energy: 0.5374253389073992
Energy: 0.5203336040765285
Energy: 0.5198428834834928
Energy: 0.5253137115835449
Energy: 0.5198428834829703
Energy: 0.5261289655671434
Energy: 0.5230054936122492
Energy: 0.6682456363597892
Energy: 0.5230054936112041
Energy: 0.5275615776189483
Energy: 0.5424483496007686
Energy: 0.7720938392331796
Energy: 0.542448349599201
Energy: 0.7486960736292223
Energy: 0.5231720408392381
Energy: 0.5278187026971173
Energy: 0.5231720408381929
Energy: 0.6734839720276555
Energy: 0.5204053945160158
Energy: 0.5207448320579473
Energy: 0.5204053945181061
Energy: 0.6578752246064276
Energy: 0.5225478619807015
Energy: 0.5454351156542172
Energy: 0.5225478619817465

minimum gb energy = 0.5098810113630299 eV
minimum distance =  2.5394841722433 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.8633333049823115
Energy: 0.4727360935921156
Energy: 0.47454245958469754
Energy: 0.47273609359074836
Energy: 0.5126091719126317
Energy: 0.5227232817874478
Energy: 0.47396148059071275
Energy: 0.5227232817860805
Energy: 0.4672784665439481
Energy: 0.5232030429435335
Energy: 0.4862936872727096
Energy: 0.5232030429435335
Energy: 0.46857707699924905
Energy: 0.5237268992183749
Energy: 0.48477748014786387
Energy: 0.5237268992183749
Energy: 0.47207525646272
Energy: 0.47152444691215206
Energy: 0.5074811370334975
Energy: 0.4715244469135193
Energy: 0.4712347369855751
Energy: 0.47579330069516224
Energy: 0.5078968164225791
Energy: 0.47579330069516224
Energy: 0.47122163114932863
Energy: 0.47063124365034015
Energy: 0.5107548918186449
Energy: 0.4706312436489729
Energy: 0.47287373351711
Energy: 0.4738713793741847
Energy: 0.46716284797625157
Energy: 0.4738713793741847
Energy: 0.4721150909776545
Energy: 0.47305041432002626
Energy: 0.46724250707171455
Energy: 0.47305041432002626
Energy: 0.5118091502658075
Energy: 0.5243574948076074
Energy: 0.4865808712815276
Energy: 0.5243574948076074
Energy: 0.4847131147170931
Energy: 0.5251245478982891
Energy: 0.4662696023594763
Energy: 0.5251245478982891
Energy: 0.5080136671433699
Energy: 0.4744608743660235
Energy: 0.4862112047525677
Energy: 0.4744608743660235
Energy: 0.5078100909069825
Energy: 0.47269876840744385
Energy: 0.47305026793706306
Energy: 0.47269876840607655
Energy: 0.5103232230822824
Energy: 0.47037694299026045
Energy: 0.47053568214658337
Energy: 0.4703769429888932
Energy: 0.46726461274121267
Energy: 0.47229034837351375
Energy: 0.47287783875749734
Energy: 0.47229034837351375

minimum gb energy = 0.4662696023594763 eV
minimum distance =  2.57104289146826 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.7687263393870738
Energy: 0.46624946699721576
Energy: 0.5872342956908506
Energy: 0.4662494671300928
Energy: 0.6679322736573022
Energy: 0.4544690601605229
Energy: 0.5347948270131802
Energy: 0.4544690601622422
Energy: 0.7259863971828612
Energy: 0.45347048828758024
Energy: 0.5329637227084685
Energy: 0.45347048828528796
Energy: 0.6038148557341013
Energy: 0.4554714227437065
Energy: 0.5421540277715484
Energy: 0.45547142267381646
Energy: 0.6194525238523874
Energy: 0.45416115233911625
Energy: 0.6686520908282435
Energy: 0.45416115233338544
Energy: 0.5336940862753083
