Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Al__MO_519613893196_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
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=180.0
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: 0.010419329734600802
Energy: 0.25178684275715596
Energy: 0.010753269804043635
Energy: 0.01054959883266875
Energy: 0.25105686044314945
Energy: 0.010699344647609325
Energy: 0.25178684275715596
Energy: 0.06484153010170074
Energy: 0.06490544044821639
Energy: 0.0648757612851067
Energy: 0.06527036197978026
Energy: 0.06494632732048224
Energy: 0.010753269804043635
Energy: 0.0649054404477122
Energy: 0.06553446777574704
Energy: 0.010764375795095826
Energy: 0.06480052491347241
Energy: 0.06523887506935434
Energy: 0.01054959883266875
Energy: 0.06487576128463055
Energy: 0.010764375795095826
Energy: 0.010633297780389534
Energy: 0.06481949631119645
Energy: 0.010729940564153315
Energy: 0.2510568604428974
Energy: 0.06527036197955616
Energy: 0.06480052491322032
Energy: 0.06481949631119645
Energy: 0.06471686946288072
Energy: 0.0648025855125708
Energy: 0.010699344647609325
Energy: 0.06494632732048224
Energy: 0.06523887506935434
Energy: 0.010729940563901218
Energy: 0.0648025855125708
Energy: 0.01081885393243312

minimum gb energy = 0.010419329734600802 eV
minimum distance =  2.84539444941926 Angstroms
sigma value = 1


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

Energy: 0.6959418904394986
Energy: 0.7080728287849928
Energy: 0.48461908037461354
Energy: 0.4441951361523811
Energy: 0.70806422228126
Energy: 0.48229480880550746
Energy: 0.6512981992198907
Energy: 0.47972976581180127
Energy: 0.46027374774494473
Energy: 0.4594971650220964
Energy: 0.47968158544309386
Energy: 0.4659383436820741
Energy: 0.6651091318611035
Energy: 0.46167454721512247
Energy: 0.4448557696332359
Energy: 0.4697733834308345
Energy: 0.4804845046393717
Energy: 0.4570779116135306
Energy: 0.7240265104599766
Energy: 0.4561423304190359
Energy: 0.45642793777415325
Energy: 0.4569719829275139
Energy: 0.4561100248947368
Energy: 0.4566658216599884
Energy: 0.6528825045788367
Energy: 0.4742860383283656
Energy: 0.47404789852413337
Energy: 0.46077284907360694
Energy: 0.47339777193596383
Energy: 0.46735547707308606
Energy: 0.6450315202833532
Energy: 0.4735379352770976
Energy: 0.4672150934873389
Energy: 0.46670421571037024
Energy: 0.47430233532654936
Energy: 0.46780900783739343
Energy: 0.644343067331334
Energy: 0.46762787573011555
Energy: 0.46769796119709744
Energy: 0.46650570269521213
Energy: 0.46070092651359745
Energy: 0.4666555065377735
Energy: 0.609918043570532
Energy: 0.47188455956630876
Energy: 0.47157738662283444
Energy: 0.43937145468974764
Energy: 0.468774101288565
Energy: 0.46717204360786285
Energy: 0.519273624286887
Energy: 0.4671007926869151
Energy: 0.4676375625982438
Energy: 0.47449880253398363
Energy: 0.4602648890573618
Energy: 0.4661640206038782
Energy: 0.5159785655444343
Energy: 0.47155808919383774
Energy: 0.47097701066552683
Energy: 0.4734426116289692
Energy: 0.4721453327392163
Energy: 0.47229092525109506
Energy: 0.5419983291716038
Energy: 0.45971447271934424
Energy: 0.46061124662251784
Energy: 0.506367779255252
Energy: 0.4595440270039029
Energy: 0.45088249885457116
Energy: 0.4801497152186444
Energy: 0.452221306890853
Energy: 0.45678614189875605
Energy: 0.48039481841265896
Energy: 0.46885460733004053
Energy: 0.4439448837925401
Energy: 0.479193909189979
Energy: 0.46669348101998853
Energy: 0.46591170330650505
Energy: 0.47923584283662424
Energy: 0.472008080386151
Energy: 0.4433886394748217
Energy: 0.491083881147779
Energy: 0.4565760882090809
Energy: 0.4563456050633587
Energy: 0.46649318141818635
Energy: 0.45658021247341574
Energy: 0.45663607474764634
Energy: 0.4911128410092941
Energy: 0.470917840889024
Energy: 0.47079757754294266
Energy: 0.4794225866930051
Energy: 0.46128588910604734
Energy: 0.4648243194501423
Energy: 0.4905341532362442
Energy: 0.45630339503849277
Energy: 0.4567080583303711
Energy: 0.4788746218308492
Energy: 0.45204239562046306
Energy: 0.45716398510451955
Energy: 0.5712977599734343
Energy: 0.4655816419045737
Energy: 0.4656358097949231
Energy: 0.4571150137575795
Energy: 0.4655235727828488
Energy: 0.45686649557001346
Energy: 0.5733466971071454
Energy: 0.4717355755041138
Energy: 0.47066134285667427
Energy: 0.47065425719260673
Energy: 0.46510768306606276
Energy: 0.47059812367651566
Energy: 0.574568907093269
Energy: 0.47155783988930167
Energy: 0.47044288003880796
Energy: 0.47058831543302604
Energy: 0.4707527700627404
Energy: 0.4703202522746066
Energy: 0.6576883620856714
Energy: 0.47192639719022017
Energy: 0.47068966674138163
Energy: 0.45423707845084654
Energy: 0.4706663859289804
Energy: 0.47030124890708613
Energy: 0.6810082055785008
Energy: 0.4455226488495709
Energy: 0.45944993740401924
Energy: 0.4599208177720642
Energy: 0.4563562431060631
Energy: 0.459576410125537
Energy: 0.6817234507200447
Energy: 0.46952367271332857
Energy: 0.46099969828828596
Energy: 0.47201831612648193
Energy: 0.4786183186965256
Energy: 0.45652615653906436
Energy: 0.6851084441512291
Energy: 0.4643278795683245
Energy: 0.44776312884557373
Energy: 0.47049269142869365
Energy: 0.46436939697263124
Energy: 0.47135574875622327

minimum gb energy = 0.43937145468974764 eV
minimum distance =  2.62919752999191 Angstroms
sigma value = 33


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

Energy: 0.8728964776548129
Energy: 0.4927111104770876
Energy: 0.47794955893624114
Energy: 0.4834821561696965
Energy: 0.5068374115123646
Energy: 0.48331741455933813
Energy: 0.6185523856671281
Energy: 0.49835951724229954
Energy: 0.4983691767515901
Energy: 0.4875148182677539
Energy: 0.4984568351720004
Energy: 0.4704443648694929
Energy: 0.6954437511685748
Energy: 0.49884123349242543
Energy: 0.48827310890310865
Energy: 0.48344210311123886
Energy: 0.49861793483674843
Energy: 0.46176161819253697
Energy: 0.6982480793011612
Energy: 0.48383722168710236
Energy: 0.48340736309039545
Energy: 0.4636969467245962
Energy: 0.5027172531468093
Energy: 0.46364919029172164
Energy: 0.6178989432095564
Energy: 0.4971737644680114
Energy: 0.4971392435081756
Energy: 0.49303457171252346
Energy: 0.49727736220509594
Energy: 0.4976286908961675
Energy: 0.6702867853715245
Energy: 0.49624753880267786
Energy: 0.4809702998273777
Energy: 0.4845498346606904
Energy: 0.49705077708161266
Energy: 0.4811383514703943
Energy: 0.6691416815015845
Energy: 0.48371900522117744
Energy: 0.48177238683000095
Energy: 0.4843504811144201
Energy: 0.47509199379459516
Energy: 0.47985440462457296
Energy: 0.6164311869041967
Energy: 0.483239781605555
Energy: 0.483440102836201
Energy: 0.5102816902129274
Energy: 0.4838369704022306
Energy: 0.4836926956114936
Energy: 0.5317739551310734
Energy: 0.4834393212825871
Energy: 0.48734411350201895
Energy: 0.4996035363673873
Energy: 0.4827562023951949
Energy: 0.4899230110508717
Energy: 0.5312516001155867
Energy: 0.48915344346838713
Energy: 0.4938263350667372
Energy: 0.4956543678488743
Energy: 0.49391840039882756
Energy: 0.4896231975030668
Energy: 0.5478160372906103
Energy: 0.4507295745701739
Energy: 0.4501795730308471
Energy: 0.48679068911172685
Energy: 0.45512183308155085
Energy: 0.450013177326171
Energy: 0.5006685864438981
Energy: 0.46269784735082436
Energy: 0.47275315499117293
Energy: 0.4956958915751074
Energy: 0.48355220526713905
Energy: 0.4670101686714238
Energy: 0.49922064569462926
Energy: 0.48642386999976067
Energy: 0.4874906581261502
Energy: 0.4954952466436674
Energy: 0.4883488086105489
Energy: 0.48051811184062415
Energy: 0.565689740978115
Energy: 0.46357543609070206
Energy: 0.4550496110737071
Energy: 0.49390825221780327
Energy: 0.4631306726974168
Energy: 0.448768335456116
Energy: 0.5401692769951342
Energy: 0.48858119878334944
Energy: 0.4719115029023786
Energy: 0.48068016703321753
Energy: 0.4898908895586192
Energy: 0.49195285613868206
Energy: 0.5413629516021382
Energy: 0.460638691642081
Energy: 0.4729775303489657
Energy: 0.4796011923682198
Energy: 0.450128924069437
Energy: 0.4742927890348593
Energy: 0.5440159088513952
Energy: 0.4426943923235701
Energy: 0.4434776966110986
Energy: 0.45147343259668715
Energy: 0.44054570859773357
Energy: 0.460114211346753
Energy: 0.6016556648954472
Energy: 0.4819718150387334
Energy: 0.48181154425705575
Energy: 0.4832791738573948
Energy: 0.4890328533781194
Energy: 0.4842630059948204
Energy: 0.6020358628089137
Energy: 0.4961362529750585
Energy: 0.4869836441806532
Energy: 0.48276602211817404
Energy: 0.49593711001079926
Energy: 0.4868996001451373
Energy: 0.5437100840428104
Energy: 0.48340994582662694
Energy: 0.48269971563828495
Energy: 0.47880880070295445
Energy: 0.4751447823842248
Energy: 0.48448016243234926
Energy: 0.7368241062311418
Energy: 0.4398983750176711
Energy: 0.43969157602310494
Energy: 0.43976843556025036
Energy: 0.46370067755704103
Energy: 0.4396675058794622
Energy: 0.7320271423876269
Energy: 0.4609031621646048
Energy: 0.4404136564158791
Energy: 0.480930129477835
Energy: 0.4592066272464398
Energy: 0.4371211829483968
Energy: 0.5432960823400326
Energy: 0.4803527459757632
Energy: 0.4904750561604538
Energy: 0.47718568727899363
Energy: 0.47964498702428876
Energy: 0.4576186930746755
Energy: 0.7106323088686763
Energy: 0.5271107009868833
Energy: 0.4883111476188577
Energy: 0.44864767170594494
Energy: 0.5274878805485469
Energy: 0.4690169868751841
Energy: 0.5433020777792681
Energy: 0.488987514279936
Energy: 0.4883388153028649
Energy: 0.46072093358589566
Energy: 0.4699645127643408
Energy: 0.4876287373979537
Energy: 0.6739824613276388
Energy: 0.49615660432088315
Energy: 0.475561974950822
Energy: 0.47298348241692345
Energy: 0.49591864111797995
Energy: 0.47340479260487855
Energy: 0.672351170404779
Energy: 0.4767874478623149
Energy: 0.47413737174500703
Energy: 0.4714636443088796
Energy: 0.4757250527139188
Energy: 0.47477179715467477
Energy: 0.6206368184760995
Energy: 0.4830763474838108
Energy: 0.4837779671914897
Energy: 0.4919632107202214
Energy: 0.4829133965244811
Energy: 0.48775030941303504
Energy: 0.5322990261219372
Energy: 0.48311976634958553
Energy: 0.48407807244296186
Energy: 0.5025087200592566
Energy: 0.4828999104544079
Energy: 0.48790226959259775
Energy: 0.5320871593392258
Energy: 0.4814704439802906
Energy: 0.48870753948187223
Energy: 0.49902585577369923
Energy: 0.4867023921977565
Energy: 0.4989434377553035
Energy: 0.5463552818430807
Energy: 0.4500434362801293
Energy: 0.4508530580949228
Energy: 0.4667049341122737
Energy: 0.4504344424023417
Energy: 0.4499829312550499
Energy: 0.49895089805813625
Energy: 0.44783426660283704
Energy: 0.44615585289574144
Energy: 0.48379938432101327
Energy: 0.4467728475859644
Energy: 0.4668211768900601
Energy: 0.49905558055012555
Energy: 0.4879189437160877
Energy: 0.4657365311783803
Energy: 0.4910765687357915
Energy: 0.4877109038012242
Energy: 0.4888422832248176
Energy: 0.4976727143884347
Energy: 0.4559845206881384
Energy: 0.4555458089947301
Energy: 0.4929874657158981
Energy: 0.44865024545068294
Energy: 0.4689544872419035
Energy: 0.5356388801950679
Energy: 0.4963785461425782
Energy: 0.47189314618304845
Energy: 0.4785520992470906
Energy: 0.48646802925936217
Energy: 0.48174539304461467
Energy: 0.5354989989943838
Energy: 0.47644899821597575
Energy: 0.4764899154737333
Energy: 0.4981346870018349
Energy: 0.4735066455482917
Energy: 0.47751805098135003
Energy: 0.5353950240714682
Energy: 0.47915937289330335
Energy: 0.4793680409050007
Energy: 0.46642276942529465
Energy: 0.4776689225947411
Energy: 0.4856337046769361
Energy: 0.6022578689312057
Energy: 0.48879396954150345
Energy: 0.49123392844324476
Energy: 0.48287417450906184
Energy: 0.4885449551498312
Energy: 0.48726227526940236
Energy: 0.601669317162305
Energy: 0.4956543629577333
Energy: 0.4910572254630464
Energy: 0.48393418410730743
Energy: 0.504833953507197
Energy: 0.48433034815293624
Energy: 0.6189427607133845
Energy: 0.5032573398166922
Energy: 0.5042937310689442
Energy: 0.49764092488880285
Energy: 0.5035712699747156
Energy: 0.4910342694738697
Energy: 0.69910585247748
Energy: 0.4819705972161638
Energy: 0.456804147818038
Energy: 0.4585845348703847
Energy: 0.481985229475452
Energy: 0.4564021849062537

