Model name: model_name=EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_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=4.032073378562927
cohesive_energy=3.360270999181857
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=[2.0212259326226998e-19, 2.65757844811482e-19, 3.03902466113754e-19, 3.4081821793774797e-19, 3.6802317718306796e-19, 3.92344218487188e-19, 4.1436132979161596e-19, 4.3353297539406e-19, 4.498174987020359e-19, 4.63395945675186e-19, 4.745791385805059e-19, 4.84793014622256e-19, 4.95253625865642e-19, 5.041937714833619e-19, 5.11345887977538e-19, 5.17209854457978e-19, 5.22307980507366e-19, 5.2673639672374195e-19, 5.304454356314519e-19, 5.334014515211819e-19, 5.356124552761019e-19, 5.371473404914739e-19, 5.3804295722988e-19, 5.38332951200634e-19, 5.38020526757004e-19, 5.37003144594414e-19, 5.351526305821439e-19, 5.323728541221539e-19, 5.28641384741568e-19, 5.236313784070499e-19, 5.16969527962878e-19, 5.08396280794344e-19, 4.9769213870258995e-19, 4.8420982232748e-19, 4.670312844577319e-19, 4.44881192492682e-19, 4.16174993741304e-19, 3.78869912995248e-19, 3.3068284855106395e-19, 2.69691188447952e-19, 1.9296615379895997e-19, 9.67943798194662e-20, -2.3618486850110998e-20, -1.7341158798098998e-19, -3.5857353939573594e-19, -5.890081959574199e-19, -8.820174631366078e-19, -1.2539163055973218e-18, -1.6972658172279e-18, -2.1969847093724998e-18, -2.7921773071371595e-18, -3.544687628594279e-18, -4.60620975745098e-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: 0.01041681894291652
Energy: 0.05573021751186144
Energy: 0.33412708387614865
Energy: 0.05573021751186144
Energy: 0.05573021751284177
Energy: 0.40078205527149896
Energy: 0.05573021751236561
Energy: 0.4007820552700144
Energy: 0.33412708387614865
Energy: 0.05573021751186144
Energy: 0.01041681894291652
Energy: 0.055730217511385266
Energy: 0.05573021751186144
Energy: 0.40078205527149896
Energy: 0.05573021751088111
Energy: 0.40078205527200306

minimum gb energy = 0.01041681894291652 eV
minimum distance =  2.81235688102365 Angstroms
sigma value = 1


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

Energy: 0.6661424888911636
Energy: 0.5088421923160561
Energy: 0.510266999494355
Energy: 0.5088421923154447
Energy: 0.4661081227489361
Energy: 0.5073634901261627
Energy: 0.4661955846196218
Energy: 0.5073634901255513
Energy: 0.5089064734063681
Energy: 0.5086487938784364
Energy: 0.7258117296287312
Energy: 0.5086487938790478
Energy: 0.46758406113832107
Energy: 0.4679549582405792
Energy: 0.46654186669904346
Energy: 0.46795495823935634
Energy: 0.6193983930222605
Energy: 0.46726564592324504
Energy: 0.46876500934053267
Energy: 0.46726564592141073
Energy: 0.486723813614414
Energy: 0.47383556819504596
Energy: 0.4730100975277752
Energy: 0.4738355681944345
Energy: 0.4895161033176591
Energy: 0.49130717853719647
Energy: 0.47869046236258106
Energy: 0.49130717853719647
Energy: 0.48206489021955523
Energy: 0.49658243931632134
Energy: 0.49753792102971733
Energy: 0.49658243931632134
Energy: 0.499587807183496
Energy: 0.5038233275890188
Energy: 0.5027483425626085
Energy: 0.5038233275877959
Energy: 0.4935129600477051
Energy: 0.501327116590267
Energy: 0.48035615129535414
Energy: 0.5013271165896556
Energy: 0.4780905070003687
Energy: 0.5034515349868074
Energy: 0.5371846621721376
Energy: 0.5034515349861958
Energy: 0.4834094550329354
Energy: 0.5034731038741912
Energy: 0.49573892529236224
Energy: 0.5034731038741912
Energy: 0.48811320430579114
Energy: 0.4908977509772936
Energy: 0.47753798556014204
Energy: 0.4908977509766822
Energy: 0.4866804079639278
Energy: 0.4915721347942638
Energy: 0.48544539074508447
Energy: 0.4915721347948752
Energy: 0.47703422189984734
Energy: 0.4662534920123369
Energy: 0.46659263545889507
Energy: 0.4662534920123369
Energy: 0.47932691335223354
Energy: 0.4673863840470274
Energy: 0.4663338104389961
Energy: 0.46738638404825034
Energy: 0.509876392165738
Energy: 0.5088606013705537
Energy: 0.46805860887973816
Energy: 0.5088606013693308
Energy: 0.4667013228760859
Energy: 0.46849279944280403
Energy: 0.4686913118138847
Energy: 0.4684927994434155
Energy: 0.4738389856514761
Energy: 0.508774261001862
Energy: 0.5104793241659629
Energy: 0.5087742610012504
Energy: 0.4859160858885739
Energy: 0.4689453792073784
Energy: 0.4674568343775431
Energy: 0.46894537920798984
Energy: 0.46827002138525087
Energy: 0.4673674496495207
Energy: 0.47829543780194556
Energy: 0.4673674496495207
Energy: 0.4726820475111884
Energy: 0.46787605614029926
Energy: 0.48668221707369197
Energy: 0.46787605614029926
Energy: 0.4788475802529225
Energy: 0.49148414135509516
Energy: 0.4908801141970695
Energy: 0.49148414135509516
Energy: 0.4951517866455746
Energy: 0.49035965470966325
Energy: 0.48045932487953774
Energy: 0.49035965470966325
Energy: 0.5003232666613755
Energy: 0.5050409050791819
Energy: 0.49961907204155426
Energy: 0.5050409050785705
Energy: 0.481185201522699
Energy: 0.5032839213332861
Energy: 0.4946672085444481
Energy: 0.5032839213332861
Energy: 0.5000421600226106
Energy: 0.5045124462399052
Energy: 0.4780611328596347
Energy: 0.5045124462411281
Energy: 0.4944231435744505
Energy: 0.5058844901630017
Energy: 0.48089487331768443
Energy: 0.5058844901630017
Energy: 0.47783740123468127
Energy: 0.4912308668382509
Energy: 0.4881459633023546
Energy: 0.4912308668382509
Energy: 0.48559331881494255
Energy: 0.49140788563455134
Energy: 0.4879985481710285
Energy: 0.4914078856339399
Energy: 0.46662424382775947
Energy: 0.4663557224729289
Energy: 0.4770481559902318
Energy: 0.4663557224729289
Energy: 0.4664215002308125
Energy: 0.46683876067296975
Energy: 0.4794048507115674
Energy: 0.46683876067296975
Energy: 0.46802004763644195
Energy: 0.5090245298799192
Energy: 0.5106506376490181
Energy: 0.5090245298805307

minimum gb energy = 0.4661081227489361 eV
minimum distance =  2.59248357434485 Angstroms
sigma value = 1


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

Energy: 0.7606788453142815
Energy: 0.527713164644008
Energy: 0.5271120118361698
Energy: 0.527713164644008
Energy: 0.48085398258612505
Energy: 0.5219264730864578
Energy: 0.4810796841268484
Energy: 0.5219264730836691
Energy: 0.5279371058127925
Energy: 0.5274256111846879
Energy: 0.6956828003616766
Energy: 0.5274256111916595
Energy: 0.483065687141791
Energy: 0.5353265004151762
Energy: 0.4810519715418961
Energy: 0.5353265004109932
Energy: 0.49073699213275596
Energy: 0.4815217238406337
Energy: 0.4814095278237858
Energy: 0.48152172384133085
Energy: 0.5039787492591148
Energy: 0.48108758547269315
Energy: 0.4894490125846272
Energy: 0.4810875854719959
Energy: 0.5130386502444544
Energy: 0.5135724253781818
Energy: 0.5267184103702147
Energy: 0.5135724253788789
Energy: 0.49779811957801634
Energy: 0.5196882923776901
Energy: 0.5115237957164459
Energy: 0.5196882923735071
Energy: 0.5273347002521819
Energy: 0.528668728908574
Energy: 0.5370740841528155
Energy: 0.5286687289057853
Energy: 0.512238665471142
Energy: 0.535650636449428
Energy: 0.49702673783604273
Energy: 0.5356506364459422
Energy: 0.4955247445410078
Energy: 0.5124524324988808
Energy: 0.512769491340214
Energy: 0.5124524324953951
Energy: 0.5058499446560538
Energy: 0.5137184145752893
Energy: 0.5050795108320357
Energy: 0.513718414578078
Energy: 0.4816270798695591
Energy: 0.48112411960120105
Energy: 0.49458917337410957
Energy: 0.4811241196123557
Energy: 0.4809083394421007
Energy: 0.48105512732019823
Energy: 0.49523557368808985
Energy: 0.4810551273174096
Energy: 0.48175327282999364
Energy: 0.5276745730198699
Energy: 0.5269395396742342
Energy: 0.5276745730170812
Energy: 0.48574550442512054
Energy: 0.4842551565210301
Energy: 0.4811615687073095
Energy: 0.4842551565217272
Energy: 0.5296498126330729
Energy: 0.5274071220105784
Energy: 0.48986547074315684
Energy: 0.5274071220112756
Energy: 0.48323359326502646
Energy: 0.4831708483669768
Energy: 0.503896978946244
Energy: 0.4831708483690683
Energy: 0.4898738127915732
Energy: 0.48076660432475915
Energy: 0.48264152833551527
Energy: 0.48076660432197044
Energy: 0.504566798702028
Energy: 0.4811651982915154
Energy: 0.4889313073686476
Energy: 0.4811651982936068
Energy: 0.5136373610151898
Energy: 0.5136659826224771
Energy: 0.526527342044642
Energy: 0.5136659826203857
Energy: 0.4975604201242195
Energy: 0.5119932826274404
Energy: 0.5124312504278479
Energy: 0.5119932826253489
Energy: 0.5278119080833461
Energy: 0.5282601352920646
Energy: 0.5376360993648164
Energy: 0.5282601352920646
Energy: 0.5123210693458187
Energy: 0.5282983005233103
Energy: 0.498064275676524
Energy: 0.5282983005233103
Energy: 0.4953656274059002
Energy: 0.5122333701012926
Energy: 0.5129481501950324
Energy: 0.5122333701005954
Energy: 0.5023097039806398
Energy: 0.512747433969541
Energy: 0.5041844898884519
Energy: 0.5127474339709354
Energy: 0.4809115787720532
Energy: 0.48123223370765345
Energy: 0.4946039712976655
Energy: 0.48123223370765345
Energy: 0.4820507591822801
Energy: 0.4811655956689669
Energy: 0.4953099773303552
Energy: 0.4811655956682697
Energy: 0.48161335220269463
Energy: 0.527802572228746
Energy: 0.5271199708707806
Energy: 0.5278025722204118

minimum gb energy = 0.48076660432197044 eV
minimum distance =  2.59383386609725 Angstroms
sigma value = 25