Energy: 0.4541572414059539
Energy: 0.6695249223529157
Energy: 0.4541572414025154
Energy: 0.5350817454196859
Energy: 0.45356900563951397
Energy: 0.6328560077873115
Energy: 0.45356900564180624
Energy: 0.5422197629008014
Energy: 0.4550452489850786
Energy: 0.664237251287235
Energy: 0.4550452489867979
Energy: 0.46502204226477856
Energy: 0.4544850603457934
Energy: 0.6595468029111254
Energy: 0.45448506034295405
Energy: 0.45553513152175806
Energy: 0.45357517126006713
Energy: 0.6573526050549965
Energy: 0.4535751712549093
Energy: 0.45326506197100763
Energy: 0.45686441276333845
Energy: 0.7687236079013966
Energy: 0.4568644127621923
Energy: 0.669710594308804
Energy: 0.45349631936061763
Energy: 0.6588021687673121
Energy: 0.4534963193594715
Energy: 0.668882678558601
Energy: 0.48227077980982286
Energy: 0.6678430010082433
Energy: 0.48227077981211514
Energy: 0.6708227548596474
Energy: 0.48395206967023213
Energy: 0.6051283910887559
Energy: 0.4839520696708053
Energy: 0.6619719489955974
Energy: 0.4554435026016661
Energy: 0.6170143502271318
Energy: 0.4554435025999469
Energy: 0.6600571078853303
Energy: 0.4543206138580223
Energy: 0.45639310065150085
Energy: 0.45432061385744926
Energy: 0.6702071058142033
Energy: 0.4536182255639309
Energy: 0.4560098591396383
Energy: 0.4536182255650772
Energy: 0.7335187676356162
Energy: 0.4542989742510179
Energy: 0.4581899663836547
Energy: 0.4542989742578949
Energy: 0.589576760907155
Energy: 0.4543424686272962
Energy: 0.546186183214779
Energy: 0.45434246862901545
Energy: 0.6590410854018729
Energy: 0.4527258706189817
Energy: 0.530623865422288
Energy: 0.45272587062070097
Energy: 0.6028353141954889
Energy: 0.45627927056143586
Energy: 0.5493869570261048
Energy: 0.4562792705631552
Energy: 0.6584693443014814
Energy: 0.4890375836807054
Energy: 0.6694921524552111
Energy: 0.4890375836824246
Energy: 0.5368288419332682
Energy: 0.455123684584494
Energy: 0.668944827567341
Energy: 0.45512368458506713
Energy: 0.45592268606132225
Energy: 0.45287208558314623
Energy: 0.6336898348572483
Energy: 0.45287208558314623
Energy: 0.5357945747105534
Energy: 0.4649139531863417
Energy: 0.6615482319993756
Energy: 0.46491395318290324
Energy: 0.4678736805568616
Energy: 0.4564638833998748
Energy: 0.659634534314962
Energy: 0.4564638833952902
Energy: 0.453215902281199
Energy: 0.4526594975131947
Energy: 0.6731573148257352
Energy: 0.4526594975126216
Energy: 0.46248970513497883
Energy: 0.4552941808045378
Energy: 0.7200703224922554
Energy: 0.4552941808028186
Energy: 0.656988566368077
Energy: 0.4540728079960237
Energy: 0.5929205397312978
Energy: 0.45407280799774297
Energy: 0.5295072245213722
Energy: 0.48424538469146383
Energy: 0.6686398779980494
Energy: 0.4842453846960486
Energy: 0.6698834325238708
Energy: 0.48695090449625916
Energy: 0.6033306700971585
Energy: 0.48695090449855155
Energy: 0.6603731264772373
Energy: 0.45448444375980407
Energy: 0.6174073724968245
Energy: 0.45448444376152336
Energy: 0.662398555055691
Energy: 0.45450000765792314
Energy: 0.45893828202961867
Energy: 0.45450000765964244
Energy: 0.6354594676493259
Energy: 0.45272737884992775
Energy: 0.453289114580816
Energy: 0.4527273788539393
Energy: 0.5919428856543607