minimum gb energy = 0.4371211829483968 eV
minimum distance =  2.66749606401071 Angstroms
sigma value = 51


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

Energy: 0.7217319764705121
Energy: 0.48609027545387423
Energy: 0.4600112494417481
Energy: 0.46126165884681186
Energy: 0.4936666811832453
Energy: 0.4933829322238519
Energy: 0.5549889034130324
Energy: 0.48590770165699043
Energy: 0.4859714539171767
Energy: 0.46017379235245026
Energy: 0.4859373884166273
Energy: 0.47071532175873493
Energy: 0.6574738702510516
Energy: 0.4863744328457656
Energy: 0.471181444613286
Energy: 0.46704088625036605
Energy: 0.48631505455107205
Energy: 0.45940967137504474
Energy: 0.6559418984840002
Energy: 0.45904216202963666
Energy: 0.45915448445105334
Energy: 0.46731078626559003
Energy: 0.4605436913779374
Energy: 0.4431866795457749
Energy: 0.5544856756106137
Energy: 0.49027016099728576
Energy: 0.4908910758728468
Energy: 0.46559534590544804
Energy: 0.48991997084082484
Energy: 0.4901542256956507
Energy: 0.5552153626037496
Energy: 0.4919439960593359
Energy: 0.4903149971615809
Energy: 0.49039110081315984
Energy: 0.4906104427061072
Energy: 0.48969738998070217
Energy: 0.5550168762345734
Energy: 0.4832032629388747
Energy: 0.4808067805201371
Energy: 0.4904681329863084
Energy: 0.47727609371875757
Energy: 0.4907064112431901
Energy: 0.5655293077388043
Energy: 0.45599894421828846
Energy: 0.45755915909265615
Energy: 0.4756809341754472
Energy: 0.4592817908217546
Energy: 0.4579222299041678
Energy: 0.48601513857133444
Energy: 0.45663296518195823
Energy: 0.4563289563044116
Energy: 0.4860467137389911
Energy: 0.45668660528357385
Energy: 0.4585812558032879
Energy: 0.48598986640924335
Energy: 0.4731493270845586
Energy: 0.4593552435723031
Energy: 0.48600159928322534
Energy: 0.43793938918090103
Energy: 0.48597487919298626
Energy: 0.5004662338257049
Energy: 0.45798253919133053
Energy: 0.4562316527376386
Energy: 0.5004617439913713
Energy: 0.45917616561825164
Energy: 0.45614592869741977
Energy: 0.5009549884450843
Energy: 0.47476732675999805
Energy: 0.49710014947967573
Energy: 0.4727420917867808
Energy: 0.47588032705401995
Energy: 0.47102469859582
Energy: 0.500579915736038
Energy: 0.46695646650806755
Energy: 0.46775545626692355
Energy: 0.4902689074258352
Energy: 0.4668960988141188
Energy: 0.4917298230105681
Energy: 0.501228324127015
Energy: 0.4592995926037923
Energy: 0.45941817387029305
Energy: 0.49143718902383393
Energy: 0.4593831492027019
Energy: 0.45418168741434684
Energy: 0.5893837507400977
Energy: 0.4601728434477315
Energy: 0.4660205982943511
Energy: 0.4732789133353296
Energy: 0.47195799141474704
Energy: 0.4664257901388989
Energy: 0.5912318341452993
Energy: 0.49132523105091885
Energy: 0.4701507194927681
Energy: 0.4290650857120116
Energy: 0.49187893372816915
Energy: 0.4782405979691413
Energy: 0.6136065387532676
Energy: 0.4921403073292246
Energy: 0.491524433119453
Energy: 0.4793479931955637
Energy: 0.49251433641367093
Energy: 0.4815567220466514
Energy: 0.7199139018372139
Energy: 0.4709927879081033
Energy: 0.453014268545733
Energy: 0.45662233741796254
Energy: 0.4711185951157063
Energy: 0.45288974731846715

minimum gb energy = 0.4290650857120116 eV
minimum distance =  2.655686218941 Angstroms
sigma value = 19


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

Energy: 0.6063748730870178
Energy: 0.4488858559023983
Energy: 0.4480861660083563
Energy: 0.5121737735846852
Energy: 0.44774464998356456
Energy: 0.44700990443313393
Energy: 0.5239850159811159
Energy: 0.4479557216312993
Energy: 0.4479365542521283
Energy: 0.4629939337105392
Energy: 0.44793939955307344
Energy: 0.44794598760714927
Energy: 0.5234010170943019
Energy: 0.44803076820388205
Energy: 0.44801608451804037
Energy: 0.4458295925748223
Energy: 0.44793881176303474
Energy: 0.44804166157797154
Energy: 0.5218252264941832
Energy: 0.4479616105863359
Energy: 0.4480890230646012
Energy: 0.45806806096699676
Energy: 0.44783813381743265
Energy: 0.448141034438938
Energy: 0.523922130486102
Energy: 0.44791689940458823
Energy: 0.46619106256321086
Energy: 0.46309455086074847
Energy: 0.44791062551153965
Energy: 0.46660504186484014
Energy: 0.5236140984378987
Energy: 0.43438295383756875
Energy: 0.46599231294079896
Energy: 0.4627568291066869
Energy: 0.4342455723452524
Energy: 0.4608510632120641
Energy: 0.5234757540436152
Energy: 0.4662462723899913
Energy: 0.46144398731341474
Energy: 0.4624403927123926
Energy: 0.4390667122121574
Energy: 0.46119633343280264
Energy: 0.5105504521692595
Energy: 0.42311496804730675
Energy: 0.42304430478853133
Energy: 0.5111256386920388
Energy: 0.42352855779968135
Energy: 0.42264684289027743
Energy: 0.4479719833646156
Energy: 0.4228182963870766
Energy: 0.4228924645508249
Energy: 0.4479827889434952
Energy: 0.4229158435396097
Energy: 0.43018284220906255
Energy: 0.4486321441179599
Energy: 0.44514845271506737
Energy: 0.44795742736302774
Energy: 0.44783456745132577
Energy: 0.462278449409328
Energy: 0.4479588454631825
Energy: 0.44799870711619333
Energy: 0.4578875725370224
Energy: 0.4824333310168916
Energy: 0.4483976175782147
Energy: 0.45885769538718507
Energy: 0.44855320875405863
Energy: 0.5233167321191617
Energy: 0.4623983948803385
Energy: 0.46595652924577663
Energy: 0.4479081333786959
Energy: 0.462491382693363
Energy: 0.4479443698015148
Energy: 0.43420247861967637
Energy: 0.46205218219930994
Energy: 0.46275916270427253
Energy: 0.4357614761388866
Energy: 0.4620882644932913
Energy: 0.46267063941034214
Energy: 0.523531855662518
Energy: 0.4635880125344363
Energy: 0.46270246545931254
Energy: 0.4478533120395203
Energy: 0.4636020931650218
Energy: 0.4629407584598901
Energy: 0.6076913681876248
Energy: 0.4481358251332234
Energy: 0.4450336985983874
Energy: 0.42308745742897214
Energy: 0.448004084797481
Energy: 0.430119879943602
Energy: 0.6077293165750421
Energy: 0.4484772695164614
Energy: 0.43035027529474984
Energy: 0.42276281536560145
Energy: 0.4482340703999729
Energy: 0.42298026260458127
Energy: 0.5233349443451638
Energy: 0.4480256093416109
Energy: 0.44797999928472726
Energy: 0.46213717455664843
Energy: 0.4481600862122469
Energy: 0.44788910263502985
Energy: 0.5201831853516418
Energy: 0.44809593481747595
Energy: 0.4481150870006665
Energy: 0.4576387583761795
Energy: 0.4480222703640941
Energy: 0.44806673540266534
Energy: 0.520034079500387
Energy: 0.4480804745144048
Energy: 0.448112661413388
Energy: 0.45785460992785687
Energy: 0.44797212622305027
Energy: 0.44804225642689555
Energy: 0.5236287778448833
Energy: 0.4342698940722028
Energy: 0.4670094567781974
Energy: 0.4621173046454985
Energy: 0.434184032379152
Energy: 0.46568538256475256
Energy: 0.5223026990025202
Energy: 0.4661665823797269
Energy: 0.4620290312112308
Energy: 0.46317661586074105
Energy: 0.46666526518334267
Energy: 0.46282263841943744
Energy: 0.5233657469224687
Energy: 0.4664026040868809
Energy: 0.46634063972473655
Energy: 0.46195342354829827
Energy: 0.46653949139715817
Energy: 0.4661861977664104
Energy: 0.5112763846981723
Energy: 0.4238651515261418
Energy: 0.4232300917210771
Energy: 0.5109003723749521
Energy: 0.4222559463298399
Energy: 0.4347804445265757
Energy: 0.4478828457028285
Energy: 0.4456214991242599
Energy: 0.44819840829383845
Energy: 0.4479864817150074
Energy: 0.4302018337664055
Energy: 0.4479174918456956
Energy: 0.4479257877965231
Energy: 0.44548487332574704
Energy: 0.4480279542044026
Energy: 0.4478955997615585
Energy: 0.4628220229709341
Energy: 0.44801341013132595
Energy: 0.5118454394414403
Energy: 0.458014436757693
Energy: 0.45792231171842435
Energy: 0.5116712348453322
Energy: 0.45792166019980657
Energy: 0.44813133078022693
Energy: 0.5236391810218082
Energy: 0.4629768248157971
Energy: 0.4671873966470045
Energy: 0.46646807251711553
Energy: 0.4628278460688954
Energy: 0.4662224021111047
Energy: 0.43418722830572426
Energy: 0.46194370955756153
Energy: 0.4610101948902598
Energy: 0.43424713492881134
Energy: 0.4625832439548454
Energy: 0.4657722875428587
Energy: 0.5247782503538523
Energy: 0.4620034819984572
Energy: 0.46153700789066016
Energy: 0.43929853263083407
Energy: 0.46230829074851243
Energy: 0.4608129019113544
Energy: 0.6077789271191618
Energy: 0.44797781630146855
Energy: 0.4300369651946654
Energy: 0.4234785799265435
Energy: 0.4481083556424383
Energy: 0.422847322709825

minimum gb energy = 0.4222559463298399 eV
minimum distance =  2.71411641209467 Angstroms
sigma value = 27