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

Energy: 0.7723597932549748
Energy: 0.5528107240341648
Energy: 0.5539127945271323
Energy: 0.5528107240325439
Energy: 0.503604107783945
Energy: 0.54351955105454
Energy: 0.5057699562483783
Energy: 0.5435195510561609
Energy: 0.554175595679384
Energy: 0.5534332221925264
Energy: 0.689754285001206
Energy: 0.5534332221925264
Energy: 0.5267198965734691
Energy: 0.5434504378665242
Energy: 0.5056139699975013
Energy: 0.543450437864093
Energy: 0.5064814794252834
Energy: 0.5057245236700924
Energy: 0.5081363563899547
Energy: 0.5057245236709028
Energy: 0.5344061750707645
Energy: 0.5087243625911501
Energy: 0.5127230913628236
Energy: 0.5087243625903396
Energy: 0.5559126887356707
Energy: 0.5478494164893143
Energy: 0.5667899136838062
Energy: 0.5478494164901246
Energy: 0.5228193806900767
Energy: 0.5583396361416719
Energy: 0.543102854897503
Energy: 0.5583396361416719
Energy: 0.558920153460192
Energy: 0.5538168987006095
Energy: 0.5161496941875046
Energy: 0.5538168987022304
Energy: 0.5363907224508065
Energy: 0.5556001825366054
Energy: 0.5272249270384309
Energy: 0.5556001825349846
Energy: 0.49559103552929806
Energy: 0.5316377656204406
Energy: 0.5310158972646618
Energy: 0.5316377656196304
Energy: 0.5031526041182263
Energy: 0.5083633144992583
Energy: 0.505731737161535
Energy: 0.5083633144992583
Energy: 0.49158846194651423
Energy: 0.4914167141013904
Energy: 0.4949877996145107
Energy: 0.4914167141013904
Energy: 0.4913815385237046
Energy: 0.48476207848062225
Energy: 0.5067899014550913
Energy: 0.4847620784814327
Energy: 0.5075172364265784
Energy: 0.580217755568627
Energy: 0.58149579040169
Energy: 0.5802177555678166
Energy: 0.5514718176012048
Energy: 0.5095468122913266
Energy: 0.5278239599414369
Energy: 0.509546812292137
Energy: 0.5092902291452469
Energy: 0.5093884961690068
Energy: 0.5067309908279353
Energy: 0.5093884961681963
Energy: 0.5080278337556509
Energy: 0.5095227076542874
Energy: 0.5379987639354791
Energy: 0.5095227076550978
Energy: 0.5668101777162629
Energy: 0.5460148219604597
Energy: 0.5388791151192427
Energy: 0.5460148219620807
Energy: 0.541415696528032
Energy: 0.5453289221762344
Energy: 0.5272414541514526
Energy: 0.5453289221762344
Energy: 0.5157295359838467
Energy: 0.5489710289992038
Energy: 0.5559190239227974
Energy: 0.5489710289984118
Energy: 0.5155563415608349
Energy: 0.5503574480754931
Energy: 0.5358410513087976
Energy: 0.5503574480754931
Energy: 0.5033483172535734
Energy: 0.504069572751202
Energy: 0.4955631613480092
Energy: 0.5040695727528046
Energy: 0.5038340878520865
Energy: 0.5063325094048612
Energy: 0.5175084931550724
Energy: 0.5063325094048612
Energy: 0.5118867555073626
Energy: 0.5530529493524226
Energy: 0.5539237273764324
Energy: 0.5530529493524226

minimum gb energy = 0.48476207848062225 eV
minimum distance =  2.57909583805094 Angstroms
sigma value = 9


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

Energy: 0.6675886925351783
Energy: 0.5620081323825489
Energy: 0.563186441596351
Energy: 0.5620081323844826
Energy: 0.5379230103414664
Energy: 0.5471316286001523
Energy: 0.5383360497308542
Energy: 0.5471316286020859
Energy: 0.5625397314232519
Energy: 0.5625116237302515
Energy: 0.5311899314569207
Energy: 0.5625116237302515
Energy: 0.532464598016701
Energy: 0.5469724816881852
Energy: 0.5380439992674576
Energy: 0.5469724816881852
Energy: 0.5375215613706703
Energy: 0.5121931845213686
Energy: 0.5140466353996275
Energy: 0.5121931845223354
Energy: 0.565630863534843
Energy: 0.5122836887586492
Energy: 0.521258913398456
Energy: 0.5122836887576824
Energy: 0.536199492518583
Energy: 0.5671445025888406
Energy: 0.5330336033255239
Energy: 0.5671445025898073
Energy: 0.5213633017372219
Energy: 0.5678829498761088
Energy: 0.5643742839791933
Energy: 0.5678829498761088
Energy: 0.5123349429584592
Energy: 0.5123605098021123
Energy: 0.48870534249344694
Energy: 0.5123605098030792
Energy: 0.5378778401337035
Energy: 0.5173587536140661
Energy: 0.5209913514800435
Energy: 0.5173587536121326
Energy: 0.4891583904782644
Energy: 0.5619187803989188
Energy: 0.5621548256126865
Energy: 0.5619187804008524
Energy: 0.5736119980309696
Energy: 0.5322693165977492
Energy: 0.5380868123371977
Energy: 0.532269316598716
Energy: 0.5628846953462923
Energy: 0.5626818075909269
Energy: 0.5312057808694046
Energy: 0.5626818075918937
Energy: 0.5324460977920739
Energy: 0.5120005186714957
Energy: 0.5629320753721407
Energy: 0.5120005186705289
Energy: 0.5375472826382528
Energy: 0.5576026655305969
Energy: 0.5120500042372074
Energy: 0.5576026655334971
Energy: 0.5641783914870346
Energy: 0.5124280054221317
Energy: 0.5124276309306027
Energy: 0.5124280054221317
Energy: 0.5342748934569784
Energy: 0.567436918431978
Energy: 0.5331236241077191
Energy: 0.5674369184329447
Energy: 0.5354845404830048
Energy: 0.5671486700187215
Energy: 0.5640274478101899
Energy: 0.5671486700187215
Energy: 0.5117582741154881
Energy: 0.5126027352899453
Energy: 0.4886242066477175
Energy: 0.5126027352899453
Energy: 0.5379216281333947
Energy: 0.5171634460049082
Energy: 0.4887858560397968
Energy: 0.5171634460039414
Energy: 0.5067628407616829
Energy: 0.561888212601537
Energy: 0.5629037367784107
Energy: 0.5618882126005701

minimum gb energy = 0.4886242066477175 eV
minimum distance =  2.59178215127644 Angstroms
sigma value = 25


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

Energy: 0.5886988163928052
Energy: 0.5786888212854462
Energy: 0.5801527179710941
Energy: 0.5786888212854462
Energy: 0.55413473805828
Energy: 0.5348886909658077
Energy: 0.5540696367917969
Energy: 0.534888690964612
Energy: 0.5787636186558871
Energy: 0.5788001193905737
Energy: 0.6063633184976561
Energy: 0.578800119389378
Energy: 0.5474716146267171
Energy: 0.5346986701509902
Energy: 0.554030097159067
Energy: 0.5346986701509902
Energy: 0.5394617687015951
Energy: 0.5710487967163584
Energy: 0.5428860722887371
Energy: 0.5710487967163584
Energy: 0.6051341033201844
Energy: 0.5417514092402538
Energy: 0.5093297664620178
Energy: 0.5417514092402538
Energy: 0.5896850382172735
Energy: 0.5419838180492904
Energy: 0.5403361531731774
Energy: 0.5419838180516816
Energy: 0.5516715446814526
Energy: 0.5708380932839111
Energy: 0.5539516733577186
Energy: 0.5708380932839111
Energy: 0.5787806325842667
Energy: 0.5782613725404826
Energy: 0.6012406241505853
Energy: 0.5782613725404826
Energy: 0.5545691014455207
Energy: 0.5466425337772992
Energy: 0.6015727598206905
Energy: 0.5466425337761036
Energy: 0.6067840418258459
Energy: 0.5797277669344043
Energy: 0.5802967312635562
Energy: 0.5797277669355999
Energy: 0.6035462580372181
Energy: 0.5470010125015702
Energy: 0.5476680569568986
Energy: 0.5470010125015702
Energy: 0.5421947339302134
Energy: 0.5720064730670735
Energy: 0.5395997337657127
Energy: 0.5720064730670735
Energy: 0.5435578626106081
Energy: 0.5417689700267247
Energy: 0.6081876341797342
Energy: 0.5417689700267247
Energy: 0.5427703170706891
Energy: 0.5413734372681421
Energy: 0.5934906029502617
Energy: 0.5413734372681421
Energy: 0.5545835705433424
Energy: 0.5715372294848656
Energy: 0.59157691981706
Energy: 0.5715372294848656
Energy: 0.6014475406505833
Energy: 0.5782275191534392
Energy: 0.5799028060553237
Energy: 0.5782275191546349

minimum gb energy = 0.5093297664620178 eV
minimum distance =  2.59100384251409 Angstroms
sigma value = 17