Energy: 0.45430511672530943
Energy: 0.45639568257104396
Energy: 0.4543051167247364

minimum gb energy = 0.4526594975126216 eV
minimum distance =  2.56595700577026 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.7466945894788547
Energy: 0.43272202959671147
Energy: 0.434761182356886
Energy: 0.43272202959276757
Energy: 0.6686460589831945
Energy: 0.42637579868591774
Energy: 0.5497910868725854
Energy: 0.42637579868690373
Energy: 0.6979061736854542
Energy: 0.4255637325460533
Energy: 0.5511977469105878
Energy: 0.4255637325490112
Energy: 0.6962669491297033
Energy: 0.5312747850819298
Energy: 0.5499285011727154
Energy: 0.5312747850829158
Energy: 0.648784099514358
Energy: 0.4191996673579296
Energy: 0.6013050921413684
Energy: 0.41919966736088743
Energy: 0.47831606503929897
Energy: 0.41917938415938033
Energy: 0.6104125870249514
Energy: 0.4191793841574084
Energy: 0.47950738880143606
Energy: 0.41884535812332757
Energy: 0.6499352858701825
Energy: 0.4188453581252995
Energy: 0.5269200749297889
Energy: 0.41211676861619573
Energy: 0.6964665731154169
Energy: 0.4121167686171817
Energy: 0.47984860959473485
Energy: 0.4208240979244016
Energy: 0.6976239235858717
Energy: 0.4208240979244016
Energy: 0.47430176728885237
Energy: 0.4107169706635762
Energy: 0.6494749677424497
Energy: 0.4107169706635762
Energy: 0.513822471137633
Energy: 0.5141303953344336
Energy: 0.6688435724702593
Energy: 0.5141303953334476
Energy: 0.5971104053674267
Energy: 0.4106397589116971
Energy: 0.6493472008086665
Energy: 0.41063975891071114
Energy: 0.5985906437511203
Energy: 0.41896175042951717
Energy: 0.6975788438827503
Energy: 0.41896175042951717
Energy: 0.6484824101430609
Energy: 0.46524307788135777
Energy: 0.6962407342549672
Energy: 0.46524307788135777
Energy: 0.6013050921413684
Energy: 0.4738246159082647
Energy: 0.6497860490452527
Energy: 0.47382461590727876
Energy: 0.6104125870229793
Energy: 0.4733857921975824
Energy: 0.47805565629120506
Energy: 0.4733857921995544
Energy: 0.6493932252574391
Energy: 0.5458842404334564
Energy: 0.47951594737979236
Energy: 0.5458842404344423
Energy: 0.6964665731144309
Energy: 0.4824060590354165
Energy: 0.41967849616541086
Energy: 0.4824060590324586
Energy: 0.6976239235868577
Energy: 0.42767395877027675
Energy: 0.4262425335518827
Energy: 0.42767395876832714
Energy: 0.6080368675664124
Energy: 0.42644353402757507
Energy: 0.42619668913198444
Energy: 0.42644353402658913

minimum gb energy = 0.41063975891071114 eV
minimum distance =  2.55275634257839 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.791474715980974
Energy: 0.3725548867521134
Energy: 0.37711608186876955
Energy: 0.37255488676135234
Energy: 0.719090225173836
Energy: 0.3733903351692955
Energy: 0.47415866336810253
Energy: 0.37339033516852554
Energy: 0.7143668234460404
Energy: 0.372926285388013
Energy: 0.4720690575932405
Energy: 0.37292628538878286
Energy: 0.5640741125642813
Energy: 0.37541953185075305
Energy: 0.5738260673489838
Energy: 0.37541953184998317
Energy: 0.7160488806684494
Energy: 0.4160252259954742
Energy: 0.6461770390341957
Energy: 0.4160252259947043
Energy: 0.570621852687341
Energy: 0.4150936433158043