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

Energy: 0.5236438732315004
Energy: 0.45191829067122435
Energy: 0.5816392552370436
Energy: 0.4708031669830521
Energy: 0.4520849644220464
Energy: 0.5814804201138489
Energy: 0.5269162941159445
Energy: 0.4513046531463386
Energy: 0.451371837205231
Energy: 0.4296022235908842
Energy: 0.451176510749192
Energy: 0.42146286876510836
Energy: 0.4739553938187566
Energy: 0.4514689564097254
Energy: 0.45156997288995815
Energy: 0.41083915878341637
Energy: 0.45222912254460484
Energy: 0.4216525199532434
Energy: 0.4748367071911601
Energy: 0.45119217095074315
Energy: 0.44126730422657784
Energy: 0.4106821172031812
Energy: 0.42881962489299397
Energy: 0.41065910276876133
Energy: 0.5266505963091817
Energy: 0.3964872195510512
Energy: 0.4103512557227976
Energy: 0.44241828092766894
Energy: 0.39624278462018525
Energy: 0.41047412473789446
Energy: 0.45090451082796634
Energy: 0.396586467509639
Energy: 0.39644081971324374
Energy: 0.45090159878108016
Energy: 0.3968081322226472
Energy: 0.39663237940560014
Energy: 0.4531865867057925
Energy: 0.40983508210846237
Energy: 0.40980603707508645
Energy: 0.4519384710495856
Energy: 0.4111180220432439
Energy: 0.45275914974879616
Energy: 0.45178650787253544
Energy: 0.4086453599400303
Energy: 0.42065692915837144
Energy: 0.4518197293267651
Energy: 0.4084100169780418
Energy: 0.43005348727120823
Energy: 0.4739858204115146
Energy: 0.41086493540651836
Energy: 0.39971326463201023
Energy: 0.4516981276171409
Energy: 0.40878819939041616
Energy: 0.42108836056434923
Energy: 0.476058847214244
Energy: 0.43204688275017217
Energy: 0.41748832174167677
Energy: 0.43325439227162077
Energy: 0.41052928666688554
Energy: 0.43148475991638596
Energy: 0.4738249211752525
Energy: 0.4511633478652812
Energy: 0.4479907965846392
Energy: 0.4324458093190683
Energy: 0.4510746020184875
Energy: 0.4322892550720685
Energy: 0.4743488687262504
Energy: 0.4216208094275696
Energy: 0.4212034493999394
Energy: 0.42937814824110637
Energy: 0.4520454214395733
Energy: 0.42117697320570785

minimum gb energy = 0.39624278462018525 eV
minimum distance =  2.68015010008476 Angstroms
sigma value = 9


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

Energy: 0.8286625298950105
Energy: 0.515277369137955
Energy: 0.4768033100935401
Energy: 0.4257752754599982
Energy: 0.5152557088580916
Energy: 0.4157434696681187
Energy: 0.43576980710418567
Energy: 0.3910314952934521
Energy: 0.3914937246754799
Energy: 0.38568423712098626
Energy: 0.39124526350579275
Energy: 0.38338470795949775
Energy: 0.4064384713814891
Energy: 0.3913084980018185
Energy: 0.39128992073557145
Energy: 0.38866683081280134
Energy: 0.3911890065443334
Energy: 0.3891050796510766
Energy: 0.40812762818038606
Energy: 0.3747561815394685
Energy: 0.36660641818140244
Energy: 0.38712734349267575
Energy: 0.3946560060923121
Energy: 0.36711708152948397
Energy: 0.43974091264197745
Energy: 0.3790873551453295
Energy: 0.36752352903930285
Energy: 0.39875120297368977
Energy: 0.37906895978729
Energy: 0.3734660709657117
Energy: 0.3987161295920758
Energy: 0.37382441396318
Energy: 0.3677540743199926
Energy: 0.39869028352919034
Energy: 0.3767918953033911
Energy: 0.3810477666059155
Energy: 0.3985258951072571
Energy: 0.36695604401755394
Energy: 0.3666312327264836
Energy: 0.39921372306694675
Energy: 0.37794971148902246
Energy: 0.3989119080574136
Energy: 0.39875948424545987
Energy: 0.3878948255683621
Energy: 0.36693687292362415
Energy: 0.3986705983122801
Energy: 0.3866410069336252
Energy: 0.4062242709064256
Energy: 0.4833581417057291
Energy: 0.38292388969355956
Energy: 0.39701279721093424
Energy: 0.401825486019552
Energy: 0.385631792625663
Energy: 0.3970854187412784
Energy: 0.38056496870420414
Energy: 0.3828235563406653
Energy: 0.3950279592208882
Energy: 0.37501945895935107
Energy: 0.39483729970048936
Energy: 0.3682229932832514
Energy: 0.37612143291434674
Energy: 0.3990031410934831
Energy: 0.39875738906808084
Energy: 0.3862009776169019
Energy: 0.39924560954068233
Energy: 0.39670211995520155
Energy: 0.4820200552882705
Energy: 0.39875388235558107
Energy: 0.39863131931686213
Energy: 0.3747328603362515
Energy: 0.39877420301893785
Energy: 0.3675058416969825
Energy: 0.7258647096994688
Energy: 0.44141052541742043
Energy: 0.379037050307836
Energy: 0.37239088641134216
Energy: 0.4428775255523588
Energy: 0.40988788901791595
Energy: 0.4924909950692923
Energy: 0.3987518328481334
Energy: 0.3921370336780956
Energy: 0.37609731406390506
Energy: 0.3989576825967199
Energy: 0.39292132402059177
Energy: 0.3918733652203624
Energy: 0.4037113631943346
Energy: 0.3997788776520993
Energy: 0.3912216956788259
Energy: 0.4047779512738182
Energy: 0.37386547300145323
Energy: 0.3920592003692722
Energy: 0.3761772351770549
Energy: 0.38924223489613163
Energy: 0.39237936493017467
Energy: 0.3951058133098284
Energy: 0.3909113136721039
Energy: 0.3912044822760178
Energy: 0.3731002097246047
Energy: 0.37405007889131164
Energy: 0.39120620602310036
Energy: 0.3733785378804231
Energy: 0.38030323876402866
Energy: 0.406364119907787
Energy: 0.3775291768081455
Energy: 0.40160792961575903
Energy: 0.3916211248283215
Energy: 0.38274738759412885
Energy: 0.38430332800358047
Energy: 0.4064331535151421
Energy: 0.3862163506363551
Energy: 0.39109246900662664
Energy: 0.3918359061303016
Energy: 0.39001015579746084
Energy: 0.3897287063294853
Energy: 0.4063882704792763
Energy: 0.38998928876466976
Energy: 0.3839231042751397
Energy: 0.3891571730844016
Energy: 0.38907285829214316
Energy: 0.385776825911511
Energy: 0.40659536722791323
Energy: 0.3969909787103751
Energy: 0.38734638324780535
Energy: 0.3936996608630096
Energy: 0.3964042584006426
Energy: 0.3789435249573785
Energy: 0.43538265742438054
Energy: 0.3921764987183988
Energy: 0.4005961587003386
Energy: 0.37997679221494435
Energy: 0.3920972191852854
Energy: 0.3815470576952079
Energy: 0.4328660538970286
Energy: 0.3916226649957024
Energy: 0.3915051904258287
Energy: 0.3798681882737015
Energy: 0.391547890593329
Energy: 0.36989206807819136
Energy: 0.4061592868268391
Energy: 0.3923553312559989
Energy: 0.39219890812333663
Energy: 0.396389296943666
Energy: 0.3918933763829932
Energy: 0.39794183481660816
Energy: 0.5287776513309336
Energy: 0.38298985418910875
Energy: 0.4121533445121837
Energy: 0.39549067735181265
Energy: 0.39084836381672944
Energy: 0.3988084901159304
Energy: 0.4057531677443081
Energy: 0.3742992527410279
Energy: 0.3673704311615737
Energy: 0.3999273232948548
Energy: 0.3744092879862003
Energy: 0.39179371254268874
Energy: 0.45295533486818906
Energy: 0.4110062567883111
Energy: 0.3834373606617824
Energy: 0.45269671173400333
Energy: 0.40396333955336694
Energy: 0.3828858054995326
Energy: 0.39872689631189084
Energy: 0.3672404915403202
Energy: 0.3686140414870026
Energy: 0.39863998486603824
Energy: 0.37450570167880487
Energy: 0.39904910312469394
Energy: 0.3989585747345541
Energy: 0.38343380177291336
Energy: 0.39579212506122674
Energy: 0.3988660698217383
Energy: 0.38323827694082013
Energy: 0.40622672658097647
Energy: 0.39875904754678987
Energy: 0.38695914247971036
Energy: 0.36729371301265873
Energy: 0.3952103083209482
Energy: 0.3867696238917661
Energy: 0.3672160852776802
Energy: 0.37610175776445093
Energy: 0.3885427271537455
Energy: 0.3973201016496329
Energy: 0.38498249614070307
Energy: 0.38863590136933873
Energy: 0.41448929430754883
Energy: 0.3796107673271379
Energy: 0.3989400167394905
Energy: 0.40660429732223713
Energy: 0.3756038650307766
Energy: 0.3987727774383822
Energy: 0.36731500528529193
Energy: 0.4918214779218817
Energy: 0.39900325483144256
Energy: 0.3988391659793064
Energy: 0.3968215156198993
Energy: 0.39985503229989433
Energy: 0.39638236600094073
Energy: 0.407772896371776
Energy: 0.3988699225532314
Energy: 0.39877095117392175
Energy: 0.3825000892333856
Energy: 0.39894808261449477
Energy: 0.366049816408772
Energy: 0.4050923134388447
Energy: 0.398297936769196
Energy: 0.41349818731305255
Energy: 0.3836952433078363
Energy: 0.3983748269557898
Energy: 0.3742149177883544
Energy: 0.40605308401470014
Energy: 0.3963529356799108
Energy: 0.40805120324768557
Energy: 0.40183292864939846
Energy: 0.397171971626531
Energy: 0.36830524970717915
Energy: 0.39237906121714067
Energy: 0.394593597730172
Energy: 0.3892423972388426
Energy: 0.39216797185051094
Energy: 0.39305331572379026
Energy: 0.3898393772322226
Energy: 0.39130878667146607
Energy: 0.38490097345369295
Energy: 0.38723209597186575
Energy: 0.3913574928983831
Energy: 0.38615244580894004
Energy: 0.3912724373262918
Energy: 0.42285102630798055
Energy: 0.4372128197249364
Energy: 0.40577779874907377
Energy: 0.4220732959181361
Energy: 0.39376805160480105
Energy: 0.39377985721856
Energy: 0.4057053776742994
Energy: 0.3860605106290176
Energy: 0.3859966422823833
Energy: 0.3912592515491484
Energy: 0.3862308309172086
Energy: 0.38705904438339805
Energy: 0.40603372556492173
Energy: 0.3809201964589357
Energy: 0.3825122148672177
Energy: 0.39053161056094216
Energy: 0.3908607026126139
Energy: 0.3829507938522088
Energy: 0.4069698288285656
Energy: 0.3900991140656145
Energy: 0.3904977714067379
Energy: 0.3912210569689652
Energy: 0.38949768876712443
Energy: 0.3869730887743605
Energy: 0.43305537052435794
Energy: 0.39172257130835775
Energy: 0.3915742946042975
Energy: 0.3796936639175921
Energy: 0.3918888509312363
Energy: 0.37002901547283823

minimum gb energy = 0.366049816408772 eV
minimum distance =  2.65193747780328 Angstroms
sigma value = 57