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

Energy: 0.8097222631064047
Energy: 0.6428425501758859
Energy: 0.6436976713765061
Energy: 0.642842550176563
Energy: 0.5470660985642182
Energy: 0.529159540351291
Energy: 0.6202645111912588
Energy: 0.5291595403492595
Energy: 0.5482121321726297
Energy: 0.5473831051749395
Energy: 0.6597237538934525
Energy: 0.5473831051749395
Energy: 0.5291680793028788
Energy: 0.5302123613478311
Energy: 0.6095568846112919
Energy: 0.530212361347154
Energy: 0.6095860314372129
Energy: 0.5891544807421261
Energy: 0.5658799460598726
Energy: 0.5891544807428032
Energy: 0.6101954214974453
Energy: 0.5872689504476818
Energy: 0.5694245417964213
Energy: 0.5872689504476818
Energy: 0.6511937807658487
Energy: 0.5468185261651036
Energy: 0.5476759849964433
Energy: 0.5468185261657809
Energy: 0.640340653384098
Energy: 0.5299928943616662
Energy: 0.5471708541521977
Energy: 0.5299928943603119
Energy: 0.6445104439587683
Energy: 0.6430405764425834
Energy: 0.6600244766010221
Energy: 0.6430405764425834
Energy: 0.6434410762192779
Energy: 0.5965832526894388
Energy: 0.6082383871427745
Energy: 0.5965832526901159
Energy: 0.608707361193484
Energy: 0.5335090792558876
Energy: 0.5345063897184598
Energy: 0.5335090792565649
Energy: 0.6088158804519459
Energy: 0.5338461896387028
Energy: 0.5342693994015225
Energy: 0.5338461896380257
Energy: 0.6091207967238166
Energy: 0.5335137491222948
Energy: 0.5334515332484766
Energy: 0.5335137491229719
Energy: 0.6508496636803787
Energy: 0.5558277304774609
Energy: 0.5339598700519869
Energy: 0.5558277304781382
Energy: 0.6432682903005247
Energy: 0.6421691355398527
Energy: 0.6393183790753852
Energy: 0.6421691355391754
Energy: 0.64321325220751
Energy: 0.6424827480627091
Energy: 0.6394170802318299
Energy: 0.6424827480627091
Energy: 0.6605975946353616
Energy: 0.5469865370986622
Energy: 0.5472480223094195
Energy: 0.5469865370986622
Energy: 0.6630973565614422
Energy: 0.5471570988482044
Energy: 0.5471394796165088
Energy: 0.5471570988482044
Energy: 0.5702650743423049
Energy: 0.5906973238146191
Energy: 0.6100256256412949
Energy: 0.5906973238152964
Energy: 0.5602921150855497
Energy: 0.590243364100707
Energy: 0.609770809233191
Energy: 0.590243364100707
Energy: 0.5469618630897946
Energy: 0.5299539361843663
Energy: 0.6518469938322227
Energy: 0.5299539361850434
Energy: 0.5470524001953836
Energy: 0.5471829562489011
Energy: 0.653976296650394
Energy: 0.5471829562495782
Energy: 0.6313079776469214
Energy: 0.5969527127277225
Energy: 0.6328302258767914
Energy: 0.5969527127277225
Energy: 0.6600185387289177
Energy: 0.6425916491109863
Energy: 0.6421720851917021
Energy: 0.6425916491116636
Energy: 0.5338419389675568
Energy: 0.5288596610992
Energy: 0.6088417181342229
Energy: 0.5288596610992
Energy: 0.5339796499097272
Energy: 0.5337771459473262
Energy: 0.6078759579634582
Energy: 0.5337771459480034
Energy: 0.51926192380693
Energy: 0.5719877146954317
Energy: 0.6418516514003528
Energy: 0.5719877146954317
Energy: 0.5374528460417926
Energy: 0.5337285073297823
Energy: 0.6541657056785369
Energy: 0.5337285073297823
Energy: 0.5329638716351282
Energy: 0.6017360120617707
Energy: 0.5529545427179627
Energy: 0.6017360120624479
Energy: 0.6622563129307907
Energy: 0.6427035766000582
Energy: 0.6431684899099721
Energy: 0.6427035765993808

minimum gb energy = 0.51926192380693 eV
minimum distance =  2.56655171592181 Angstroms
sigma value = 53


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

Energy: 0.7244537262817373
Energy: 0.5852558193556721
Energy: 0.5891690246016165
Energy: 0.5852558193556721
Energy: 0.5559235226014746
Energy: 0.5112462431226652
Energy: 0.6059757961017778
Energy: 0.5112462431242241
Energy: 0.5863530682950414
Energy: 0.5869292404086861
Energy: 0.5773984828022792
Energy: 0.5869292404086861
Energy: 0.555491971628827
Energy: 0.5113684032505449
Energy: 0.5672149509375595
Energy: 0.5113684032521039
Energy: 0.5773276332358735
Energy: 0.5107414041684697
Energy: 0.4710252344519127
Energy: 0.5107414041684697
Energy: 0.5536567852087114
Energy: 0.5115075595298998
Energy: 0.47120807275550763
Energy: 0.5115075595298998
Energy: 0.6346302970325457
Energy: 0.5839027254213709
Energy: 0.5864477027714498
Energy: 0.5839027254198119
Energy: 0.6335225226305448
Energy: 0.5545956542856572
Energy: 0.6083001811105366
Energy: 0.5545956542840983
Energy: 0.5859186316959147
Energy: 0.586745252803068
Energy: 0.5752418387502771
Energy: 0.586745252803068
Energy: 0.5549241917459848
Energy: 0.5551539668451405
Energy: 0.5683103299816402
Energy: 0.5551539668435816
Energy: 0.5777231585467923
Energy: 0.5110912702588444
Energy: 0.47126709701712777
Energy: 0.5110912702604032
Energy: 0.555054537552176
Energy: 0.510383598956042
Energy: 0.47400792021142707
Energy: 0.510383598956042
Energy: 0.6336657376290777
Energy: 0.5848100594417673
Energy: 0.5905596724565607
Energy: 0.5848100594402085

minimum gb energy = 0.4710252344519127 eV
minimum distance =  2.59201326125862 Angstroms
sigma value = 9


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

Energy: 0.7056194728488624
Energy: 0.6779949399363735
Energy: 0.6762973885793448
Energy: 0.6779949399375274
Energy: 0.587451378942025
Energy: 0.5319855160091813
Energy: 0.7000475262552245
Energy: 0.5319855160097582
Energy: 0.5264236304420621
Energy: 0.5265584199202519
Energy: 0.6432699824992394
Energy: 0.5265584199208289
Energy: 0.5291837620211793
Energy: 0.5320050656042995
Energy: 0.6782962599099771
Energy: 0.5320050656042995
Energy: 0.5277855068408324
Energy: 0.5252809582600734
Energy: 0.6741336913975261
Energy: 0.5252809582583424
Energy: 0.5822198050029952
Energy: 0.5256770622039344
Energy: 0.6725900175185165
Energy: 0.5256770622039344
Energy: 0.670280621305063
Energy: 0.66854888126876
Energy: 0.6771921612847756
Energy: 0.668548881269337
Energy: 0.6997733875825141
Energy: 0.6438783070634573
Energy: 0.6716731857951499
Energy: 0.6438783070634573
Energy: 0.5637014031247642
Energy: 0.5841609300607488
Energy: 0.5536447674777524
Energy: 0.5841609300613257
Energy: 0.5099680689884551
Energy: 0.5557073151733641
Energy: 0.6396351579063593
Energy: 0.5557073151750951
Energy: 0.582606179047908
Energy: 0.5702959595320346
Energy: 0.6610934555119862
Energy: 0.5702959595314576
Energy: 0.5803240921981094
Energy: 0.5803031279637267
Energy: 0.686557165653549
Energy: 0.5803031279631496
Energy: 0.6721482237688576
Energy: 0.569903290426799
Energy: 0.6301265199941936
Energy: 0.569903290427376
Energy: 0.671609997144474
Energy: 0.5805169126382475
Energy: 0.5826108570244565
Energy: 0.5805169126394014
Energy: 0.6580410359750358
Energy: 0.5550174292211267
Energy: 0.5581143493674426
Energy: 0.5550174292211267
Energy: 0.5956596207146887
Energy: 0.5800894932368881
Energy: 0.5587959626113216
Energy: 0.5800894932368881
Energy: 0.6604796641118796
Energy: 0.5873677808317751
Energy: 0.5854344995898192
Energy: 0.5873677808311981
Energy: 0.6714489394809624
Energy: 0.6702681841704946
Energy: 0.6881173807417486
Energy: 0.6702681841704946
Energy: 0.735333501608599
Energy: 0.6929843546118865
Energy: 0.6297461647491203
Energy: 0.6929843546107325
Energy: 0.6437378320438142
Energy: 0.5266446661413111
Energy: 0.52627949150574
Energy: 0.5266446661413111
Energy: 0.6795434582602801
Energy: 0.5321018096707697
Energy: 0.5280112416492555
Energy: 0.5321018096713467
Energy: 0.6728761938769278
Energy: 0.5251569062701006
Energy: 0.5263655905871422
Energy: 0.5251569062718314
Energy: 0.6737745967009514
Energy: 0.5260901158145607
Energy: 0.5263560191435869
Energy: 0.5260901158145607
Energy: 0.6782053741771223
Energy: 0.6687793230551746
Energy: 0.6720273114283616
Energy: 0.6687793230534438
Energy: 0.6712210106574127
Energy: 0.6542542177475548
Energy: 0.670340639106183
Energy: 0.6542542177464009
Energy: 0.5548233716664854
Energy: 0.6200536925785707
Energy: 0.57260092610852
Energy: 0.6200536925785707
Energy: 0.6392329510793892
Energy: 0.5551271909438139
Energy: 0.5094263604318442
Energy: 0.5551271909438139
Energy: 0.6612304408882557
Energy: 0.5779405272558549
Energy: 0.5827045938732124
Energy: 0.5779405272564317
Energy: 0.6893432772534919
Energy: 0.580456922856929
Energy: 0.5803838795268141
Energy: 0.5804569228575058
Energy: 0.6300064850315551
Energy: 0.5793386369033111
Energy: 0.6735461418463649
Energy: 0.5793386369021571
Energy: 0.5834900952768161
Energy: 0.580448647417807
Energy: 0.641363453271569
Energy: 0.580448647417807
Energy: 0.5748029774867229
Energy: 0.5759955210367544
Energy: 0.6482766052674448
Energy: 0.5759955210367544
Energy: 0.557758917519333
Energy: 0.5821363813791899
Energy: 0.5964046975242507
Energy: 0.5821363813803438
Energy: 0.5793529198082309
Energy: 0.589117934407547
Energy: 0.610546405338293
Energy: 0.589117934407547
Energy: 0.6883554927514056
Energy: 0.66903736998385
Energy: 0.6716990880664065
Energy: 0.66903736998385

minimum gb energy = 0.5094263604318442 eV
minimum distance =  2.5770250339408 Angstroms
sigma value = 73