Energy: 0.6431991442848127
Energy: 0.41509364331657417
Energy: 0.5677816739485743
Energy: 0.41636261196724367
Energy: 0.7161970702009337
Energy: 0.41636261196724367
Energy: 0.5740802548405612
Energy: 0.3754910063279771
Energy: 0.6429454779787518
Energy: 0.37549100632874705
Energy: 0.47330481255007173
Energy: 0.37272776862342905
Energy: 0.7206534185011152
Energy: 0.37272776862342905
Energy: 0.47436407777268896
Energy: 0.37336333325741317
Energy: 0.7176944338573551
Energy: 0.37336333325818305
Energy: 0.3736157379630576
Energy: 0.37267407658803164
Energy: 0.6772876117642593
Energy: 0.37267407658803164
Energy: 0.37580322907082264
Energy: 0.3732009555630346
Energy: 0.7174797812968039
Energy: 0.37320095556226474
Energy: 0.37476916293529994
Energy: 0.3743609526800954
Energy: 0.7121064686518528
Energy: 0.3743609526800954
Energy: 0.4702357318741908
Energy: 0.3767275334132664
Energy: 0.7103250334510035
Energy: 0.37672753341249654
Energy: 0.4712040898347799
Energy: 0.3728326561348027
Energy: 0.7159765285461958
Energy: 0.3728326561348027
Energy: 0.47516023577903854
Energy: 0.37361259233262417
Energy: 0.7160742946150104
Energy: 0.37361259233185423
Energy: 0.6421169282788195
Energy: 0.37411320523505637
Energy: 0.7121783880108005
Energy: 0.3741132052342865
Energy: 0.46883009536324943
Energy: 0.4180876964711309
Energy: 0.6443481869616314
Energy: 0.4180876964695911
Energy: 0.6410487402478738
Energy: 0.4157922391010666
Energy: 0.5683225876346918
Energy: 0.41579223910029667
Energy: 0.717578096181604
Energy: 0.4157141239633479
Energy: 0.5700113139778548
Energy: 0.4157141239648877
Energy: 0.6780182278027803
Energy: 0.3765650488901761
Energy: 0.47339560181693163
Energy: 0.3765650488901761
Energy: 0.7185225987780944
Energy: 0.37250695717885923
Energy: 0.37333477033599016
Energy: 0.37250695717885923
Energy: 0.7164913696199194
Energy: 0.3743620313884298
Energy: 0.4755132756787847
Energy: 0.3743620313876599
Energy: 0.6435926162987116
Energy: 0.3749470248735216
Energy: 0.3732554314820495
Energy: 0.37494702487506143
Energy: 0.7158365224465216
Energy: 0.3730220909007929
Energy: 0.37316961981099256
Energy: 0.3730220909007929
Energy: 0.7147435940811533
Energy: 0.37634813686410434
Energy: 0.37654006950393093
Energy: 0.37634813686410434

minimum gb energy = 0.37250695717885923 eV
minimum distance =  2.57293644963827 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.8693695614271443
Energy: 0.3423825271393576
Energy: 0.34581994291007545
Energy: 0.3423825271412512
Energy: 0.7564278373659168
Energy: 0.34354260006320464
Energy: 0.42464533173473107
Energy: 0.34354260006320464
Energy: 0.7541827176251567
Energy: 0.34275591715823533
Energy: 0.42503656110923504
Energy: 0.3427559171576041
Energy: 0.6400272602489668
Energy: 0.34541447526808666
Energy: 0.5737953899694216
Energy: 0.34541447526745545
Energy: 0.7538672772709711
Energy: 0.34160894996048907
Energy: 0.5708568654965561
Energy: 0.3416089499592267
Energy: 0.6327164602085891
Energy: 0.4667538945637056
Energy: 0.5722622499619757
Energy: 0.46675389456433675
Energy: 0.6369669368909436
Energy: 0.37876729331394754
Energy: 0.6926844963726484
Energy: 0.3787672933145788