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

Energy: 0.18031117999903942
Energy: 0.2065923638072598
Energy: 0.18668712084818073
Energy: 0.18176643949388877
Energy: 0.20665327727202912
Energy: 0.1810517131327261
Energy: 0.2300228402632173
Energy: 0.1906012532855808
Energy: 0.19069012788923825
Energy: 0.2044587810641134
Energy: 0.20558417569697482
Energy: 0.20093173819233773
Energy: 0.23164099895759035
Energy: 0.2061797013123073
Energy: 0.20693352094915074
Energy: 0.20549366664736268
Energy: 0.2059809526741912
Energy: 0.19125104945731156
Energy: 0.2317244696050076
Energy: 0.20627959979175825
Energy: 0.20681987073264968
Energy: 0.20637183457737732
Energy: 0.23235831965774809
Energy: 0.1915635442760788
Energy: 0.22952547552023297
Energy: 0.18128579353096133
Energy: 0.19860609328617596
Energy: 0.2308131291701211
Energy: 0.1808536988576401
Energy: 0.19171550359638212
Energy: 0.20600726587811208
Energy: 0.18078648841101577
Energy: 0.18140730628579704
Energy: 0.19100218690743945
Energy: 0.18065926183391598
Energy: 0.19688906302355275
Energy: 0.20325696729850903
Energy: 0.19059755844650939
Energy: 0.1908931471039976
Energy: 0.2039704700813131
Energy: 0.1901430220217145
Energy: 0.19393741135763778
Energy: 0.2060308043722362
Energy: 0.2128954617253487
Energy: 0.20679241655252772
Energy: 0.20607459550590457
Energy: 0.19244068752943047
Energy: 0.20693823023548852
Energy: 0.2292352562732395
Energy: 0.20664507163604112
Energy: 0.19248678924505544
Energy: 0.20588664608646226
Energy: 0.20525627454700024
Energy: 0.2113310454878929
Energy: 0.1806224132081197
Energy: 0.2068628138705946
Energy: 0.19838325966169504
Energy: 0.18067271408142527
Energy: 0.20547431545988978
Energy: 0.1970754277738971
Energy: 0.1806299215132386
Energy: 0.19087853873089428
Energy: 0.19082829380700733
Energy: 0.18073162300442758
Energy: 0.1903443532361698
Energy: 0.19832301768555127
Energy: 0.230586486479618
Energy: 0.20606902818987502
Energy: 0.2116535571631521
Energy: 0.20470822708788328
Energy: 0.2054693354450111
Energy: 0.1910356066972926
Energy: 0.23184762438828124
Energy: 0.23198844734712853
Energy: 0.23238110580612711
Energy: 0.2058305821637687
Energy: 0.23183947380284292
Energy: 0.23222594698636814
Energy: 0.22985417673579567
Energy: 0.20576479725118388
Energy: 0.2065744321751728
Energy: 0.20588585109096352
Energy: 0.2054662928942829
Energy: 0.19138045757726904
Energy: 0.23165047965964441
Energy: 0.18071845086419375
Energy: 0.18096169189811492
Energy: 0.20637810601038462
Energy: 0.18349390164587495
Energy: 0.1816715944673897
Energy: 0.2051087478311766
Energy: 0.19098360039289689
Energy: 0.20124973227710594
Energy: 0.20538642998869197
Energy: 0.18107541315545778
Energy: 0.19096368555211185
Energy: 0.2058984988126601
Energy: 0.19307144238413765
Energy: 0.20223576463712123
Energy: 0.2059196562255772
Energy: 0.20576258181328777
Energy: 0.21126420198357398
Energy: 0.2318879523727481
Energy: 0.21674983320978822
Energy: 0.2118707072805053
Energy: 0.2312426524837083
Energy: 0.20688094157034578
Energy: 0.2074857754270308
Energy: 0.18063830973520897
Energy: 0.1908574762785682
Energy: 0.19093538833646329
Energy: 0.18080469294007023
Energy: 0.20601227013880297
Energy: 0.21059316208910342

minimum gb energy = 0.18031117999903942 eV
minimum distance =  2.70921197973087 Angstroms
sigma value = 11


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

Energy: 0.6851848255766705
Energy: 0.563502298290582
Energy: 0.44865167656235905
Energy: 0.33344081538385706
Energy: 0.3849618044513604
Energy: 0.37907512943510446
Energy: 0.30779964039512614
Energy: 0.3430658100623294
Energy: 0.32613003497244725
Energy: 0.3198804606638967
Energy: 0.3108217287899624
Energy: 0.3111944507880508
Energy: 0.3114725880068561
Energy: 0.3218558724986074
Energy: 0.30851554154660277
Energy: 0.3122911070418355
Energy: 0.30871852472244393
Energy: 0.32289045625077345
Energy: 0.31120717631045847
Energy: 0.32853577520937355
Energy: 0.3335327486767808
Energy: 0.31176609997215704
Energy: 0.31138406456727163
Energy: 0.30904352500542104
Energy: 0.31135168389011664
Energy: 0.3710038236509739
Energy: 0.3479860684015008
Energy: 0.3078646722032846
Energy: 0.36706562012318333
Energy: 0.3161765172325452
Energy: 0.4353195243387419
Energy: 0.3471136301748307
Energy: 0.340835967700208
Energy: 0.32316866082340673
Energy: 0.3243599099746689
Energy: 0.34175867827696527
Energy: 0.3345666572693644
Energy: 0.3172996982015692
Energy: 0.32025857418325965
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Energy: 0.319321737282867
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Energy: 0.3168146913919972
Energy: 0.3521866487205269
Energy: 0.3527326672826209
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Energy: 0.35189552671467744
Energy: 0.35283299413920793
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Energy: 0.31062454387514493
Energy: 0.3402299236972933
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Energy: 0.31153310068390855
Energy: 0.31910315363017244
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Energy: 0.3451712509592003
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Energy: 0.34991289086393446
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Energy: 0.31700598673648167
Energy: 0.4058033342849825
Energy: 0.3735633922928836
Energy: 0.37189648645673645
Energy: 0.4063373476670753
Energy: 0.3650857488541155
Energy: 0.37134802163229486
Energy: 0.3663830638715671
Energy: 0.41754220016741683
Energy: 0.41641248590242175
Energy: 0.3656746015270044
Energy: 0.41771780241163176
Energy: 0.3441601849487169
Energy: 0.5684367901265618
Energy: 0.370274582854099
Energy: 0.37172015155125193
Energy: 0.4091321387881222
Energy: 0.4053020623669759
Energy: 0.3718433906087113
Energy: 0.483073246183947
Energy: 0.4521150828984066
Energy: 0.3287966699753195
Energy: 0.44983378890015857
Energy: 0.4445769505658626
Energy: 0.31286239005830824
Energy: 0.5843752661138853
Energy: 0.34017516567208267
Energy: 0.34182659134918386
Energy: 0.39779689100903964
Energy: 0.38716833824323
Energy: 0.3729174748452542
Energy: 0.5562878913343836
Energy: 0.31994614812700606
Energy: 0.32482352987426794
Energy: 0.34909473907080874
Energy: 0.36956906909376996
Energy: 0.34744824839575594
Energy: 0.40407359124157044
Energy: 0.42325603815918195
Energy: 0.3641494963667182
Energy: 0.39158381618032095
Energy: 0.40584057785147104
Energy: 0.3549856586444738
Energy: 0.5692727172674668
Energy: 0.37167027113404716
Energy: 0.3418419375633422
Energy: 0.3498911073805269
Energy: 0.39084243495914905
Energy: 0.34527923771072544
Energy: 0.5232250859619932
Energy: 0.42439383533890496
Energy: 0.3854967343144583
Energy: 0.5235184006782474
Energy: 0.4241922747445077
Energy: 0.3685279686781544
Energy: 0.3498845999776918
Energy: 0.3495294451181226
Energy: 0.34163919146044597
Energy: 0.3494152397675976
Energy: 0.32474615115867905
Energy: 0.3461844275029623
Energy: 0.35172402541678405
Energy: 0.30795506890513635
Energy: 0.30834375525901137
Energy: 0.3522608624828546
Energy: 0.3134264530789701
Energy: 0.3106366838826217
Energy: 0.3557081178641168
Energy: 0.31411323992105444
Energy: 0.30923109646496333
Energy: 0.3572151083158444
Energy: 0.31158287461825235
Energy: 0.30789905792341593
Energy: 0.5545123812239782
Energy: 0.3271092941183138
Energy: 0.31607563230672175
Energy: 0.41249581873102614
Energy: 0.32230104271003357
Energy: 0.3137166723159715

minimum gb energy = 0.29954487924806544 eV
minimum distance =  2.68391768650047 Angstroms
sigma value = 41


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

Energy: 0.656570241432199
Energy: 0.42465977413258577
Energy: 0.3437015675308594
Energy: 0.4749456036462956
Energy: 0.4245924724441937
Energy: 0.4744619176234162
Energy: 0.33269982185254565
Energy: 0.35067521791401124
Energy: 0.34806202357112553
Energy: 0.33807314918392106
Energy: 0.33320519062228077
Energy: 0.3366784142622887
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Energy: 0.3340567238058912
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Energy: 0.33274218916803716
Energy: 0.33591892729331335
Energy: 0.3341204816871065
Energy: 0.346275715917794
Energy: 0.3357934676151735
Energy: 0.33418655447583495
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Energy: 0.33339738103302635
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Energy: 0.35901781963074986
Energy: 0.3582897119203314
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Energy: 0.346521885078486
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Energy: 0.3458841167884185
Energy: 0.40211934058173326
Energy: 0.3601788055590216
Energy: 0.3463157892006985
Energy: 0.4020826290228921
Energy: 0.3311055177008959
Energy: 0.49542624528836654
Energy: 0.3362226111714214
Energy: 0.34724679119999674
Energy: 0.3644083511148502
Energy: 0.3794860860492958
Energy: 0.3474166450352734
Energy: 0.4682587315539194
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Energy: 0.3726084983706419
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Energy: 0.348122269009551
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Energy: 0.34671148501334476
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Energy: 0.31910175700770516
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Energy: 0.3604552684150144
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Energy: 0.33301985720654825
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Energy: 0.33810803245484333
Energy: 0.34204194162431206
Energy: 0.49229906155101977
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Energy: 0.36944089070981095
Energy: 0.42587104667950304
Energy: 0.4075066913835656
Energy: 0.49333670129969076
Energy: 0.41851261570905207
Energy: 0.4003536756235298
Energy: 0.3717465804974783
Energy: 0.33657442684881295
Energy: 0.3473850281436046
Energy: 0.33308190718914393
Energy: 0.33526155848548783
Energy: 0.3469942810126133
Energy: 0.34594454108473843
Energy: 0.40355645899987486
Energy: 0.33921035410772354
Energy: 0.3464149945929692
Energy: 0.4023961548380058
Energy: 0.33276626747361143
Energy: 0.37191759418768683
Energy: 0.33299882391139585
Energy: 0.33641821361708657
Energy: 0.3444043389160552
Energy: 0.33531574757550014
Energy: 0.3484021402552649
Energy: 0.4683152156351593
Energy: 0.3504350939994757
Energy: 0.34871486133640506
Energy: 0.33395688758908665
Energy: 0.3366756447721243
Energy: 0.34603298185572445
Energy: 0.4680053493934713
Energy: 0.3497531114151676
Energy: 0.3480425738278168
Energy: 0.439378858463704
Energy: 0.33698797752621573
Energy: 0.346957918269071
Energy: 0.49588889492888477
Energy: 0.3314887843964925
Energy: 0.3584369926611146
Energy: 0.354279027195123
Energy: 0.3196726603686806
Energy: 0.350083720500607
Energy: 0.336860464617219
Energy: 0.3547796609512741
Energy: 0.3551893118152945
Energy: 0.3369039343578688
Energy: 0.5141591529088541
Energy: 0.3550674780258425
Energy: 0.3792631543741746
Energy: 0.3471745067518556
Energy: 0.34822052225539935
Energy: 0.37895081374509343
Energy: 0.34758777555838455
Energy: 0.35838976875116313
Energy: 0.34011309257678773
Energy: 0.33664527250179843
Energy: 0.3373323586812307
Energy: 0.3370169566261743
Energy: 0.3334698068440051
Energy: 0.3371961485616754
Energy: 0.3335277720752864
Energy: 0.3340945888754257
Energy: 0.34839089511599486
Energy: 0.33911694018036337
Energy: 0.3335945582025609
Energy: 0.33368631419785355
Energy: 0.5893707576991939
Energy: 0.34973467596764996
Energy: 0.34198032061919714
Energy: 0.32640090419237866
Energy: 0.3328629714930405
Energy: 0.3642699309463849

minimum gb energy = 0.31910175700770516 eV
minimum distance =  2.68702917594756 Angstroms
sigma value = 33