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

Energy: 0.7483621199176655
Energy: 0.6503534747099793
Energy: 0.6512544847022372
Energy: 0.6503534747108948
Energy: 0.5757363716482627
Energy: 0.6620378530112565
Energy: 0.6458122207812053
Energy: 0.6620378530121719
Energy: 0.5401550495838052
Energy: 0.5404373832117487
Energy: 0.6184893431293766
Energy: 0.5404373832126641
Energy: 0.540257391842187
Energy: 0.5409413174653731
Energy: 0.6456154121420223
Energy: 0.5409413174635422
Energy: 0.5408017061450762
Energy: 0.5409407231870434
Energy: 0.685348010170346
Energy: 0.5409407231861281
Energy: 0.5803828376537778
Energy: 0.5404633486069415
Energy: 0.6842985323300618
Energy: 0.5404633486069415
Energy: 0.6205202955792465
Energy: 0.6447528514984954
Energy: 0.6588141716580171
Energy: 0.6447528514984954
Energy: 0.6320581417298895
Energy: 0.6200167570493272
Energy: 0.6450411347861505
Energy: 0.6200167570484117
Energy: 0.5788664181920256
Energy: 0.6003428925716312
Energy: 0.6293854463872771
Energy: 0.6003428925716312
Energy: 0.5421062050031984
Energy: 0.6158189875613206
Energy: 0.6308953523624963
Energy: 0.6158189875613206
Energy: 0.5815704234578999
Energy: 0.5637590185464432
Energy: 0.551005372182558
Energy: 0.5637590185455278
Energy: 0.5811162041773029
Energy: 0.5836893386164373
Energy: 0.6521645210481527
Energy: 0.5836893386173527
Energy: 0.6198829393809501
Energy: 0.5626463747393029
Energy: 0.6127584062618209
Energy: 0.5626463747402184
Energy: 0.619146191411656
Energy: 0.5779001958441082
Energy: 0.5774599253525282
Energy: 0.5779001958422774
Energy: 0.639229970632148
Energy: 0.5415042882713375
Energy: 0.5472962749526229
Energy: 0.5415042882704221
Energy: 0.6836962000438681
Energy: 0.5492019621773594
Energy: 0.5481590241877861
Energy: 0.5492019621764438
Energy: 0.6839177309083467
Energy: 0.6547777899332055
Energy: 0.5821928639559415
Energy: 0.6547777899341211
Energy: 0.6514866305837895
Energy: 0.6511789569703333
Energy: 0.632315835131099
Energy: 0.6511789569730796
Energy: 0.6332307335744598
Energy: 0.6292874374879825
Energy: 0.6323932137975905
Energy: 0.6292874374879825
Energy: 0.593065135666198
Energy: 0.5612408819774247
Energy: 0.6030683168796159
Energy: 0.5612408819792557
Energy: 0.5944226919611622
Energy: 0.5808907654092261
Energy: 0.5441078574432087
Energy: 0.5808907654092261
Energy: 0.6834440778007955
Energy: 0.6259178606868554
Energy: 0.6368485116736343
Energy: 0.62591786068594

minimum gb energy = 0.5401550495838052 eV
minimum distance =  2.55840981100294 Angstroms
sigma value = 7


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

Energy: 0.8899728276444053
Energy: 0.6653772601839382
Energy: 0.6678576592814993
Energy: 0.6653772601813488
Energy: 0.5729798212479404
Energy: 0.6249662333466554
Energy: 0.6572397862527587
Energy: 0.6249662333440661
Energy: 0.5257286776175968
Energy: 0.5254282368971974
Energy: 0.5718171051669493
Energy: 0.5254282368971974
Energy: 0.5275706617948319
Energy: 0.5258178195107425
Energy: 0.657569227871293
Energy: 0.5258178195107425
Energy: 0.5651526912842902
Energy: 0.5612202260300345
Energy: 0.6301863682952861
Energy: 0.5612202260274454
Energy: 0.5624819910914768
Energy: 0.5616630528517342
Energy: 0.6315564002130879
Energy: 0.5616630528582072
Energy: 0.6844727824848077
Energy: 0.5767845700903934
Energy: 0.5623832306818177
Energy: 0.5767845700897462
Energy: 0.7008247104386589
Energy: 0.5628723246530364
Energy: 0.5620910929237907
Energy: 0.5628723246556255
Energy: 0.694892767580412
Energy: 0.5370337146311627
Energy: 0.5252578371017934
Energy: 0.5370337146324573
Energy: 0.6284696464613079
Energy: 0.5253363329573207
Energy: 0.5246245764884232
Energy: 0.5253363329560261
Energy: 0.701117736240588
Energy: 0.6157154957909712
Energy: 0.5623918620442592
Energy: 0.6157154957844982
Energy: 0.640141415727969
Energy: 0.6406260850801138
Energy: 0.6858603213486406
Energy: 0.6406260850820555
Energy: 0.6303911125596245
Energy: 0.5489888854545767
Energy: 0.6495150895901285
Energy: 0.5489888854526348
Energy: 0.576641871051439
Energy: 0.5476735853116365
Energy: 0.5183026189703438
Energy: 0.5476735853116365
Energy: 0.6381488918096457
Energy: 0.5484155857787548
Energy: 0.5595408931323725
Energy: 0.5484155857774603
Energy: 0.733133140778171
Energy: 0.6412441622747836
Energy: 0.6421218788279087
Energy: 0.6412441622702526
Energy: 0.7336687710928476
Energy: 0.6161109297966135
Energy: 0.7063861355209599
Energy: 0.6161109297985553
Energy: 0.5695978223516994
Energy: 0.5253933061894551
Energy: 0.5715756794313958
Energy: 0.5253933061881604
Energy: 0.5242130583159531
Energy: 0.53676786048401
Energy: 0.7028161590417623
Energy: 0.5367678604827154
Energy: 0.5615794606509242
Energy: 0.5611725841969201
Energy: 0.7359759708487938
Energy: 0.5611725841936835
Energy: 0.5631691289429379
Energy: 0.5764312600531916
Energy: 0.6270548962934582
Energy: 0.5764312600538388
Energy: 0.6843902872427855
Energy: 0.5622570004378846
Energy: 0.6484905739466365
Energy: 0.5622570004333536
Energy: 0.6837737925226546
Energy: 0.5623276280856451
Energy: 0.5630935701960632
Energy: 0.5623276280849979
Energy: 0.6534200412632172
Energy: 0.5252418653256609
Energy: 0.5292549476790596
Energy: 0.5252418653191878
Energy: 0.6284148603674351
Energy: 0.5257096302825442
Energy: 0.5244024426114465
Energy: 0.5257096302838389
Energy: 0.6771832449923967
Energy: 0.6152735385211457
Energy: 0.6461790793324271
Energy: 0.6152735385224404
Energy: 0.668157499207921
Energy: 0.6444159153130771
Energy: 0.7584053301523499
Energy: 0.6444159153169609
Energy: 0.6297277354133539
Energy: 0.615369069533789
Energy: 0.6460734378116701
Energy: 0.615369069533789
Energy: 0.573268335541556
Energy: 0.5491859466443576
Energy: 0.5957014047079948
Energy: 0.5491859466437103
Energy: 0.6329209630805578
Energy: 0.548637266199315
Energy: 0.5192515147970582
Energy: 0.5486372662006096
Energy: 0.7373906599340891
Energy: 0.6405734736547163
Energy: 0.6414532458421519
Energy: 0.6405734736508326

minimum gb energy = 0.5183026189703438 eV
minimum distance =  2.57186699471217 Angstroms
sigma value = 29


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

Energy: 0.45164847184040174
Energy: 0.6074481129303692
Energy: 0.5327377706924445
Energy: 0.6074481129301437
Energy: 0.6016137798549371
Energy: 0.5224146358117051
Energy: 0.5555703531925422
Energy: 0.5224146358119305
Energy: 0.600867588294946
Energy: 0.5744140933394026
Energy: 0.5261302909879099
Energy: 0.574414093340054
Energy: 0.5328546784796314
Energy: 0.46222517555473724
Energy: 0.5993463100530798
Energy: 0.4622251755545117
Energy: 0.5292268322140607
Energy: 0.5298169620135549
Energy: 0.4522235626537574
Energy: 0.5298169620120017
Energy: 0.5991528553259243
Energy: 0.5734911770802079
Energy: 0.45214101844923515
Energy: 0.5734911770797572
Energy: 0.4585665862725339
Energy: 0.5741714997966986
Energy: 0.5999121643173354
Energy: 0.5741714997964981
Energy: 0.5557504015605506
Energy: 0.4623085374482706
Energy: 0.5934332767257019
Energy: 0.4623085374478197
Energy: 0.5324206775717184
Energy: 0.4660854481962685
Energy: 0.5272980712152989
Energy: 0.46608544819561715

minimum gb energy = 0.45164847184040174 eV
minimum distance =  2.62906366334063 Angstroms
sigma value = 5