Energy: 0.636493572747171
Energy: 0.3817831555139028
Energy: 0.5687401794495593
Energy: 0.38178315551200914
Energy: 0.5021738594182888
Energy: 0.34312037443168736
Energy: 0.6935613262854037
Energy: 0.34312037443042487
Energy: 0.5038239357928056
Energy: 0.3417406659799612
Energy: 0.7565429202381891
Energy: 0.3417406659799612
Energy: 0.4271440329384545
Energy: 0.34637015323499587
Energy: 0.691630812975102
Energy: 0.3463701532337335
Energy: 0.4208736551712607
Energy: 0.342128300031692
Energy: 0.7561603991865542
Energy: 0.3421283000297984
Energy: 0.42758042257803125
Energy: 0.3436193361611854
Energy: 0.7569469406913951
Energy: 0.3436193361611854
Energy: 0.3425278637257468
Energy: 0.34803252676737595
Energy: 0.6903290515277606
Energy: 0.34803252676737595
Energy: 0.3435820940270076
Energy: 0.34243160049712884
Energy: 0.7542646712441644
Energy: 0.3424316004964977
Energy: 0.3468294232370846
Energy: 0.34464094112119814
Energy: 0.7544634452929374
Energy: 0.34464094112309174
Energy: 0.42820264745226455
Energy: 0.3444949465530672
Energy: 0.7583770927073028
Energy: 0.3444949465530672
Energy: 0.41973243621444334
Energy: 0.3417958427445946
Energy: 0.7536540636328791
Energy: 0.3417958427452258
Energy: 0.4299176062056536
Energy: 0.34428064031784694
Energy: 0.6345172573461233
Energy: 0.3442806403172157
Energy: 0.5703262128168046
Energy: 0.3432297171482665
Energy: 0.6327794963534344
Energy: 0.34322971715079126
Energy: 0.5706245507405072
Energy: 0.3431638878697592
Energy: 0.6937638403472749
Energy: 0.3431638878653408
Energy: 0.570686572643518
Energy: 0.46965894849078627
Energy: 0.637954469344194
Energy: 0.46965894849078627
Energy: 0.6936687248627077
Energy: 0.3766737081680341
Energy: 0.6318779498099553
Energy: 0.3766737081674029
Energy: 0.5679588218037263
Energy: 0.3769638386839383
Energy: 0.5699871103763934
Energy: 0.37696383868267586
Energy: 0.6934188027446823
Energy: 0.3444090372641906
Energy: 0.4954706924939644
Energy: 0.34440903726482186
Energy: 0.6949729222037061
Energy: 0.3429266613548555
Energy: 0.5694840505036255
Energy: 0.34292666135674915
Energy: 0.6973544683529015
Energy: 0.3442287926674712
Energy: 0.4298360973818539
Energy: 0.34422879266560624
Energy: 0.753232290035163
Energy: 0.34180061687925595
Energy: 0.41871981481555826
Energy: 0.34180061687862473
Energy: 0.6957379203211355
Energy: 0.3458946357907316
Energy: 0.4266977104027379
Energy: 0.3458946357913628
Energy: 0.694630776935479
Energy: 0.3449334646354344
Energy: 0.34227852273060533
Energy: 0.34493346463606556
Energy: 0.7537960615244582
Energy: 0.34248842556505804
Energy: 0.3432616691618518
Energy: 0.34248842556505804
Energy: 0.7494855797121331
Energy: 0.3456047312822743
Energy: 0.3423656149077859
Energy: 0.34560473128353675

minimum gb energy = 0.3416089499592267 eV
minimum distance =  2.57831294607767 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.7527902905538958
Energy: 0.3222395113245308
Energy: 0.500145858847143
Energy: 0.32223950850565075
Energy: 0.7830237927294224
Energy: 0.32017949271379137
Energy: 0.3884186438754285
Energy: 0.32017949271272195
Energy: 0.781749477197119
Energy: 0.3192035551337368
Energy: 0.3877857416639072