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

Energy: 0.4646617120152853
Energy: 0.38010740326902615
Energy: 0.4351713619599147
Energy: 0.4637234792838165
Energy: 0.3798241915448324
Energy: 0.43507274582107913
Energy: 0.36666416129100987
Energy: 0.36032009354332434
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Energy: 0.3677205143299305
Energy: 0.3671940672251996
Energy: 0.35927100625415437
Energy: 0.3667421989909111
Energy: 0.3600766404261309
Energy: 0.36079363580489776
Energy: 0.36713060126481856
Energy: 0.3740641816950798
Energy: 0.3595586333390343
Energy: 0.36642111803166366
Energy: 0.3773801802193351
Energy: 0.36365785927622374
Energy: 0.3665508373662004
Energy: 0.3600906214429642
Energy: 0.3632527118104001
Energy: 0.36584859778183165
Energy: 0.36182813206372194
Energy: 0.347688850691573
Energy: 0.3664570457990537
Energy: 0.3744446024975119
Energy: 0.3474388959854601
Energy: 0.49023136254986877
Energy: 0.36200682176687493
Energy: 0.34758263828504127
Energy: 0.3940709839820807
Energy: 0.39526589313813654
Energy: 0.349040568902314
Energy: 0.3866745775969176
Energy: 0.3637550299352339
Energy: 0.36097763327523064
Energy: 0.368989789244159
Energy: 0.37862392160746317
Energy: 0.3599100054629229
Energy: 0.3836474486602571
Energy: 0.39707983803517594
Energy: 0.36055733870880263
Energy: 0.38368168160661065
Energy: 0.3955670432066111
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Energy: 0.38618664426259697
Energy: 0.3469369228616727
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Energy: 0.35930301842450296
Energy: 0.3951864402233108
Energy: 0.3959424145982737
Energy: 0.3644315906790848
Energy: 0.39810963708607733
Energy: 0.3670742481725257
Energy: 0.37462762395536287
Energy: 0.3750166375731563
Energy: 0.3630044187901657
Energy: 0.36935564259133563
Energy: 0.3602809759421229
Energy: 0.3839551426646789
Energy: 0.4087882854410198
Energy: 0.34709820404842323
Energy: 0.3471372579219003
Energy: 0.4064334914810438
Energy: 0.34624795935425223

minimum gb energy = 0.3460946333167953 eV
minimum distance =  2.68231385208132 Angstroms
sigma value = 67


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

Energy: 0.5487020698625523
Energy: 0.39710282428038374
Energy: 0.3862171421440097
Energy: 0.3861395514851486
Energy: 0.3969825650631351
Energy: 0.38612236825050944
Energy: 0.39511470071042754
Energy: 0.379269130989234
Energy: 0.3787414246008823
Energy: 0.37882377188147137
Energy: 0.39431732520601775
Energy: 0.3785014456437429
Energy: 0.39109667924491226
Energy: 0.3649079180055622
Energy: 0.3790914891967193
Energy: 0.3787741425331336
Energy: 0.3632394494194954
Energy: 0.37890731116745446
Energy: 0.3913687351319705
Energy: 0.37918274161650845
Energy: 0.37922262387134037
Energy: 0.39154933480652665
Energy: 0.3791628356232593
Energy: 0.37930529391417195
Energy: 0.39269494708041763
Energy: 0.37981094437728713
Energy: 0.37972499012926453
Energy: 0.3930025596048498
Energy: 0.37945379909379556
Energy: 0.38022578196384244
Energy: 0.3937316470925837
Energy: 0.38543296178396147
Energy: 0.3814890088224226
Energy: 0.393801939921775
Energy: 0.3844095827212541
Energy: 0.3829657961249432
Energy: 0.4149959551269873
Energy: 0.3790938758343618
Energy: 0.37859603300797406
Energy: 0.4166668591603444
Energy: 0.3941941132926952
Energy: 0.37843842177219145

minimum gb energy = 0.3632394494194954 eV
minimum distance =  2.70609632144809 Angstroms
sigma value = 3


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

Energy: 0.7548864657683867
Energy: 0.686219763586238
Energy: 0.44213052600794994
Energy: 0.42221836485296044
Energy: 0.6851220324583489
Energy: 0.4368479472367303
Energy: 0.41705479522479116
Energy: 0.4470812429989519
Energy: 0.4261410589806999
Energy: 0.4277280424489771
Energy: 0.49186045542749474
Energy: 0.41849645923207124
Energy: 0.45557082660633574
Energy: 0.41776454429160204
Energy: 0.4175515710621482
Energy: 0.4555694748731917
Energy: 0.4180263740430611
Energy: 0.41992797296538587
Energy: 0.41873147914426695
Energy: 0.4192133147957317
Energy: 0.41923041630053004
Energy: 0.41931253354748355
Energy: 0.4175357777733219
Energy: 0.41919068960681694
Energy: 0.42414732441963215
Energy: 0.41737517557880044
Energy: 0.41729351896108086
Energy: 0.4247747197555469
Energy: 0.43529297064483835
Energy: 0.4174810836724655
Energy: 0.41729111441395755
Energy: 0.4178223884495788
Energy: 0.4173371114012887
Energy: 0.41751102930148415
Energy: 0.43164346088325795
Energy: 0.41741298812042127
Energy: 0.41748142104296515
Energy: 0.4443555892286187
Energy: 0.4433876048965903
Energy: 0.42818482385506473
Energy: 0.46249266587537285
Energy: 0.4427536580001182
Energy: 0.6044878654768246
Energy: 0.4915318822857827
Energy: 0.42865305725360575
Energy: 0.4180412813195097
Energy: 0.4819538566241985
Energy: 0.48405840485125984
Energy: 0.41883319228142196
Energy: 0.42072368291629325
Energy: 0.4377588131418987
Energy: 0.4302430769562385
Energy: 0.42229667458248893
Energy: 0.4286840049458075
Energy: 0.47123336749818984
Energy: 0.42284455321889064
Energy: 0.4198484572673282
Energy: 0.4531397655070272
Energy: 0.41703061095426414
Energy: 0.4429462413479981
Energy: 0.44216071913268745
Energy: 0.4177733357904656
Energy: 0.44679420588615804
Energy: 0.44218783647950044
Energy: 0.41918415982615864
Energy: 0.43797371407966756
Energy: 0.46985475256285264
Energy: 0.41750649279167673
Energy: 0.41701898509484736
Energy: 0.4421915775910877
Energy: 0.422876015083306
Energy: 0.41655617023468017
Energy: 0.4384281043672764
Energy: 0.416756749349219
Energy: 0.41717474402672583
Energy: 0.4372093254473229
Energy: 0.41630784825076544
Energy: 0.41653229109726125
Energy: 0.4525621506328728
Energy: 0.4204757218732065
Energy: 0.4172313651153932
Energy: 0.43277502677304114
Energy: 0.4181688005163627
Energy: 0.4171511498588572
Energy: 0.5023401513676332
Energy: 0.4240454712492284
Energy: 0.42331340999683204
Energy: 0.417681031219383
Energy: 0.42385988391039764
Energy: 0.4204498874078999
Energy: 0.44958061731902677
Energy: 0.4192440242344759
Energy: 0.418348160060909
Energy: 0.43895177189334056
Energy: 0.42990708925300497
Energy: 0.41826377588639974
Energy: 0.49564789889885463
Energy: 0.4383196860243703
Energy: 0.42631571678864855
Energy: 0.4955890367582841
Energy: 0.41789770615847605
Energy: 0.45475571486944666
Energy: 0.4640443555057029
Energy: 0.4414824667482325
Energy: 0.44414640564491153
Energy: 0.4429844386099201
Energy: 0.42522577146075496
Energy: 0.4410053941773496
Energy: 0.496278261161452
Energy: 0.432234549863687
Energy: 0.43353390564494
Energy: 0.4165135601446058
Energy: 0.4690257616157798
Energy: 0.4177195331365668
Energy: 0.47983134264402466
Energy: 0.4341886596094933
Energy: 0.4332433160262602
Energy: 0.41683168856176706
Energy: 0.43178806535093484
Energy: 0.4231973075401676
Energy: 0.4278473985035667
Energy: 0.43853853397426484
Energy: 0.434356482156246
Energy: 0.4323596779072038
Energy: 0.43486418949159245
Energy: 0.438536050454635
Energy: 0.42853684776137557
Energy: 0.43201898199219746
Energy: 0.4359444022167461
Energy: 0.4365457979777847
Energy: 0.43815073188558673
Energy: 0.43540571624681157
Energy: 0.43165670575664267
Energy: 0.4345746251081526
Energy: 0.43445871402024233
Energy: 0.4325408809440976
Energy: 0.4203641916441608
Energy: 0.4429258828339722
Energy: 0.4326947336603839
Energy: 0.4182740654197279
Energy: 0.4181402781649157
Energy: 0.4330031549547262
Energy: 0.4186489677394991
Energy: 0.42959744478747
Energy: 0.4212876834196202
Energy: 0.4166767970213514
Energy: 0.41638854052373336
Energy: 0.4289439566325744
Energy: 0.4173455547074512
Energy: 0.41650847541733477
Energy: 0.5165181246947277
Energy: 0.42905879512722656
Energy: 0.4273508665353564
Energy: 0.4168192811253196
Energy: 0.4716209445307507
Energy: 0.4411177514931014
Energy: 0.4148051894007043
Energy: 0.42827456537524544
Energy: 0.44998147165358215
Energy: 0.42772225199848335
Energy: 0.4730003511853004
Energy: 0.44000422874899703
Energy: 0.4218388376388578
Energy: 0.41705968821157785
Energy: 0.41677512364916364
Energy: 0.4276850774998582
Energy: 0.42369578319082996
Energy: 0.41660502526697657
Energy: 0.42229883382463607
Energy: 0.4179744125630393
Energy: 0.41781564869613225
Energy: 0.4223502686432585
Energy: 0.418249808975546
Energy: 0.42286771563291314
Energy: 0.42271736109703223
Energy: 0.43743083117092796
Energy: 0.42478553716709927
Energy: 0.42365080775559794
Energy: 0.4294147102576624
Energy: 0.4255507035649089
Energy: 0.42232345630755236
Energy: 0.4243660972829318
Energy: 0.4239499387883583
Energy: 0.42243522348837764
Energy: 0.45406299280022033
Energy: 0.42525893986298124
Energy: 0.42680968735416785
Energy: 0.44309414585446827
Energy: 0.4392361131065088
Energy: 0.42829399303613297
Energy: 0.45225750070894916
Energy: 0.4332740178337063
Energy: 0.5022346045461912
Energy: 0.4628161840194589
Energy: 0.44296274164962446
Energy: 0.41666811000539056
Energy: 0.45766659982431207
Energy: 0.43679908804075795
Energy: 0.43142981143977777
Energy: 0.46203256881638305
Energy: 0.4170747860227408
Energy: 0.41687473906264205
Energy: 0.462574051717657
Energy: 0.4169391225483425
Energy: 0.4383509011640645
Energy: 0.4287598618365619
Energy: 0.4388664009302452
Energy: 0.4492651546938419
Energy: 0.43068815172015423
Energy: 0.4438134999454968
Energy: 0.45126763241974577
Energy: 0.42247842641816946
Energy: 0.41976805023659575
Energy: 0.45178110903982593
Energy: 0.4170805203352149
Energy: 0.4426477438418992
Energy: 0.44691578007166743
Energy: 0.42073472878406093
Energy: 0.4172616133957172
Energy: 0.44785728652027085
Energy: 0.4245988660743926
Energy: 0.4361723041665213
Energy: 0.4393848158166785
Energy: 0.41741146222283004
Energy: 0.4172388553238186
Energy: 0.4154936682662877
Energy: 0.4168388275905043
Energy: 0.4428842363161083
Energy: 0.4571918442550979
Energy: 0.4207816100412446
Energy: 0.41640376313567556
Energy: 0.4472405528702709
Energy: 0.41953502883233806
Energy: 0.4160806552544556
Energy: 0.4571465271051285
Energy: 0.41906074831832457
Energy: 0.4193014637745564
Energy: 0.4172277534377419
Energy: 0.41888206947774664
Energy: 0.41898215089264385
Energy: 0.4278721777732319
Energy: 0.42072713892801294
Energy: 0.4177573566539611
Energy: 0.4564550237075921
Energy: 0.4301966261776152
Energy: 0.41780168025493564
Energy: 0.4862632263275191
Energy: 0.4212991018115554
Energy: 0.4216677695035322
Energy: 0.4862134286965084
Energy: 0.4243484472156307
Energy: 0.4357800195983728
Energy: 0.5264551098398582
Energy: 0.4329417053307505
Energy: 0.43715126188780895
Energy: 0.49468050404135283
Energy: 0.4173225370679419
Energy: 0.42471218874805367
Energy: 0.4294579990286768
Energy: 0.41982531529129136
Energy: 0.4172065626315435
Energy: 0.41985834232677116
Energy: 0.41700036859000134
Energy: 0.41713322319332813
Energy: 0.646094401240404
Energy: 0.4253693082107391
Energy: 0.4219059098303971
Energy: 0.43502323624108274
Energy: 0.4250965556078875
Energy: 0.42055432016753547
Energy: 0.42805610272339006
Energy: 0.43226654650576696
Energy: 0.4330529808633686
Energy: 0.4345841412170169
Energy: 0.4273607483271099
Energy: 0.43343115369799706
Energy: 0.42473410924258903
Energy: 0.42896538145659857
Energy: 0.4292532353015849
Energy: 0.42739063078053346
Energy: 0.43079109837489904
Energy: 0.4294767230081932
Energy: 0.4234274906981097
Energy: 0.4290044276598202
Energy: 0.42932919362431626
Energy: 0.42366444798564534
Energy: 0.4296950860918014
Energy: 0.42939494793071775
Energy: 0.4236225755950529
Energy: 0.4165795987433266
Energy: 0.4208142733963476
Energy: 0.42428132064891416
Energy: 0.41670681274876015
Energy: 0.4324115767520708
Energy: 0.4209047122303344
Energy: 0.4169911062685313
Energy: 0.4168229250221869
Energy: 0.4259940897504832
Energy: 0.41710094449862134
Energy: 0.419605460261376
Energy: 0.41639473276164646
Energy: 0.44278158902481174
Energy: 0.4297362798909878
Energy: 0.4437574356229901
Energy: 0.45101192461619305
Energy: 0.43558746522567277

minimum gb energy = 0.4148051894007043 eV
minimum distance =  2.65119025750389 Angstroms
sigma value = 81