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

Energy: 0.7292760174534205
Energy: 0.5323186559391773
Energy: 0.6342346824802992
Energy: 0.5323186559905112
Energy: 0.6386950423243872
Energy: 0.49845524601703034
Energy: 0.5974370364424502
Energy: 0.49845524601091595
Energy: 0.5912235828047925
Energy: 0.5378492481207813
Energy: 0.5827639279705092
Energy: 0.5378492481201697
Energy: 0.5443027163979212
Energy: 0.49785906346183
Energy: 0.6513370711145529
Energy: 0.49785906346244146
Energy: 0.6360180532529514
Energy: 0.509048801486474
Energy: 0.7205227095725121
Energy: 0.5090488014876969
Energy: 0.5207105045234197
Energy: 0.5168943278361576
Energy: 0.7192337354360581
Energy: 0.5168943278373805
Energy: 0.4974568992743919
Energy: 0.4972089071649009
Energy: 0.6512466998485192
Energy: 0.4972089071673467
Energy: 0.5078516749595146
Energy: 0.4987490500535923
Energy: 0.6512939822993017
Energy: 0.49874905005298087
Energy: 0.6255084019498558
Energy: 0.5226843113968729
Energy: 0.6575526349012998
Energy: 0.5226843113980958
Energy: 0.6259070903324557
Energy: 0.4934259200993111
Energy: 0.49556158904871006
Energy: 0.4934259201035912
Energy: 0.6283497919267482
Energy: 0.49327051563638297
Energy: 0.513212265282321
Energy: 0.49327051563332575
Energy: 0.674758476175255
Energy: 0.494243905783396
Energy: 0.516134983130841
Energy: 0.49424390577911587
Energy: 0.6780742240989821
Energy: 0.5123931403231542
Energy: 0.6240275498811317
Energy: 0.5123931403225429
Energy: 0.638564304980493
Energy: 0.5793898870746418
Energy: 0.6183473975050924
Energy: 0.5793898870770876
Energy: 0.5278869625881271
Energy: 0.48692955524379883
Energy: 0.6192808535800067
Energy: 0.4869295552425759
Energy: 0.5563190184930825
Energy: 0.4862306687134909
Energy: 0.6058954902610605
Energy: 0.4862306687110451
Energy: 0.5297726084850656
Energy: 0.5298694183601257
Energy: 0.6061157533771588
Energy: 0.5298694183589028
Energy: 0.6346597699563069
Energy: 0.4865038311133358
Energy: 0.6055824783235749
Energy: 0.4865038311157815
Energy: 0.6142324883014314
Energy: 0.529909710793445
Energy: 0.541927438823832
Energy: 0.5299097107946679
Energy: 0.6645576825153895
Energy: 0.5012483596916643
Energy: 0.5436305723897816
Energy: 0.5012483596946937
Energy: 0.7190279799736553
Energy: 0.5008874981391549
Energy: 0.5491955977370766
Energy: 0.5008874981385435
Energy: 0.7214345526897877
Energy: 0.5248258364903379
Energy: 0.527320806137479
Energy: 0.5248258364915608
Energy: 0.6603620843708164
Energy: 0.5004929502557023
Energy: 0.5017698072498746
Energy: 0.5004929502544794
Energy: 0.6479152629812311
Energy: 0.5058506806311422
Energy: 0.5055149928777902
Energy: 0.5058506806293079
Energy: 0.6580060833785281
Energy: 0.49257962151557505
Energy: 0.6190752245291306
Energy: 0.49257962150823764
Energy: 0.5040533179072175
Energy: 0.4915347414723778
Energy: 0.6259526584587451
Energy: 0.4915347414736007
Energy: 0.5148084473738168
Energy: 0.4904617895903778
Energy: 0.6175278794182112
Energy: 0.4904617895916007
Energy: 0.5305568196164583
Energy: 0.4907318011440607
Energy: 0.6181433159191552
Energy: 0.49073180114283776
Energy: 0.6491446461922706
Energy: 0.536931306623274
Energy: 0.6799314569620935
Energy: 0.536931306623274
Energy: 0.6188853464225784
Energy: 0.5760879202597876
Energy: 0.6238625283463678
Energy: 0.5760879202573419
Energy: 0.6184618841241083
Energy: 0.4986193517265072
Energy: 0.5018577445792354
Energy: 0.49861935173017585
Energy: 0.6390185384487559
Energy: 0.4974189879927224
Energy: 0.5016211700850752
Energy: 0.4974189879933338
Energy: 0.6180489960247336
Energy: 0.5429104093530668
Energy: 0.5520441212660482
Energy: 0.5429104093542897

minimum gb energy = 0.4862306687110451 eV
minimum distance =  2.56118319952659 Angstroms
sigma value = 1


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

Energy: 0.714885517099802
Energy: 0.4830796235133432
Energy: 0.6242524776972036
Energy: 0.4830796235116523
Energy: 0.6351534897542135
Energy: 0.4749043528538865
Energy: 0.5873437724467787
Energy: 0.4749043528521956
Energy: 0.5769063317698413
Energy: 0.5288125805807419
Energy: 0.5847402442818965
Energy: 0.5288125805798966
Energy: 0.4838646199658192
Energy: 0.47453823063970496
Energy: 0.652715796710689
Energy: 0.4745382306371687
Energy: 0.6116513429993021
Energy: 0.48338584946491453
Energy: 0.6548360601234395
Energy: 0.48338584946575996
Energy: 0.48208885940347795
Energy: 0.4832770883136332
Energy: 0.6524580230854046
Energy: 0.48327708831447863
Energy: 0.47445123230078995
Energy: 0.47384920592788543
Energy: 0.6517906108732505
Energy: 0.4738492059287308
Energy: 0.4766158585045259
Energy: 0.47507133863901635
Energy: 0.6758581002906323
Energy: 0.4750713386398618
Energy: 0.6369325225939134
Energy: 0.5081820077639304
Energy: 0.6892828935976932
Energy: 0.5081820077639304
Energy: 0.5970403983366419
Energy: 0.47524119612486415
Energy: 0.4744530412957543
Energy: 0.47524119612317334
Energy: 0.6370590283512604
Energy: 0.4742266075269121
Energy: 0.47418273367187946
Energy: 0.4742266075260667
Energy: 0.6752124190707467
Energy: 0.4774150294196185
Energy: 0.4827046912082292
Energy: 0.47741502941877306
Energy: 0.6749400147529248
Energy: 0.4748545239069506
Energy: 0.5960633111711692
Energy: 0.4748545239044143
Energy: 0.6350232555472491
Energy: 0.474591069601731
Energy: 0.5847298341848748
Energy: 0.47459106960088554
Energy: 0.48190637078243087
Energy: 0.5280002094917928
Energy: 0.5875418165627202
Energy: 0.5280002094934837
Energy: 0.48147337207327917
Energy: 0.4747428870603887
Energy: 0.6515107874614198
Energy: 0.47474288706207957
Energy: 0.5447014401361729
Energy: 0.6132254248084803
Energy: 0.6510604597985966
Energy: 0.6132254248101712
Energy: 0.48192887133407425
Energy: 0.47505760947087056
Energy: 0.6515236530528551
Energy: 0.47505760947171605
Energy: 0.49963740721768823
Energy: 0.47448942367531277
Energy: 0.6902889758107287
Energy: 0.4744894236770037
Energy: 0.4749411964103826
Energy: 0.5030654660614804
Energy: 0.6759856609716229
Energy: 0.5030654660597895
Energy: 0.5835878328153243
Energy: 0.5087941133973455
Energy: 0.6623261159059932
Energy: 0.5087941133981909
Energy: 0.5824395039649167
Energy: 0.47535714432393283
Energy: 0.4767542334554477
Energy: 0.47535714432393283
Energy: 0.6348707900843146
Energy: 0.47403662282344855
Energy: 0.47577354631092245
Energy: 0.47403662282429393
Energy: 0.6747593280303762
Energy: 0.4753080800994339
Energy: 0.4742493066399881
Energy: 0.47530808010112474

minimum gb energy = 0.47384920592788543 eV
minimum distance =  2.58592043597915 Angstroms
sigma value = 17


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

Energy: 0.7702027524131153
Energy: 0.5119346230689661
Energy: 0.632198168383406
Energy: 0.5119346250804254
Energy: 0.6666595539792509
Energy: 0.4763467122520142
Energy: 0.5549693887088812
Energy: 0.47634671225149167
Energy: 0.6132569464880514
Energy: 0.5757903115682085
Energy: 0.5490979590413834
Energy: 0.5757903115687311
Energy: 0.612864322450851
Energy: 0.5044884892848799
Energy: 0.6151704373727133
Energy: 0.5044884892864474
Energy: 0.6549474723605727
Energy: 0.473061128473552
Energy: 0.6706769329998278
Energy: 0.4730611284777323
Energy: 0.4697869546593623
Energy: 0.472640056767123
Energy: 0.6958336551152685
Energy: 0.4726400567692132
Energy: 0.4705637701190343
Energy: 0.4689076863751662
Energy: 0.6378343043794023
Energy: 0.4689076863741212
Energy: 0.475579497530224
Energy: 0.4696455848291692
Energy: 0.7147707758267995
Energy: 0.4696455848312594
Energy: 0.6727049424733881
Energy: 0.4699407304237495
Energy: 0.6739984075100608
Energy: 0.4699407304232269
Energy: 0.5496192227943042
Energy: 0.5058270313957197
Energy: 0.5574386157685542
Energy: 0.5058270313936295
Energy: 0.6664628014498037
Energy: 0.4755249533015327
Energy: 0.48023167259060545
Energy: 0.47552495330310035
Energy: 0.6936793955603558
Energy: 0.4771806202613226
Energy: 0.541638689324033
Energy: 0.47718062026027747
Energy: 0.6969893720319698
Energy: 0.5095142232938811
Energy: 0.5127844212281908
Energy: 0.5095142232933585
Energy: 0.664455536006388
Energy: 0.4753892580883878
Energy: 0.47737576051542674
Energy: 0.4753892580889103
Energy: 0.6106823043350535
Energy: 0.47622835489053084
Energy: 0.48248659292435353
Energy: 0.47622835489000825
Energy: 0.7125387444237762
Energy: 0.4756146338870857
Energy: 0.6794947850482995
Energy: 0.4756146338881308
Energy: 0.4758042161708725
Energy: 0.5033904591416479
Energy: 0.6748569365846218
Energy: 0.5033904591755658
Energy: 0.4917933204667442
Energy: 0.4757006652603911
Energy: 0.6916038282125948
Energy: 0.4757006652603911
Energy: 0.4948901320062427
Energy: 0.4767188824220626
Energy: 0.6732176548033725
Energy: 0.47671888242310767
Energy: 0.5976422310883005
Energy: 0.5816772294105652
Energy: 0.7339987616220958
Energy: 0.5816772294105652
Energy: 0.55240424204893
Energy: 0.4760610578744608
Energy: 0.6660723595374604
Energy: 0.4760610578734157
Energy: 0.5502684398008557
Energy: 0.5775765520857212
Energy: 0.6113712912127185
Energy: 0.5775765520872889
Energy: 0.6391569029941144
Energy: 0.5034766604306542
Energy: 0.6109014878966782
Energy: 0.5034766604311768
Energy: 0.6723493851416598
Energy: 0.4833271025337481
Energy: 0.6776084985451326
Energy: 0.4833271025311354
Energy: 0.6933729404267309
Energy: 0.47005616550182827
Energy: 0.48519766408266074
Energy: 0.47005616550130574
Energy: 0.6375772042502983
Energy: 0.4692488084461172
Energy: 0.47236242893801167
Energy: 0.4692488084461172
Energy: 0.7360410657239662
Energy: 0.4701727723457094
Energy: 0.4718308932255234
Energy: 0.47017277234727706
Energy: 0.6710056891300562
Energy: 0.47090852555738877
Energy: 0.6631143855531382
Energy: 0.4709085255605241
Energy: 0.5555464468482941
Energy: 0.5044838600791882
Energy: 0.5487289647567528
Energy: 0.5044838600797108
Energy: 0.48129734981168587
Energy: 0.4755630497409212
Energy: 0.6686542640813625
Energy: 0.47556304973883107
Energy: 0.5673400838609655
Energy: 0.4761993874583268
Energy: 0.6951752549686557
Energy: 0.4761993874593719
Energy: 0.5106596579351544
Energy: 0.491431780015034
Energy: 0.6955737141746287
Energy: 0.49143178001555654
Energy: 0.47589263548218036
Energy: 0.4752499906459319
Energy: 0.6927763464229644
Energy: 0.47524999064488677
Energy: 0.4822744520107181
Energy: 0.4762692014145363
Energy: 0.6120814911937124
Energy: 0.47626920141401374
Energy: 0.6800236511784367
Energy: 0.4754581754434163
Energy: 0.7110406870865335
Energy: 0.47545817543453306
Energy: 0.6924854964287304
Energy: 0.4768737061785529
Energy: 0.47560455605331675
Energy: 0.4768737061775078
Energy: 0.6991546354127572
Energy: 0.4754663317898648
Energy: 0.4763693062997075
Energy: 0.4754663317893422
Energy: 0.6765408736787825
Energy: 0.47676637520950066
Energy: 0.5306136904757279
Energy: 0.4767663752115908

minimum gb energy = 0.4689076863741212 eV
minimum distance =  2.57401399609753 Angstroms
sigma value = 89