Energy: 0.3192035551321326
Energy: 0.6824524539752803
Energy: 0.32197375019339847
Energy: 0.5204341674568982
Energy: 0.32197375019767616
Energy: 0.7794458067527148
Energy: 0.31757270091260503
Energy: 0.512575437839555
Energy: 0.3175727009136745
Energy: 0.6768893182715507
Energy: 0.31816473012100477
Energy: 0.5159067525407354
Energy: 0.3181647301194006
Energy: 0.5719152605112698
Energy: 0.3239969383173114
Energy: 0.6245718332794606
Energy: 0.3239969383108948
Energy: 0.6782937098932063
Energy: 0.35088801729759445
Energy: 0.5117389174247507
Energy: 0.35088801729759445
Energy: 0.570461117093315
Energy: 0.3475064904004232
Energy: 0.6223333071398057
Energy: 0.3475064903956107
Energy: 0.5696458270280368
Energy: 0.34855992682155085
Energy: 0.7270639120697591
Energy: 0.348559926819412
Energy: 0.5197051921324559
Energy: 0.31944676939937944
Energy: 0.6305615184873047
Energy: 0.31944676939884475
Energy: 0.4488130542021677
Energy: 0.31755661280654873
Energy: 0.7267386477117388
Energy: 0.31755661280387515
Energy: 0.5142308841513427
Energy: 0.31833562381523467
Energy: 0.7281947747102514
Energy: 0.31833562381683883
Energy: 0.39765425243438257
Energy: 0.3218842086712281
Energy: 0.6283423496983922
Energy: 0.3218842086712281
Energy: 0.383014686703657
Energy: 0.31800622502974735
Energy: 0.780214038893238
Energy: 0.3180062250286779
Energy: 0.3936973937726247
Energy: 0.32068440523649244
Energy: 0.7299413964012516
Energy: 0.32068440523595776
Energy: 0.3180054315296639
Energy: 0.32197029151704515
Energy: 0.7330277300735547
Energy: 0.32197029151918405
Energy: 0.31868456012592344
Energy: 0.3185539896112586
Energy: 0.7793720626760818
Energy: 0.3185539896133974
Energy: 0.3262094012202719
Energy: 0.3203692271978852
Energy: 0.6791472675441451
Energy: 0.3203692271984199
Energy: 0.39173741995602696
Energy: 0.32076931268772935
Energy: 0.7829589817260699
Energy: 0.32076931268826403
Energy: 0.3817490916403426
Energy: 0.3181770223360119
Energy: 0.779846786088434
Energy: 0.3181770223370814
Energy: 0.39628176046329056
Energy: 0.3215908402171579
Energy: 0.6817773825977861
Energy: 0.3215908402166232
Energy: 0.5141128195893812
Energy: 0.31889287186636156
Energy: 0.6751019631750161
Energy: 0.31889287189625715
Energy: 0.5125648630638705
Energy: 0.3176324683090336
Energy: 0.7281132626833526
Energy: 0.31763246831277653
Energy: 0.5205863142232768
Energy: 0.3193058411514691
Energy: 0.5757750121159554
Energy: 0.31930583810387614
Energy: 0.6238449041268274
Energy: 0.3484933799792776
Energy: 0.7287992474681289
Energy: 0.3484933799819511
Energy: 0.5124959843894529
Energy: 0.34763226072267994
Energy: 0.6231715068562923
Energy: 0.3476322607258882
Energy: 0.6278750715660959
Energy: 0.3508234147361535
Energy: 0.5753328713142808
Energy: 0.35082341474310474
Energy: 0.6258160465923764
Energy: 0.32208683495286217
Energy: 0.6243408238398
Energy: 0.322086834958744
Energy: 0.6237592650356549
Energy: 0.3180810197235785
Energy: 0.5139823122565864
Energy: 0.31808101972732156
Energy: 0.7319542141256009
Energy: 0.31798745475534307
Energy: 0.44861312779305657
Energy: 0.3179874547569472
Energy: 0.6275768551667033
Energy: 0.32147256648621597