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

Energy: 0.7612460655805255
Energy: 0.44291711253579846
Energy: 0.38982295913576154
Energy: 0.42929585169146567
Energy: 0.44298965693124587
Energy: 0.4146445229383383
Energy: 0.43257079045772084
Energy: 0.40338273461206997
Energy: 0.41547359390831706
Energy: 0.4055629836371213
Energy: 0.41598959883524633
Energy: 0.41619158807379625
Energy: 0.43386154156814105
Energy: 0.4237635813077634
Energy: 0.4231702785988316
Energy: 0.4094719339467939
Energy: 0.42413995945699484
Energy: 0.42174689441552776
Energy: 0.43434329417979217
Energy: 0.42394726183530074
Energy: 0.4498368133486319
Energy: 0.4352079682455549
Energy: 0.4137519433662039
Energy: 0.40311992952620185
Energy: 0.4339467329976095
Energy: 0.4457910845656081
Energy: 0.44496986043407233
Energy: 0.4349558892206912
Energy: 0.4476301170619964
Energy: 0.443668017042566
Energy: 0.44395154865806435
Energy: 0.444981041245028
Energy: 0.443774318694295
Energy: 0.4484723656677322
Energy: 0.4439776938935202
Energy: 0.44409376726631133
Energy: 0.4408989490016567
Energy: 0.43433580921442083
Energy: 0.4485184476619321
Energy: 0.4422141104387662
Energy: 0.4378435814588455
Energy: 0.4477759170999455
Energy: 0.4889693890666447
Energy: 0.48685025232661283
Energy: 0.48238371172606487
Energy: 0.41520217918574837
Energy: 0.48835012758184804
Energy: 0.41301178341734307
Energy: 0.44194982596202276
Energy: 0.4610820380529713
Energy: 0.4587347817902726
Energy: 0.44645795279859785
Energy: 0.4474231936979066
Energy: 0.4571389682054137
Energy: 0.4441806105697107
Energy: 0.38814738774791196
Energy: 0.3880256682270511
Energy: 0.44333387948785064
Energy: 0.38736531808479346
Energy: 0.3879365803339037
Energy: 0.4386890003967085
Energy: 0.3876176138804235
Energy: 0.38744130902663776
Energy: 0.43779251872267866
Energy: 0.40139605690240604
Energy: 0.4353118584280798
Energy: 0.411758969586489
Energy: 0.4475350684722903
Energy: 0.4468702865045991
Energy: 0.41238095143658066
Energy: 0.44787196039013744
Energy: 0.4443475209223227
Energy: 0.4123254188398385
Energy: 0.43629207381731805
Energy: 0.4517735392214452
Energy: 0.41390724679490737
Energy: 0.4382011918074502
Energy: 0.41214353252296054
Energy: 0.43694790566251407
Energy: 0.4356458579902748
Energy: 0.4425045555848195
Energy: 0.4526413131882931
Energy: 0.43387202982803347
Energy: 0.4423433847950312
Energy: 0.49249522344213364
Energy: 0.4583258915492353
Energy: 0.4466432801314704
Energy: 0.4454192365692308
Energy: 0.44796689710167636
Energy: 0.44627560693105095
Energy: 0.4378080626673355
Energy: 0.44036053805917075
Energy: 0.443827811444512
Energy: 0.43780212313900846
Energy: 0.43280418960882006
Energy: 0.4436588338069756
Energy: 0.4941519216603591
Energy: 0.41226432542348346
Energy: 0.4124392351108069
Energy: 0.4944697968676506
Energy: 0.415101532934863
Energy: 0.4217727567568527
Energy: 0.4300143127345989
Energy: 0.42642922089363644
Energy: 0.46302013903721717
Energy: 0.45042216693808335
Energy: 0.4268293603896081
Energy: 0.4610832634840827
Energy: 0.3891157682096808
Energy: 0.42712846371317675
Energy: 0.38737958450184573
Energy: 0.3873843243335536
Energy: 0.4381570053966773
Energy: 0.38747570233464157
Energy: 0.38865321181630236
Energy: 0.4276084237219144
Energy: 0.38744326391978284
Energy: 0.3872744409192145
Energy: 0.4368253341183217
Energy: 0.38762490825519774
Energy: 0.4275192690243452
Energy: 0.4269524693763159
Energy: 0.4370620329112912
Energy: 0.45021778961918985
Energy: 0.43892486090042826
Energy: 0.46369377122449584
Energy: 0.4349181014796991
Energy: 0.42944097777401213
Energy: 0.41200867532539376
Energy: 0.4352199150902506
Energy: 0.41103387081177256
Energy: 0.4114467839474075
Energy: 0.43326472030378865
Energy: 0.43920230680752903
Energy: 0.44274462086020117
Energy: 0.433779342910127
Energy: 0.432571083302154
Energy: 0.44265074309900765
Energy: 0.43985657019311486
Energy: 0.4450516886304509
Energy: 0.4449486053351814
Energy: 0.4449126502619518
Energy: 0.44525877069881703
Energy: 0.44553607683957347
Energy: 0.43559077627574244
Energy: 0.4466172064737477
Energy: 0.44336054960440235
Energy: 0.44805821214506797
Energy: 0.43649752649166046
Energy: 0.4432742088603757
Energy: 0.48983442857656934
Energy: 0.471374095383451
Energy: 0.4718302099468924
Energy: 0.4351095954490045
Energy: 0.49431104945128135
Energy: 0.47160407861511633
Energy: 0.42192458613538814
Energy: 0.48326688935833084
Energy: 0.4829165431416016
Energy: 0.4327948726229125
Energy: 0.5044293711159221
Energy: 0.4603370142745974
Energy: 0.43646268763231605
Energy: 0.3877424849416009
Energy: 0.4355398628701418
Energy: 0.4372069078542925
Energy: 0.3881004261014357
Energy: 0.4364172374618169
Energy: 0.438656300090795
Energy: 0.38848527507112024
Energy: 0.38831469625613474
Energy: 0.43719693189155656
Energy: 0.3877377337857556
Energy: 0.3880400150819347
Energy: 0.4451055845872413
Energy: 0.4446719520375704
Energy: 0.46452529804016934
Energy: 0.4466813461077598
Energy: 0.44705398417560427
Energy: 0.4362806274838688
Energy: 0.41237826353672685
Energy: 0.4513057759949665
Energy: 0.4421448768248294
Energy: 0.4243267246069746
Energy: 0.43851168191089523
Energy: 0.41111473965671513
Energy: 0.445770957307166
Energy: 0.43305534864375944
Energy: 0.43344577888267594
Energy: 0.4419905454250312
Energy: 0.4327102876964127
Energy: 0.45456616224117635
Energy: 0.43802976798514887
Energy: 0.44043357767183333
Energy: 0.44155718329736415
Energy: 0.441934533225666
Energy: 0.4371382492825876
Energy: 0.443218125291046
Energy: 0.43768806379630476
Energy: 0.44316987186291534
Energy: 0.43248779372966323
Energy: 0.43571180059170694
Energy: 0.4415349092829051
Energy: 0.44274758434872946
Energy: 0.43825844739220454
Energy: 0.42317807020005915
Energy: 0.45050307011988766
Energy: 0.43914170601271757
Energy: 0.431613421315309
Energy: 0.4189730759999214
Energy: 0.49526251450340125
Energy: 0.414787197563207
Energy: 0.4121893159996551
Energy: 0.46451206871798856
Energy: 0.40819951516561226
Energy: 0.427942466771501
Energy: 0.4337221645333942
Energy: 0.4036489594472502
Energy: 0.41564530149706963
Energy: 0.41477073471650605
Energy: 0.4126905131106661
Energy: 0.40897061348028296
Energy: 0.5026948567927032
Energy: 0.4164365776613789
Energy: 0.38986183619698267
Energy: 0.3874065948740063
Energy: 0.4099220399708343
Energy: 0.4154273781160268

minimum gb energy = 0.3872744409192145 eV
minimum distance =  2.65726580512781 Angstroms
sigma value = 43


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

Energy: 0.7727611694477158
Energy: 0.5173080398018798
Energy: 0.4457138295041764
Energy: 0.41566982033692407
Energy: 0.5108674306921597
Energy: 0.4156932699674406
Energy: 0.41000473312305236
Energy: 0.40736764265329867
Energy: 0.40979706605369765
Energy: 0.4343363639756387
Energy: 0.4090748551042677
Energy: 0.40840086250062396
Energy: 0.4077382815776965
Energy: 0.4027137562022672
Energy: 0.40317315846702495
Energy: 0.4555012149227244
Energy: 0.40304463679681557
Energy: 0.40878606838356
Energy: 0.4101891523012016
Energy: 0.404114143338596
Energy: 0.40936355175669015
Energy: 0.4103211534908998
Energy: 0.4279969847477262
Energy: 0.4093242529594544
Energy: 0.41008193070799004
Energy: 0.41288877425562087
Energy: 0.42709875330779823
Energy: 0.4090147343133634
Energy: 0.42444105872475857
Energy: 0.4265499693361389
Energy: 0.4097817851747378
Energy: 0.42544531936693036
Energy: 0.42561926574116443
Energy: 0.42637623153533327
Energy: 0.40825102097000826
Energy: 0.42438181139058817
Energy: 0.40829748755407624
Energy: 0.41034422543515964
Energy: 0.41031953076475874
Energy: 0.4081362907973847
Energy: 0.4099970126828133
Energy: 0.4090754726437601
Energy: 0.42596908838784603
Energy: 0.40830550141216754
Energy: 0.40758412233308167
Energy: 0.40561779595151815
Energy: 0.40815762332364786
Energy: 0.4081836693448688
Energy: 0.4071926944711725
Energy: 0.4092023586039708
Energy: 0.4109104190211697
Energy: 0.40662368834658286
Energy: 0.40883201714492345
Energy: 0.41094439788713466
Energy: 0.5184714417358082
Energy: 0.410490224103701
Energy: 0.4419879395754399
Energy: 0.5185621581456971
Energy: 0.411360879774409
Energy: 0.4411945866343789
Energy: 0.40653603840478025
Energy: 0.4147439980998118
Energy: 0.4256227515830356
Energy: 0.40649738939371133
Energy: 0.41141615465463655
Energy: 0.40681118560319957
Energy: 0.4187693083066039
Energy: 0.40976326074402797
Energy: 0.4096762303871679
Energy: 0.4085261400828351
Energy: 0.41122084453232005
Energy: 0.4095988738054193
Energy: 0.41756679868275914
Energy: 0.40938667958049446
Energy: 0.41570232172017846
Energy: 0.4044428439823793
Energy: 0.4304358385195257
Energy: 0.4157881462753512
Energy: 0.40676001045549226
Energy: 0.4096770329470336
Energy: 0.4311160469621405
Energy: 0.40665895334498925
Energy: 0.40895147747095695
Energy: 0.40967107694129545
Energy: 0.4063103906776108
Energy: 0.4064163019687169
Energy: 0.40788392279596136
Energy: 0.4064743990295417
Energy: 0.40086245744337795
Energy: 0.4075911616907877
Energy: 0.407264818184565
Energy: 0.41524045385863634
Energy: 0.4086293356690304
Energy: 0.4059762176257032
Energy: 0.42704794612772623
Energy: 0.40639765063510347
Energy: 0.40805991850526535
Energy: 0.41275493381440653
Energy: 0.4165595793477043
Energy: 0.4080182260433365
Energy: 0.40840554547505553
Energy: 0.4066268599298074
Energy: 0.4069652081201142
Energy: 0.407663056007545
Energy: 0.412028711318699
Energy: 0.41811367351292406
Energy: 0.40701084060055104
Energy: 0.40665887178290616
Energy: 0.41132482188629843
Energy: 0.40623629340194944
Energy: 0.4065363549575562
Energy: 0.4111160158078345
Energy: 0.4300470067926528
Energy: 0.41012404768084515
Energy: 0.4110578514702739
Energy: 0.4062202151704472
Energy: 0.40644649526749826
Energy: 0.41210923056456455
Energy: 0.4063945268216517
Energy: 0.40976508111266163
Energy: 0.4064875559945812
Energy: 0.4158608789384413
Energy: 0.42726692088136975
Energy: 0.4167638864803729
Energy: 0.41526991125448875
Energy: 0.4065799000065231
Energy: 0.4614171894228131
Energy: 0.41560554532117816
Energy: 0.4156850825963719
Energy: 0.4616012239305916
Energy: 0.40474676010205135
Energy: 0.4178932837510597
Energy: 0.42617586303755933
Energy: 0.40693917248027495
Energy: 0.4068604861933243
Energy: 0.41701636243942175
Energy: 0.41532632410721737
Energy: 0.41567284324820036
Energy: 0.43652547602974406
Energy: 0.40638455835169046
Energy: 0.40629027407180174
Energy: 0.40773803518895174
Energy: 0.4084067606681084
Energy: 0.41660665189595353
Energy: 0.4276410118058822
Energy: 0.4059651153696335
Energy: 0.4061389115791087
Energy: 0.4159377254149611
Energy: 0.40583820013353156
Energy: 0.41230944177528467
Energy: 0.43370177761824835
Energy: 0.40666761025291026
Energy: 0.40891896486760265
Energy: 0.4073042098071758
Energy: 0.4066425952550079
Energy: 0.41034160993809915
Energy: 0.4345658706023184
Energy: 0.40639076058465445
Energy: 0.40866726699832123
Energy: 0.40976943142630073
Energy: 0.4121699515768131
Energy: 0.40858487056714954
Energy: 0.4401527716996349
Energy: 0.40828030065775994
Energy: 0.43214610997677366
Energy: 0.4114654690951663
Energy: 0.41182209699855754
Energy: 0.41015650710304313
Energy: 0.42329525117723166
Energy: 0.4091088082739683
Energy: 0.40923114780519343
Energy: 0.42321142960419234
Energy: 0.4058484636049891
Energy: 0.4094282994070872
Energy: 0.40948691141436044
Energy: 0.40684333035617504
Energy: 0.42942471513995223
Energy: 0.43524645798142847
Energy: 0.4069853124998778
Energy: 0.4110183248260263
Energy: 0.40537435305822067
Energy: 0.4845199655833959
Energy: 0.4613322570279618
Energy: 0.4174924978836713
Energy: 0.4740985373637631
Energy: 0.46031696834674857