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

Energy: 0.9336864840317995
Energy: 0.49743071728560223
Energy: 0.497577197046709
Energy: 0.49743071728696947
Energy: 0.7534564589575898
Energy: 0.5170177236593106
Energy: 0.6223055764957109
Energy: 0.5170177236593106
Energy: 0.5300101403217035
Energy: 0.5179779482949077
Energy: 0.6220142650705973
Energy: 0.5179779482935405
Energy: 0.5221587744898318
Energy: 0.5172013777525571
Energy: 0.6708298976486755
Energy: 0.5172013777525571
Energy: 0.5728776459481224
Energy: 0.516898526616381
Energy: 0.6719202015313361
Energy: 0.516898526616381
Energy: 0.5151551471895721
Energy: 0.45190371015741754
Energy: 0.6714079875162743
Energy: 0.45190371015878483
Energy: 0.5026103923437901
Energy: 0.42536760915038113
Energy: 0.7190006063076094
Energy: 0.42536760915038113
Energy: 0.5010163182002657
Energy: 0.4266670409592727
Energy: 0.716831824459587
Energy: 0.4266670409592727
Energy: 0.6466455549310864
Energy: 0.4254287197852783
Energy: 0.7183719411406552
Energy: 0.4254287197852783
Energy: 0.6704292774190279
Energy: 0.499378478395256
Energy: 0.5337369917969542
Energy: 0.49937847839388877
Energy: 0.7062716935186728
Energy: 0.4980967502866515
Energy: 0.5212715437383075
Energy: 0.4980967502866515
Energy: 0.6728953173772901
Energy: 0.47059829984653645
Energy: 0.5328415054024287
Energy: 0.47059829984516915
Energy: 0.6721449047038995
Energy: 0.4717044586904386
Energy: 0.47060622805316316
Energy: 0.4717044586904386
Energy: 0.7525423457741277
Energy: 0.4707760691897914
Energy: 0.4701094483481466
Energy: 0.4707760691897914
Energy: 0.7659170243610184
Energy: 0.4981098227139104
Energy: 0.497363741457257
Energy: 0.4981098227139104

minimum gb energy = 0.42536760915038113 eV
minimum distance =  2.57779231240866 Angstroms
sigma value = 13


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

Energy: 0.7269200821461478
Energy: 0.42554738038677864
Energy: 0.43021254194755865
Energy: 0.4255471327598486
Energy: 0.6579902184544402
Energy: 0.42619950126916745
Energy: 0.5149955148768964
Energy: 0.4261995012680213
Energy: 0.6851176906243492
Energy: 0.4256062749213644
Energy: 0.5016261815334421
Energy: 0.4256062749213644
Energy: 0.5622728179004952
Energy: 0.4256347349310963
Energy: 0.5969030513392131
Energy: 0.4256347349333886
Energy: 0.6781361961869405
Energy: 0.4256049538860845
Energy: 0.6267554187339524
Energy: 0.42560495388551145
Energy: 0.5045007840273078
Energy: 0.4261716622256008
Energy: 0.6263798663831005
Energy: 0.4261716622290392
Energy: 0.5021183747261678
Energy: 0.42602694215396886
Energy: 0.7551049864834752
Energy: 0.42602694215568804
Energy: 0.5145995460675522
Energy: 0.4291787613842579
Energy: 0.727119637639608
Energy: 0.429178761384831
Energy: 0.4311603700041842
Energy: 0.4270107996245614
Energy: 0.7263998544227704
Energy: 0.42701079962799976
Energy: 0.42809296827823884
Energy: 0.42605236675550784
Energy: 0.7527336384105323
Energy: 0.42605236675550784
Energy: 0.42615178842760926
Energy: 0.42724546896624227
Energy: 0.6916786439198359
Energy: 0.42724546896796145
Energy: 0.6291684420323767
Energy: 0.42611931789219004
Energy: 0.7526278769013115
Energy: 0.4261193178984938
Energy: 0.6275388317942748
Energy: 0.45113477724057655
Energy: 0.6304446383075293
Energy: 0.4511347772422957
Energy: 0.6614230859685973
Energy: 0.4529818227450152
Energy: 0.5702306542453706
Energy: 0.4529818227467344
Energy: 0.7288594305632553
Energy: 0.42690974659364306
Energy: 0.635165257129649
Energy: 0.4269097465924969
Energy: 0.7290364945615502
Energy: 0.426668770977926
Energy: 0.4260546370087803
Energy: 0.42666877097735295
Energy: 0.7563093454868812
Energy: 0.42604834483667486
Energy: 0.42841806076320565
Energy: 0.4260483448372479
Energy: 0.6860133525671512
Energy: 0.44193361022281463
Energy: 0.44148196146237534
Energy: 0.4419336102188032
Energy: 0.7668627357891257
Energy: 0.4268787429520048
Energy: 0.5187749993346963
Energy: 0.4268787429514317
Energy: 0.7284078861378064
Energy: 0.4256127956327274
Energy: 0.49609114917797675
Energy: 0.42561279562928905
Energy: 0.564425080998976
Energy: 0.4262754634178787
Energy: 0.514972497044088
Energy: 0.4262754634178787
Energy: 0.7278904300613978
Energy: 0.428815220125723
Energy: 0.6265829455919848
Energy: 0.42881522012744216
Energy: 0.5055472108890511
Energy: 0.42621942775052707
Energy: 0.6274613208800072
Energy: 0.42621942775224625
Energy: 0.42857448741910054
Energy: 0.4258078282785418
Energy: 0.731155077285409
Energy: 0.42580782827739566
Energy: 0.5150481903966277
Energy: 0.4266218532336628
Energy: 0.7280721703894368
Energy: 0.426621853235382
Energy: 0.4472361003367173
Energy: 0.42684771134078325
Energy: 0.7271719973672036
Energy: 0.4268477113442216
Energy: 0.42598485799315433
Energy: 0.4257939973015912
Energy: 0.7512404055916855
Energy: 0.4257939973061757
Energy: 0.4262189378558888
Energy: 0.42700393316727925
Energy: 0.6874888824859872
Energy: 0.4270039331718377
Energy: 0.6311808163823883
Energy: 0.42649709416307013
Energy: 0.7666990492800716
Energy: 0.4264970941693737
Energy: 0.4950201712346366
Energy: 0.4534854626653099
Energy: 0.6335002950159109
Energy: 0.45348546266989437
Energy: 0.634581886316395
Energy: 0.45575177046223053
Energy: 0.5635739788293253
Energy: 0.4557517704593652
Energy: 0.7290748850823189
Energy: 0.4269018313632863
Energy: 0.6328307737532489
Energy: 0.42690183136672466
Energy: 0.7290476549272235
Energy: 0.42696904622506393
Energy: 0.42771458533905926
Energy: 0.4269690462227717
Energy: 0.7521485407583437
Energy: 0.4256609254774693
Energy: 0.42626913574889297
Energy: 0.42566092548033463
Energy: 0.7730963645656873
Energy: 0.44213395123374793
Energy: 0.4413989227672396
Energy: 0.4421339512326018

minimum gb energy = 0.4255471327598486 eV
minimum distance =  2.59335766256942 Angstroms
sigma value = 37


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

Energy: 0.6301296688964878
Energy: 0.39150026172041485
Energy: 0.3916087137341325
Energy: 0.3915002617430913
Energy: 0.6989595086256988
Energy: 0.3919883934707624
Energy: 0.5133187562466743
Energy: 0.3919883934717484
Energy: 0.6243193620634118
Energy: 0.391759828235036
Energy: 0.5116341792283623
Energy: 0.39175982823700783
Energy: 0.6238527541755902
Energy: 0.3913475513541452
Energy: 0.6429779873836684
Energy: 0.39134755135315924
Energy: 0.6434424008282216
Energy: 0.4419498176841529
Energy: 0.5066992347104698
Energy: 0.441949817683167
Energy: 0.46347017529455586
Energy: 0.39224320854117717
Energy: 0.6991608172312284
Energy: 0.39224320854117717
Energy: 0.3889189277633315
Energy: 0.39152354425113123
Energy: 0.69819225736118
Energy: 0.39152354425113123
Energy: 0.5115101065325584
Energy: 0.39236452052926485
Energy: 0.6951020780786523
Energy: 0.39236452052926485
Energy: 0.39200331094103674
Energy: 0.3925626435308724
Energy: 0.6946166154155051
Energy: 0.3925626435308724
Energy: 0.39213432352755834
Energy: 0.39187564101974887
Energy: 0.7703989271595656
Energy: 0.39187564101974887
Energy: 0.3916087239655379
Energy: 0.3915002606679092
Energy: 0.6301296688964878
Energy: 0.39150026072211314
Energy: 0.5133187562456883
Energy: 0.3919883934707624
Energy: 0.7703586171643714
Energy: 0.3919883934707624
Energy: 0.5116341792293483
Energy: 0.3917598282360219
Energy: 0.6243193620634118
Energy: 0.3917598282360219
Energy: 0.6429779873836684
Energy: 0.3913475513541452
Energy: 0.6238527541746043
Energy: 0.3913475513541452
Energy: 0.5066992347104698
Energy: 0.441949817683167
Energy: 0.6434424008272356
Energy: 0.441949817683167
Energy: 0.6540834811844413
Energy: 0.39224320854117717
Energy: 0.38884239988844416
Energy: 0.39224320854117717
Energy: 0.698192257362166
Energy: 0.39152354425113123
Energy: 0.3889189277633315
Energy: 0.39152354425113123
Energy: 0.6951020780776664
Energy: 0.39236452052926485
Energy: 0.5115101065345303
Energy: 0.39236452052926485
Energy: 0.694616615416491
Energy: 0.39256264352988646
Energy: 0.3920033109420227
Energy: 0.39256264352988646
Energy: 0.7660095626504834
Energy: 0.39187564101876293
Energy: 0.3921343235285443
Energy: 0.39187564101876293

minimum gb energy = 0.38884239988844416 eV
minimum distance =  2.59944149369357 Angstroms
sigma value = 25