Energy: 0.5192407113164214
Energy: 0.32147256648782013
Energy: 0.7285591554889197
Energy: 0.3190642245857212
Energy: 0.3865680362824109
Energy: 0.31906422458358236
Energy: 0.7819227871862089
Energy: 0.3197073896738538
Energy: 0.3876878002292716
Energy: 0.3197073896717149
Energy: 0.7257968996741386
Energy: 0.32452996655695654
Energy: 0.34117580845985085
Energy: 0.32452996655695654
Energy: 0.7823748001077996
Energy: 0.3192889290628861
Energy: 0.32264142974767024
Energy: 0.3192889290623514
Energy: 0.7796317717695093
Energy: 0.3199277033851787
Energy: 0.3223037178528878
Energy: 0.3199277033862481

minimum gb energy = 0.31755661280387515 eV
minimum distance =  2.5733219047095 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.7996248209013442
Energy: 0.2865346462233633
Energy: 0.28652914633246157
Energy: 0.2865346462247545
Energy: 0.7884086282597744
Energy: 0.2877568382535068
Energy: 0.3429212284043168
Energy: 0.2877568382535068
Energy: 0.6970532530483154
Energy: 0.28740693418525415
Energy: 0.3428038985247614
Energy: 0.28740693418525415
Energy: 0.6009311562530384
Energy: 0.2865910612528134
Energy: 0.459199687522289
Energy: 0.2865910612528134
Energy: 0.7424269296095577
Energy: 0.2864212025083468
Energy: 0.45625462778363196
Energy: 0.2864212025078831
Energy: 0.6027769575802472
Energy: 0.2868790003928751
Energy: 0.45942835132709486
Energy: 0.2868790003933389
Energy: 0.6058770185162347
Energy: 0.2871001672266427
Energy: 0.5574033217860966
Energy: 0.2871001672257152
Energy: 0.6505595836821503
Energy: 0.28722248466663797
Energy: 0.45487759265575084
Energy: 0.2872224846661742
Energy: 0.6056952915023825
Energy: 0.2869544405794047
Energy: 0.5570928739963724
Energy: 0.286954440578941
Energy: 0.6045892426052552
Energy: 0.33707191234576067
Energy: 0.6500457753847184
Energy: 0.33707191234715195
Energy: 0.556687042691323
Energy: 0.28752890664503533
Energy: 0.5559580182859383
Energy: 0.2875289066519917
Energy: 0.5105880559830236
Energy: 0.2874241786514245
Energy: 0.6504731237619483
Energy: 0.2874241786518883
Energy: 0.556192098753092
Energy: 0.28661849834024034
Energy: 0.6502548069329347
Energy: 0.28661849833977665
Energy: 0.4594518977275364
Energy: 0.2873160091322188
Energy: 0.5549131388705644
Energy: 0.2873160091326825
Energy: 0.39747906344375994
Energy: 0.2865203106838771
Energy: 0.742089697899624
Energy: 0.28652031068341344
Energy: 0.4595783975658116
Energy: 0.28779070025812387
Energy: 0.6512610705313779
Energy: 0.28779070025812387
Energy: 0.34967920752432596
Energy: 0.2890097136927907
Energy: 0.6486326807746517
Energy: 0.2890097136927907
Energy: 0.3423369566461447
Energy: 0.286635406606809
Energy: 0.7887963051754265
Energy: 0.286635406606809
Energy: 0.3490361072972422
Energy: 0.2866760048367286
Energy: 0.7405451960964781
Energy: 0.2866760048376561
Energy: 0.2867749095344234
Energy: 0.2867358094166198
Energy: 0.7404495201638459
Energy: 0.2867358094175473
Energy: 0.28739594853073874
Energy: 0.2868368697380525
Energy: 0.7891642840689904
Energy: 0.2868368697389801
Energy: 0.28697572818687894
Energy: 0.2871339098464491
Energy: 0.6945545580513607
Energy: 0.28713390984691284
Energy: 0.3426930904157112