minimum gb energy = 0.40086245744337795 eV
minimum distance =  2.62081688883841 Angstroms
sigma value = 57


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

Energy: 0.591208129951715
Energy: 0.4914750181587449
Energy: 0.4185325610279227
Energy: 0.40469489852184015
Energy: 0.49194920035412704
Energy: 0.41881599954778226
Energy: 0.40773418236545755
Energy: 0.4209413331681165
Energy: 0.4106723739428276
Energy: 0.41480807832961863
Energy: 0.4152951287004967
Energy: 0.4100870933305861
Energy: 0.404815205870037
Energy: 0.3912518568467178
Energy: 0.39088983947839046
Energy: 0.4104036716516411
Energy: 0.3916003564854556
Energy: 0.381876216093191
Energy: 0.4078553567582153
Energy: 0.39103150460931296
Energy: 0.38678781072830964
Energy: 0.407608196334956
Energy: 0.39091121561260855
Energy: 0.4081874251773542
Energy: 0.4080319523975603
Energy: 0.40450352070608203
Energy: 0.4067884637204794
Energy: 0.4079745170688248
Energy: 0.41040174948467417
Energy: 0.4039702537907322
Energy: 0.3914788751613375
Energy: 0.40347769816048346
Energy: 0.40410727266922
Energy: 0.4024126938331712
Energy: 0.4015330812394695
Energy: 0.4018265788294813
Energy: 0.415563188607761
Energy: 0.4076347031665097
Energy: 0.40779320817621295
Energy: 0.41455959529701486
Energy: 0.40816109518887317
Energy: 0.4082925712001875
Energy: 0.42029767185360356
Energy: 0.4031318065055429
Energy: 0.40391868732827935
Energy: 0.40210954511237307
Energy: 0.4029612086280675
Energy: 0.415570917010108
Energy: 0.4152620773139897
Energy: 0.4203454650342945
Energy: 0.4151468433992024
Energy: 0.4154444834559261
Energy: 0.4199763070467372
Energy: 0.4147106108046457
Energy: 0.44336551554096787
Energy: 0.4059212141818109
Energy: 0.40521943482409656
Energy: 0.4435948486454546
Energy: 0.41226168208492237
Energy: 0.4064407818915501
Energy: 0.4028350649453407
Energy: 0.4050114064632562
Energy: 0.4148260886195069
Energy: 0.41217248583635124
Energy: 0.4212401150002345
Energy: 0.40830539430129364
Energy: 0.38153618384983057
Energy: 0.408314072830452
Energy: 0.40789591221129745
Energy: 0.38285427042598075
Energy: 0.4160290543720247
Energy: 0.42706956149622505
Energy: 0.3843517231147417
Energy: 0.4096361033332031
Energy: 0.4270531976534127
Energy: 0.39007970166238554
Energy: 0.4125695192642319
Energy: 0.42726742414649416
Energy: 0.4099912819642961
Energy: 0.4218072567811614
Energy: 0.41519706239891346
Energy: 0.41516853614119725
Energy: 0.4149682986797467
Energy: 0.40851003556829707
Energy: 0.40587189649533084
Energy: 0.38613186621030626
Energy: 0.38427181389512216
Energy: 0.40639455126282437
Energy: 0.3856608571675641
Energy: 0.38471799581147725
Energy: 0.4088850895420759
Energy: 0.4033528218164535
Energy: 0.404663335100992
Energy: 0.4091387735499143
Energy: 0.41471378512134466
Energy: 0.40426317801685663
Energy: 0.42015249872794697
Energy: 0.40528017436637676
Energy: 0.40936725910753824
Energy: 0.4088139112981889
Energy: 0.40393775905060186
Energy: 0.4091562011795837
Energy: 0.4196342089702584
Energy: 0.4034484944153852
Energy: 0.4034434288659307
Energy: 0.4129897714339858
Energy: 0.4099617563636304
Energy: 0.4031941469928696
Energy: 0.4159495458998057
Energy: 0.40878037259607636
Energy: 0.4089210516619647
Energy: 0.4108649297267974
Energy: 0.4081341024083563
Energy: 0.41407392003107757
Energy: 0.4156533425158183
Energy: 0.4104317301019121
Energy: 0.41389720498791355
Energy: 0.41524915157676606
Energy: 0.4086582641653712
Energy: 0.41412126923306486
Energy: 0.4149718207350119
Energy: 0.422239206037037
Energy: 0.42102450074791664
Energy: 0.4152230929106918
Energy: 0.42277130032971105
Energy: 0.404588916698796
Energy: 0.43877088428462935
Energy: 0.4041428962706507
Energy: 0.4097252105181672
Energy: 0.4388652858537178
Energy: 0.4051679754860886
Energy: 0.40032276790821647
Energy: 0.4104075785925102
Energy: 0.42208611690820325
Energy: 0.4216076166555747
Energy: 0.41537151300849445
Energy: 0.41495187277791185
Energy: 0.4208400738430398
Energy: 0.3844811867057431
Energy: 0.410828924379573
Energy: 0.42703063310458694
Energy: 0.39034821833525923
Energy: 0.4090231387616383
Energy: 0.42725369146344316

minimum gb energy = 0.38153618384983057 eV
minimum distance =  2.63684584465359 Angstroms
sigma value = 17


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

Energy: 0.6932494117597799
Energy: 0.4422533327537572
Energy: 0.4547123173126091
Energy: 0.40777275641034566
Energy: 0.4420038203286454
Energy: 0.4211138351928739
Energy: 0.4868139207532375
Energy: 0.4347806174161799
Energy: 0.4384228637121633
Energy: 0.4460115497801878
Energy: 0.43531690449901994
Energy: 0.40744294961350747
Energy: 0.49412197547174097
Energy: 0.39385618137474004
Energy: 0.39356326833309724
Energy: 0.4344764544502413
Energy: 0.39408557796959676
Energy: 0.386138207765585
Energy: 0.4364728586600081
Energy: 0.39030800358249146
Energy: 0.3865854640837855
Energy: 0.43572651802385215
Energy: 0.38286010522162495
Energy: 0.42701103781374045
Energy: 0.37920222671580706
Energy: 0.3884693069687451
Energy: 0.39178613988252264
Energy: 0.3795378503825474
Energy: 0.38826953760948785
Energy: 0.391576773154119
Energy: 0.3868652319812554
Energy: 0.37334388191274603
Energy: 0.3914031740302762
Energy: 0.3824093897516945
Energy: 0.373421431588325
Energy: 0.3823478989510833
Energy: 0.37883167765194287
Energy: 0.37270996810587553
Energy: 0.37275285464911584
Energy: 0.373785971955159
Energy: 0.37560452245574893
Energy: 0.3783433211624794
Energy: 0.3736117631872673
Energy: 0.38425660055071237
Energy: 0.3858277461231527
Energy: 0.38625402296551314
Energy: 0.3854139280352923
Energy: 0.3990600503581092
Energy: 0.3744909465383071
Energy: 0.38462704955895416
Energy: 0.3846330401593106
Energy: 0.3753854727788893
Energy: 0.3894863054646551
Energy: 0.3733334108051491
Energy: 0.3731945648246122
Energy: 0.39216540495863217
Energy: 0.3919184574898098
Energy: 0.3733385887219762
Energy: 0.39218437948274637
Energy: 0.39008586204333445
Energy: 0.381354220895546
Energy: 0.39176030818084984
Energy: 0.39192915220793745
Energy: 0.3884504713218129
Energy: 0.37945552714172887
Energy: 0.38934956600755116
Energy: 0.3800637256711577
Energy: 0.4339240704897414
Energy: 0.4340369554037264
Energy: 0.37942392576979184
Energy: 0.4346796380913934
Energy: 0.43410795864404583
Energy: 0.37926137889118045
Energy: 0.43469442296654914
Energy: 0.43889919077523215
Energy: 0.39217186432063295
Energy: 0.4345796875985882
Energy: 0.4392381815351052
Energy: 0.4423132136912422
Energy: 0.4345504234059581
Energy: 0.43489965750082654
Energy: 0.4469421768950775
Energy: 0.43493813473193976
Energy: 0.4040792595039383
Energy: 0.44191970416475523
Energy: 0.43496389590037987
Energy: 0.4423305687201217
Energy: 0.4419408676715527
Energy: 0.4368121164460346
Energy: 0.45073103709236645
Energy: 0.49452452764627036
Energy: 0.44621386572442046
Energy: 0.41027615310813426
Energy: 0.43524675858813294
Energy: 0.4461337167338936
Energy: 0.434217070440854
Energy: 0.4321212426537628
Energy: 0.43563539709155275
Energy: 0.48164304116752504
Energy: 0.3971303045754228
Energy: 0.43608158056654106
Energy: 0.4815206577146546

minimum gb energy = 0.37270996810587553 eV
minimum distance =  2.65128601858085 Angstroms
sigma value = 17