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

Energy: 0.7511894434349394
Energy: 0.36076672970038737
Energy: 0.360594153233898
Energy: 0.36076672572645535
Energy: 0.7331454941986566
Energy: 0.3615152182535401
Energy: 0.4606691136236889
Energy: 0.3615152182527702
Energy: 0.6681327467126574
Energy: 0.3612059365424362
Energy: 0.4511192054555824
Energy: 0.3612059365432061
Energy: 0.5314928240277577
Energy: 0.36205879290921206
Energy: 0.600452200332257
Energy: 0.36205879291229165
Energy: 0.6801109972283235
Energy: 0.4806973272722633
Energy: 0.6132333050487445
Energy: 0.48069732727303316
Energy: 0.5525486977673709
Energy: 0.5700591067581626
Energy: 0.6127629196741475
Energy: 0.5700591067573927
Energy: 0.5349490982961819
Energy: 0.48086843535957885
Energy: 0.7346973397203046
Energy: 0.48086843535957885
Energy: 0.6006922183371771
Energy: 0.3622774683872266
Energy: 0.6043875904191077
Energy: 0.36227746838799646
Energy: 0.4590360246975928
Energy: 0.47025029343514924
Energy: 0.7338503706965038
Energy: 0.47025029343437935
Energy: 0.4607566275509292
Energy: 0.3615457521343271
Energy: 0.8009310810360298
Energy: 0.3615457521343271
Energy: 0.3615221965705982
Energy: 0.36389894321464056
Energy: 0.6436674368610737
Energy: 0.3638989432154105
Energy: 0.3644855390402222
Energy: 0.36080795631059004
Energy: 0.8010125525490018
Energy: 0.36080795631059004
Energy: 0.36142554780933267
Energy: 0.3612930339633238
Energy: 0.7963878225580605
Energy: 0.3612930339633238
Energy: 0.4476040028262767
Energy: 0.36211823564972045
Energy: 0.6672376002467406
Energy: 0.36211823564972045
Energy: 0.4501751371796566
Energy: 0.3608980554214707
Energy: 0.7984622025380667
Energy: 0.36089805542224057
Energy: 0.46172001651049555
Energy: 0.3614106010304829
Energy: 0.6691864644661116
Energy: 0.3614106010304829
Energy: 0.612032576491037
Energy: 0.36222489835330635
Energy: 0.6724367879889083
Energy: 0.3622248983563859
Energy: 0.4466987096943491
Energy: 0.4791757062676589
Energy: 0.6792766375977637
Energy: 0.4791757062676589
Energy: 0.6137232072179654
Energy: 0.5708671340360819
Energy: 0.5475738731136044
Energy: 0.5708671340353121
Energy: 0.7330196778552269
Energy: 0.4797424127216442
Energy: 0.551881282002642
Energy: 0.4797424127224141
Energy: 0.6047167728064019
Energy: 0.36232389244573526
Energy: 0.45882282330297713
Energy: 0.3623238924472751
Energy: 0.7335167429362118
Energy: 0.36063820831012183
Energy: 0.3617936570285223
Energy: 0.36063820830935195
Energy: 0.7319293784293915
Energy: 0.3615028590485761
Energy: 0.4593178739260209
Energy: 0.36150285904780627
Energy: 0.6036283575250099
Energy: 0.36335623990718124
Energy: 0.3618693181960692
Energy: 0.36335623990718124
Energy: 0.797581517952162
Energy: 0.3605147703188872
Energy: 0.3615044572649348
Energy: 0.36051477031811724
Energy: 0.6689820917132457
Energy: 0.3619337551233212
Energy: 0.36403882678618654
Energy: 0.3619337551233212

minimum gb energy = 0.36051477031811724 eV
minimum distance =  2.59843371687748 Angstroms
sigma value = 41


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

Energy: 0.8257055150144891
Energy: 0.3352328764169535
Energy: 0.3353481044814016
Energy: 0.3352380596089018
Energy: 0.756535487138923
Energy: 0.3358212795959952
Energy: 0.4104629759131451
Energy: 0.3358212795966264
Energy: 0.6999745389747536
Energy: 0.33649647196754084
Energy: 0.4098850875923962
Energy: 0.336496471968172
Energy: 0.5998451706340576
Energy: 0.3357728897834256
Energy: 0.534324731480899
Energy: 0.33577288978658154
Energy: 0.7084227283447332
Energy: 0.44450477362761326
Energy: 0.5485967432531802
Energy: 0.44450477362508856
Energy: 0.5945359146462442
Energy: 0.5263090959314958
Energy: 0.5479007532972592
Energy: 0.5263090959308646
Energy: 0.5974126168882022
Energy: 0.5341606139681437
Energy: 0.6548575079659904
Energy: 0.5341606139675125
Energy: 0.6083834649607691
Energy: 0.44402330012188007
Energy: 0.5368736865404836
Energy: 0.44402330012188007
Energy: 0.47644508903120675
Energy: 0.5296352045171313
Energy: 0.6486876037853728
Energy: 0.5296352045171313
Energy: 0.4882976659966019
Energy: 0.44468321954201434
Energy: 0.7565476498638852
Energy: 0.4446832195439079
Energy: 0.40587175263813446
Energy: 0.3361918244810308
Energy: 0.6476046659957954
Energy: 0.3361918244797684
Energy: 0.40512524814079903
Energy: 0.33566810967360944
Energy: 0.7566161985947093
Energy: 0.3356681096748718
Energy: 0.42326496894291327
Energy: 0.33627115910730065
Energy: 0.7563711435791809
Energy: 0.33627115910730065
Energy: 0.33596697289155886
Energy: 0.3368706277777828
Energy: 0.6553217368181546
Energy: 0.33687062777652044
Energy: 0.3370682718073886
Energy: 0.3362504356566531
Energy: 0.8157304163232877
Energy: 0.3362504356579154
Energy: 0.3358605603853516
Energy: 0.3360509767060003
Energy: 0.7015926118903055
Energy: 0.33605097670536915
Energy: 0.4056868766030813
Energy: 0.33665484624346365
Energy: 0.7052663708205414
Energy: 0.3366548462409677
Energy: 0.4044737663328326
Energy: 0.33510373445500896
Energy: 0.760335536646572
Energy: 0.33510373445437786
Energy: 0.40440047159564824
Energy: 0.3366423628731629
Energy: 0.5961576731286287
Energy: 0.3366423628781836
Energy: 0.553707309587749
Energy: 0.3369669066486785
Energy: 0.5942577360252114
Energy: 0.33696690664489143
Energy: 0.5399251849396234
Energy: 0.44331430387091536
Energy: 0.6533938468658689
Energy: 0.44331430387217774
Energy: 0.5346878022961038
Energy: 0.44399366227386433
Energy: 0.5991467101965502
Energy: 0.44399366227386433
Energy: 0.6486773918631196
Energy: 0.5422593758258907
Energy: 0.5949733646665928
Energy: 0.5422593758258907
Energy: 0.5365311621489527
Energy: 0.4442275859190963
Energy: 0.5524904821521077
Energy: 0.44422758591846506
Energy: 0.6526965976269234
Energy: 0.4437290404092561
Energy: 0.4732163757337211
Energy: 0.4437290404079937
Energy: 0.6485846424585283
Energy: 0.3366097462981431
Energy: 0.5363062460158547
Energy: 0.33660974629688073
Energy: 0.6518998338435901
Energy: 0.3365601341151757
Energy: 0.4187790685119794
Energy: 0.33656013411580693
Energy: 0.7620594509075282
Energy: 0.3350249331695388
Energy: 0.4057323298875682
Energy: 0.3350249331708011
Energy: 0.6505848404281452
Energy: 0.3364618610224952
Energy: 0.40547153640753536
Energy: 0.33646186102060166
Energy: 0.6491593360498082
Energy: 0.3359066317107005
Energy: 0.33610097712187803
Energy: 0.3359066317107005
Energy: 0.8129938276954415
Energy: 0.335795327413247
Energy: 0.33677213217412244
Energy: 0.3357953274126159
Energy: 0.699026282313464
Energy: 0.33652267698605304
Energy: 0.3362214496927897
Energy: 0.3365226769873154

minimum gb energy = 0.3350249331695388 eV
minimum distance =  2.5933340818054 Angstroms
sigma value = 15