Energy: 0.28918427957676124
Energy: 0.7852605498119306
Energy: 0.28918427957676124
Energy: 0.3442982523555239
Energy: 0.2866779461540094
Energy: 0.7903614922492113
Energy: 0.28667794615493686
Energy: 0.3493620443623394
Energy: 0.28651773599270497
Energy: 0.6009955836142429
Energy: 0.28651773599224123
Energy: 0.45958823879123134
Energy: 0.286836197325927
Energy: 0.7895430199288253
Energy: 0.28683619732546334
Energy: 0.45781476506379537
Energy: 0.2866778149624425
Energy: 0.6969435707259414
Energy: 0.2866778149661526
Energy: 0.5563459085975591
Energy: 0.2874545842234715
Energy: 0.6020615774567607
Energy: 0.28745458422486275
Energy: 0.5582680134696023
Energy: 0.2866553660789023
Energy: 0.7011269064093246
Energy: 0.286655366079366
Energy: 0.5567235116352157
Energy: 0.2875602128135763
Energy: 0.6033016266421023
Energy: 0.2875602128126487
Energy: 0.6527207738098842
Energy: 0.3369754237260726
Energy: 0.5095075173857904
Energy: 0.33697542371540606
Energy: 0.5558202848729172
Energy: 0.33689937632360784
Energy: 0.6531981938029491
Energy: 0.336899376336572
Energy: 0.6507795068383517
Energy: 0.2872661701944665
Energy: 0.5085031725067723
Energy: 0.2872661701949302
Energy: 0.742292869198189
Energy: 0.28658916931293116
Energy: 0.5087186402550538
Energy: 0.28658916931293116
Energy: 0.5550057252069951
Energy: 0.287606140553474
Energy: 0.4600901536256485
Energy: 0.2876061405539378
Energy: 0.743184035211772
Energy: 0.2866459477651554
Energy: 0.45657333425525826
Energy: 0.2866459477651554
Energy: 0.7428166381764061
Energy: 0.28697422695040736
Energy: 0.4590106869124638
Energy: 0.28697422695040736
Energy: 0.6488955016807377
Energy: 0.2866983280899723
Energy: 0.34909753123106313
Energy: 0.2866983280881173
Energy: 0.7902244044701638
Energy: 0.286547798130484
Energy: 0.34334630270241656
Energy: 0.286547798130484
Energy: 0.7405221709137757
Energy: 0.289340302734811
Energy: 0.3491686292101929
Energy: 0.289340302734811
Energy: 0.6478253434782484
Energy: 0.286660314440689
Energy: 0.28690959545683226
Energy: 0.2866603144416166
Energy: 0.788487030851886
Energy: 0.2867237725886371
Energy: 0.2872010488607135
Energy: 0.2867237725891009
Energy: 0.694551102343775
Energy: 0.28673981911662727
Energy: 0.28704055087687436
Energy: 0.2867398191161636

minimum gb energy = 0.2864212025078831 eV
minimum distance =  2.57801695055465 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.011788125933579245
Energy: 0.27700254241474204
Energy: 0.6186407265834921
Energy: 0.2770025424136923
Energy: 0.4117523005417254
Energy: 0.07153347734558521
Energy: 0.41253392887332463
Energy: 0.07153347734489199
Energy: 0.01319562495571723
Energy: 0.07075479868042797
Energy: 0.41120013784782067
Energy: 0.07075479868042797
Energy: 0.013008459244371358
Energy: 0.07218482083250198
Energy: 0.4131425090244929
Energy: 0.07218482083214546
Energy: 0.412224489954045
Energy: 0.07220852501570316
Energy: 0.412127155406152
Energy: 0.07220852501570316
Energy: 0.012152012028813925
Energy: 0.07080412598271087
Energy: 0.4115275040166281
Energy: 0.07080412598235435

minimum gb energy = 0.011788125933579245 eV
minimum distance =  2.81394772105043 Angstroms
sigma value = 1