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

Energy: 0.7166912614329563
Energy: 0.3154915452201674
Energy: 0.315897189129102
Energy: 0.3157151108894458
Energy: 0.7732553650112333
Energy: 0.3145391498252801
Energy: 0.3774982341730439
Energy: 0.3145391498252801
Energy: 0.724310208281595
Energy: 0.3174064329468885
Energy: 0.3771830766999861
Energy: 0.3174064329458191
Energy: 0.6348489794312294
Energy: 0.3174455417757016
Energy: 0.48899066926484513
Energy: 0.3174455417719588
Energy: 0.7339763041729567
Energy: 0.41142299044441394
Energy: 0.49571461487915586
Energy: 0.41142299044601804
Energy: 0.6279864009116871
Energy: 0.4877007220817257
Energy: 0.4989046993373434
Energy: 0.48770072208332976
Energy: 0.5388924423009488
Energy: 0.4954051261147585
Energy: 0.5921493167274423
Energy: 0.4954051261142238
Energy: 0.637668532944642
Energy: 0.5056761709419824
Energy: 0.4869325750410672
Energy: 0.5056761709414477
Energy: 0.5385253077711473
Energy: 0.49987911862080325
Energy: 0.5851088795515371
Energy: 0.49987911862240725
Energy: 0.5378900349476924
Energy: 0.5028791638851526
Energy: 0.6777767190768782
Energy: 0.5028791638851526
Energy: 0.48631013002185675
Energy: 0.41207599045397564
Energy: 0.5917940547026135
Energy: 0.4120759904507675
Energy: 0.42970009482224003
Energy: 0.489591430460864
Energy: 0.6781207250206666
Energy: 0.48959143046032927
Energy: 0.5003260067443019
Energy: 0.41162193701583044
Energy: 0.6762877119630998
Energy: 0.4116219370163651
Energy: 0.3780239913408769
Energy: 0.3178232882123654
Energy: 0.5874138613711097
Energy: 0.3178232882123654
Energy: 0.37321807001950397
Energy: 0.31603685273382354
Energy: 0.7738066813483172
Energy: 0.3160368527354277
Energy: 0.38002301349918033
Energy: 0.3153846479800792
Energy: 0.6782278308777976
Energy: 0.31538464797847504
Energy: 0.3156489048963866
Energy: 0.31533133283735426
Energy: 0.6814249745667211
Energy: 0.31533133283681963
Energy: 0.3146018955699103
Energy: 0.31456212505325454
Energy: 0.8234418793035377
Energy: 0.31456212505165043
Energy: 0.3152467315642851
Energy: 0.3157193841242975
Energy: 0.6309668567673801
Energy: 0.3157193841242975
Energy: 0.3824391126921919
Energy: 0.31540495810748176
Energy: 0.727891252767926
Energy: 0.31540495810748176
Energy: 0.3712948198498388
Energy: 0.31662082022527427
Energy: 0.7763888272838199
Energy: 0.31662082022367016
Energy: 0.37178689398879383
Energy: 0.3172974964099634
Energy: 0.6335536708553605
Energy: 0.317297496408894
Energy: 0.4999560479985138
Energy: 0.41137481065273424
Energy: 0.628248129387891
Energy: 0.4113748106521995
Energy: 0.4870624698942737
Energy: 0.4895561008209008
Energy: 0.6804000963695207
Energy: 0.48955610082143547
Energy: 0.4895997359705216
Energy: 0.4107644059094425
Energy: 0.5425941847839586
Energy: 0.4107644059094425
Energy: 0.5835389968561194
Energy: 0.5024259478048767
Energy: 0.6783803263773425
Energy: 0.5024259478059461
Energy: 0.4866514949404918
Energy: 0.49755793720773206
Energy: 0.5872747929115619
Energy: 0.49755793720559316
Energy: 0.6372697709974294
Energy: 0.5005824710863933
Energy: 0.5422998955006272
Energy: 0.5005824710863933
Energy: 0.584922228374622
Energy: 0.49556562758473377
Energy: 0.5902038008913639
Energy: 0.49556562758312966
Energy: 0.5841196645478475
Energy: 0.49339877900623086
Energy: 0.49020777855085773
Energy: 0.4933987790056962
Energy: 0.7328688544730683
Energy: 0.4124978804108468
Energy: 0.4299784084689444
Energy: 0.4124978804119162
Energy: 0.5871883083026492
Energy: 0.31825839458892374
Energy: 0.49426083730726744
Energy: 0.3182583945873197
Energy: 0.6764527825523047
Energy: 0.3163916209394108
Energy: 0.38959755980236493
Energy: 0.3163916209399455
Energy: 0.7305587568484984
Energy: 0.31477837528184865
Energy: 0.3883342511400783
Energy: 0.3147783752813139
Energy: 0.6762554618454818
Energy: 0.3159294509990226
Energy: 0.3746491437530288
Energy: 0.3159294509979532
Energy: 0.7725274895802001
Energy: 0.3151907707865401
Energy: 0.31973368491830284
Energy: 0.3151907707870748
Energy: 0.7235169178109038
Energy: 0.3153743133272401
Energy: 0.31960976961862
Energy: 0.3153743133277748

minimum gb energy = 0.3145391498252801 eV
minimum distance =  2.58622027297983 Angstroms
sigma value = 85


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

Energy: 0.7929610905124884
Energy: 0.43796602321385936
Energy: 0.28569526277179064
Energy: 0.43796602295846304
Energy: 0.776961774012171
Energy: 0.28583347010293825
Energy: 0.3356926937056154
Energy: 0.2858334701043294
Energy: 0.6657277224221528
Energy: 0.2864772229685304
Energy: 0.3355712237355213
Energy: 0.28647722297038547
Energy: 0.5810542226656593
Energy: 0.2866466994283129
Energy: 0.43699440477052764
Energy: 0.28664669942645793
Energy: 0.7599324837721574
Energy: 0.3731419491642938
Energy: 0.43568928865753004
Energy: 0.37314194916383003
Energy: 0.5809855494083668
Energy: 0.3735851862371332
Energy: 0.4412031845831398
Energy: 0.37358518623527825
Energy: 0.584245081083958
Energy: 0.42070565970223023
Energy: 0.523224173682212
Energy: 0.4207056596999115
Energy: 0.6830288803255576
Energy: 0.4559933332546074
Energy: 0.45947377804399736
Energy: 0.4559933332532162
Energy: 0.5834156193732697
Energy: 0.45601761674033137
Energy: 0.5247587825806321
Energy: 0.4560176167426501
Energy: 0.5825282219903787
Energy: 0.4619060738102183
Energy: 0.606834727280445
Energy: 0.4619060738102183
Energy: 0.5242817394404842
Energy: 0.4542363180438618
Energy: 0.5407941584337932
Energy: 0.4542363180429343
Energy: 0.503290801219223
Energy: 0.4536377281935318
Energy: 0.6072296005454337
Energy: 0.45363772819445936
Energy: 0.5252485006237576
Energy: 0.4557236351677543
Energy: 0.6237226019033822
Energy: 0.4557236351668268
Energy: 0.43104556595833343
Energy: 0.33870892659595886
Energy: 0.5404899617073295
Energy: 0.3387089265945676
Energy: 0.4103171256858171
Energy: 0.337664723179871
Energy: 0.6929183677754386
Energy: 0.3376647231812622
Energy: 0.4415523720066375
Energy: 0.3386173889881943
Energy: 0.6235513570995465
Energy: 0.33861738898726684
Energy: 0.3365010357930167
Energy: 0.33100917397710306
Energy: 0.622733247098025
Energy: 0.33100917397803054
Energy: 0.33674705132235155
Energy: 0.33135380883048965
Energy: 0.7774750313174852
Energy: 0.3313538088286347
Energy: 0.3365690371098625
Energy: 0.332661709336282
Energy: 0.7085954500011781
Energy: 0.33266170933813693
Energy: 0.3098797325967856
Energy: 0.28664373851889124
Energy: 0.708649062137467
Energy: 0.286643738519355
Energy: 0.3091608787146669
Energy: 0.2839261500621954
Energy: 0.8001456093814686
Energy: 0.2839261500621954
Energy: 0.31038882063331397
Energy: 0.2856932689604674
Energy: 0.6432317459465748
Energy: 0.2856932689600036
Energy: 0.3652701324229619
Energy: 0.28448546405368336
Energy: 0.73264204381314
Energy: 0.28448546405368336
Energy: 0.3610802537129273
Energy: 0.2854882325001186
Energy: 0.7327983278158924
Energy: 0.2854882324982847
Energy: 0.3602042936892848
Energy: 0.2860912149471697
Energy: 0.5810496270537389
Energy: 0.2860912149925956
Energy: 0.4371562180720565
Energy: 0.4142008154423821
Energy: 0.7538115955236834
Energy: 0.4142008154423821
Energy: 0.4352691689893901
Energy: 0.4142817417733468
Energy: 0.6673296387085819
Energy: 0.4142817417742743
Energy: 0.5189285389308149
Energy: 0.42542736495855527
Energy: 0.5809140585384578
Energy: 0.42542736495901895
Energy: 0.5199925949068923
Energy: 0.4255839921222156
Energy: 0.6911450248408896
Energy: 0.4255839921222156
Energy: 0.5202940638743422
Energy: 0.45271586460371016
Energy: 0.5822060636180727
Energy: 0.45271586460417385
Energy: 0.605971568941089
Energy: 0.45621649090809235
Energy: 0.5029634696993758
Energy: 0.45621649090670113
Energy: 0.5406401024860269
Energy: 0.46031099465416864
Energy: 0.6043456775656924
Energy: 0.4603109946546323
Energy: 0.6061100039981914
Energy: 0.4537612169545498
Energy: 0.5016410768877516
Energy: 0.4537612169531585
Energy: 0.6916250908742836
Energy: 0.45610828498001416
Energy: 0.5016245168026002
Energy: 0.4561082849804779
Energy: 0.5405916078697588
Energy: 0.3748511430228483
Energy: 0.5343556212072507
Energy: 0.3748511430228483
Energy: 0.6914576501356984
Energy: 0.3743994419387598
Energy: 0.4355613232404349
Energy: 0.37439944194107855
Energy: 0.7097588353994562
Energy: 0.37286608668225985
Energy: 0.43595162178330527
Energy: 0.37286608667947735
Energy: 0.6226871465296537
Energy: 0.286797074020298
Energy: 0.33552999829335867
Energy: 0.2867970740207617
Energy: 0.776864848998388
Energy: 0.28677318146714054
Energy: 0.3361112021058736
Energy: 0.2867731814643581
Energy: 0.7107726699309249
Energy: 0.2868154306285562
Energy: 0.3384135638612827
Energy: 0.28681543062623743
Energy: 0.6226434618628941
Energy: 0.2873790829916272
Energy: 0.2857814442173881
Energy: 0.2873790829920909
Energy: 0.8198586538759773
Energy: 0.2859780315182195
Energy: 0.28624629715063543
Energy: 0.2859780315163644
Energy: 0.6651133316441058
Energy: 0.28707231811172784
Energy: 0.2858806499548449
Energy: 0.2870723181121917

minimum gb energy = 0.2839261500621954 eV
minimum distance =  2.58953782559507 Angstroms
sigma value = 113


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

Energy: 0.0117852852934609
Energy: 0.3641160560159348
Energy: 0.67364063120627
Energy: 0.3641160560162912
Energy: 0.37752362618960583
Energy: 0.06954732987624823
Energy: 0.37831209927952353
Energy: 0.06954732987624823
Energy: 0.01212686238856094
Energy: 0.06812109945798912
Energy: 0.3772169049675745
Energy: 0.06812109945763262
Energy: 0.013208065449739887
Energy: 0.06753370097390145
Energy: 0.3772156661800567
Energy: 0.06753370097354496
Energy: 0.3799775413465621
Energy: 0.06822157987456896
Energy: 0.3770778892640479
Energy: 0.06822157987387577
Energy: 0.012193649115556354
Energy: 0.06826581111990686
Energy: 0.3769422672591769
Energy: 0.06826581111990686

minimum gb energy = 0.0117852852934609 eV
minimum distance =  2.81498912413854 Angstroms
sigma value = 1