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

Energy: 0.7423423238278873
Energy: 0.4389648689682451
Energy: 0.4114318260155231
Energy: 0.3905567189216379
Energy: 0.43872243157279545
Energy: 0.40790269079996083
Energy: 0.4711964033558085
Energy: 0.43633097225186174
Energy: 0.37908094977684414
Energy: 0.4326321415345809
Energy: 0.43447731667327955
Energy: 0.3969780685253592
Energy: 0.5261351358122074
Energy: 0.36367481845731614
Energy: 0.3891247836215701
Energy: 0.4371071783668447
Energy: 0.3627594757476127
Energy: 0.389443439481984
Energy: 0.4345372538332133
Energy: 0.38391463162181927
Energy: 0.3892758021344801
Energy: 0.4352357848378674
Energy: 0.3504092133757399
Energy: 0.38845706610521713
Energy: 0.37477944285077874
Energy: 0.37838851219204006
Energy: 0.3780083901140062
Energy: 0.3750408824993497
Energy: 0.36961516234161573
Energy: 0.37008728575070676
Energy: 0.3348477309999258
Energy: 0.36839219797291367
Energy: 0.360583376931838
Energy: 0.36117464078930667
Energy: 0.3685422268732309
Energy: 0.3607583467192209
Energy: 0.3411597444371504
Energy: 0.3685892929651327
Energy: 0.36826593506479816
Energy: 0.350328838691376
Energy: 0.3702583827695045
Energy: 0.36203015025085
Energy: 0.34199369722459655
Energy: 0.35253137180318855
Energy: 0.35655112863799737
Energy: 0.3578807040996471
Energy: 0.35263959238014986
Energy: 0.356804394439689
Energy: 0.342373845617857
Energy: 0.35745631459517907
Energy: 0.34196292286470636
Energy: 0.34260732318891146
Energy: 0.3490138245546202
Energy: 0.3417462550193238
Energy: 0.34156469854013427
Energy: 0.3555761731966293
Energy: 0.35569549021554037
Energy: 0.34148183387715636
Energy: 0.35506308876590276
Energy: 0.3558057969285691
Energy: 0.34923254695921135
Energy: 0.3411298208186385
Energy: 0.3547032315793754
Energy: 0.3547033036503401
Energy: 0.3415792874588961
Energy: 0.3547966183603813
Energy: 0.34296800357388124
Energy: 0.3418172416002435
Energy: 0.3415959819007228
Energy: 0.3434051534584026
Energy: 0.34419831066745127
Energy: 0.35456328878374177
Energy: 0.3501113834325883
Energy: 0.355363157021893
Energy: 0.3566846956464281
Energy: 0.3568812879778189
Energy: 0.35526864573291783
Energy: 0.3564414050206127
Energy: 0.36926321055182926
Energy: 0.36018501062109953
Energy: 0.35834130276162063
Energy: 0.3693752021449268
Energy: 0.3504684503331708
Energy: 0.36831011293553123
Energy: 0.3684149698128118
Energy: 0.3673624432317748
Energy: 0.35232872460149767
Energy: 0.3683907169331337
Energy: 0.3585286272316495
Energy: 0.3768126330990606
Energy: 0.4349497898291908
Energy: 0.36981313529994286
Energy: 0.3713570721679347
Energy: 0.38208615284053493
Energy: 0.37519766298621343
Energy: 0.3781506161728328
Energy: 0.34229054852164115
Energy: 0.4331194419442446
Energy: 0.4331808839398046
Energy: 0.3426060203201924
Energy: 0.43682396861256473
Energy: 0.3681703156800218
Energy: 0.3423793628397209
Energy: 0.43265382632698857
Energy: 0.43281523593952237
Energy: 0.36933668436919986
Energy: 0.43626487746235293
Energy: 0.3782211722253279
Energy: 0.4857268928518207
Energy: 0.4329273926854626
Energy: 0.3973330666346368
Energy: 0.44687478056228896
Energy: 0.36865181162797866
Energy: 0.37781210795234255
Energy: 0.5283395487055829
Energy: 0.3830405160393875
Energy: 0.3814024839425801
Energy: 0.4259809821623155
Energy: 0.3730059554225176
Energy: 0.43557002270722556
Energy: 0.5188292323895345
Energy: 0.43274852218483145
Energy: 0.42888472496098246
Energy: 0.43441834165577964
Energy: 0.4332853364618356
Energy: 0.4332654338291053
Energy: 0.34759487109740844
Energy: 0.43414873249936947
Energy: 0.4754651048829182
Energy: 0.38951377164828316
Energy: 0.43327937842655806
Energy: 0.3897659915104743
Energy: 0.34915477340508105
Energy: 0.4329950844969518
Energy: 0.43287362132149015
Energy: 0.3499727702745092
Energy: 0.435384594126701
Energy: 0.4757221927719575
Energy: 0.5272983247384644
Energy: 0.3809323285283579
Energy: 0.4275027654500237
Energy: 0.4335821925380542
Energy: 0.34723038898442565
Energy: 0.43264723903794855
Energy: 0.43280412866922036
Energy: 0.3471306635034914
Energy: 0.3891487494218588
Energy: 0.43277837747454123
Energy: 0.3644954497077351
Energy: 0.38969433943637416
Energy: 0.3761882982613378
Energy: 0.37843375810118957
Energy: 0.37807460104139035
Energy: 0.37641292241240876
Energy: 0.3835534643285076
Energy: 0.3789333161836875
Energy: 0.3354097468938478
Energy: 0.3828533482763128
Energy: 0.37663705110765244
Energy: 0.36180399290636517
Energy: 0.38166665982808706
Energy: 0.36065022400176827
Energy: 0.3384889434674585
Energy: 0.37217915294295095
Energy: 0.36866479794616813
Energy: 0.3387042129573419
Energy: 0.36947671157631884
Energy: 0.36857146030636123
Energy: 0.38598597297401815
Energy: 0.3584184299076862
Energy: 0.35889467254135743
Energy: 0.35948868155852925
Energy: 0.3484672159930891
Energy: 0.35880267493290335
Energy: 0.3418510656706064
Energy: 0.3523968583503464
Energy: 0.35691271213470727
Energy: 0.34181517604329553
Energy: 0.35259245717816295
Energy: 0.35620093871070485
Energy: 0.3442065552306716
Energy: 0.35600514977110476
Energy: 0.3554736303938187
Energy: 0.34494229740180343
Energy: 0.3531285763481744
Energy: 0.3507527860267383
Energy: 0.3420588059224061
Energy: 0.35315927323709634
Energy: 0.3533935521919582
Energy: 0.36271774493027786
Energy: 0.35596020882780843
Energy: 0.3536065156840035
Energy: 0.34919784016630157
Energy: 0.3447120392093183
Energy: 0.3417764814087474
Energy: 0.37625203203273083
Energy: 0.34234033148126025
Energy: 0.3417261340309068
Energy: 0.37673086670813194
Energy: 0.3564966257639552
Energy: 0.36298061898401784
Energy: 0.3569434668135541
Energy: 0.3539715371420855
Energy: 0.3600487625311462
Energy: 0.3726098650072618
Energy: 0.3596885413458162
Energy: 0.35980203779804704
Energy: 0.3733243517465374
Energy: 0.3590247716204247
Energy: 0.35856170804583615
Energy: 0.3733411685705084
Energy: 0.3574595830213942
Energy: 0.37847856298729116
Energy: 0.37360268419637027
Energy: 0.35736138741290896
Energy: 0.36933103110159793
Energy: 0.48418631266686174
Energy: 0.3699883535389273
Energy: 0.37029954583236735
Energy: 0.37145007432142196
Energy: 0.3443650934416897
Energy: 0.37710745072885005
Energy: 0.34548392570891445
Energy: 0.4331546569624762
Energy: 0.43262207325142
Energy: 0.36978826947155274
Energy: 0.43374229712527473
Energy: 0.3780945066820144
Energy: 0.3420346874317529
Energy: 0.43479675041596777
Energy: 0.382157291049134
Energy: 0.3780730790056945
Energy: 0.4334955773952899
Energy: 0.3680137236226735
Energy: 0.3688243834591758
Energy: 0.4328622670299257
Energy: 0.43421877772191964
Energy: 0.3754050040937907
Energy: 0.4354641399430595
Energy: 0.402363812841665
Energy: 0.48830529453746474
Energy: 0.3793576017439708
Energy: 0.4240629518119961
Energy: 0.4333347160796205
Energy: 0.37911534505837347
Energy: 0.4326605827196592
Energy: 0.5268930579209663
Energy: 0.39718924292831065
Energy: 0.37371684442063186
Energy: 0.4343099372771948
Energy: 0.36937907502653583
Energy: 0.43265840737892314
Energy: 0.3499787355339911
Energy: 0.43648899359963583
Energy: 0.4328757559888199
Energy: 0.3508315402438631
Energy: 0.4348889197576072
Energy: 0.42323026306288103

minimum gb energy = 0.3348477309999258 eV
minimum distance =  2.63077526998734 Angstroms
sigma value = 57


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

Energy: 0.32149731227476563
Energy: 0.5447651748328303
Energy: 0.39761581460929163
Energy: 0.3492723154402445
Energy: 0.5804398487254667
Energy: 0.3885959309385558
Energy: 0.4609316302703025
Energy: 0.36795906163755426
Energy: 0.3577427957032445
Energy: 0.427547421737204
Energy: 0.4351555199712968
Energy: 0.3835625831096058
Energy: 0.5002835540732012
Energy: 0.3440816203822172
Energy: 0.344095297527237
Energy: 0.4255256798682301
Energy: 0.34410819847573115
Energy: 0.3772775857246529
Energy: 0.42262989367212533
Energy: 0.3439630439705704
Energy: 0.3755172777273471
Energy: 0.42304642099541884
Energy: 0.36071918300954736
Energy: 0.3827541940346553
Energy: 0.35834615980371065
Energy: 0.3651564417250599
Energy: 0.3582086414493307
Energy: 0.35857919365344115
Energy: 0.3642546176037814
Energy: 0.35342566735078756
Energy: 0.3135016834828166
Energy: 0.3625533794307115
Energy: 0.3444084898942379
Energy: 0.3313124261829947
Energy: 0.36265927505976253
Energy: 0.34402257777849227
Energy: 0.33148823642734865
Energy: 0.36671505471643473
Energy: 0.36256303116450433
Energy: 0.3337304735884825
Energy: 0.3659372571740911
Energy: 0.3368401602092048
Energy: 0.4423079554585704
Energy: 0.3295812054283532
Energy: 0.3296872466315976
Energy: 0.34267148104429995
Energy: 0.32954727811561113
Energy: 0.33639478192895766
Energy: 0.33262513935983307
Energy: 0.34045131079849605
Energy: 0.33076558332864936
Energy: 0.333289840031497
Energy: 0.31855071704357335
Energy: 0.33120724462658996
Energy: 0.3309682787406825
Energy: 0.33388679700231605
Energy: 0.3337991478074064
Energy: 0.3310294501171041
Energy: 0.33398092615120567
Energy: 0.33401656854378925
Energy: 0.320086661519868
Energy: 0.31678933102293877
Energy: 0.3278779411539626
Energy: 0.3256925444351114
Energy: 0.32517529949032503
Energy: 0.3276542478151669
Energy: 0.33360315897291914
Energy: 0.3215096490779235
Energy: 0.3245113259018954
Energy: 0.3343756102841208
Energy: 0.3200696980374989
Energy: 0.32797853795631504
Energy: 0.3166650481013649
Energy: 0.34886996436325957
Energy: 0.33047028100811376
Energy: 0.32942754892268516
Energy: 0.34919911510990126
Energy: 0.3324597047483753
Energy: 0.31734656289308055
Energy: 0.3286269862534337
Energy: 0.31676136301429353
Energy: 0.31850041316246036
Energy: 0.3238894909914178
Energy: 0.3171069611934896
Energy: 0.317024959351335
Energy: 0.32807363920396654
Energy: 0.32779985870882133
Energy: 0.3167974946633447
Energy: 0.330128657960574
Energy: 0.32780148049836055
Energy: 0.3403906319501452
Energy: 0.3388918966609775
Energy: 0.3314107636369341
Energy: 0.3326807168842683
Energy: 0.33732715286712917
Energy: 0.331614077049262
Energy: 0.3178592571129932
Energy: 0.33705145895199456
Energy: 0.3309748254247961
Energy: 0.3389739650484144
Energy: 0.33475455058627696
Energy: 0.34026925292077476
Energy: 0.3187571996739401
Energy: 0.3419514812993045
Energy: 0.34088183899523666
Energy: 0.3191857469793641
Energy: 0.34107571191755937
Energy: 0.341526132713762
Energy: 0.36293041801510517
Energy: 0.3442323321746049
Energy: 0.36385189488083647
Energy: 0.36384299469686593
Energy: 0.33481663309400156
Energy: 0.36275361409207885
Energy: 0.41575704953627124
Energy: 0.3454242628550593
Energy: 0.34543240055963503
Energy: 0.3723300155718602
Energy: 0.34013757212907564
Energy: 0.3582139231602913
Energy: 0.46470351333387094
Energy: 0.36992438336206934
Energy: 0.36774220024013055
Energy: 0.3671400168238339
Energy: 0.36813046600081123
Energy: 0.3742342629690937
Energy: 0.31732166045295646
Energy: 0.42942979489656946
Energy: 0.36251820078394753
Energy: 0.33792679168712986
Energy: 0.42721730271385006
Energy: 0.36355066382453033
Energy: 0.3343634810650804
Energy: 0.4258933815496493
Energy: 0.41676019951715565
Energy: 0.33377704629200916
Energy: 0.4245914768117579
Energy: 0.3939711352206028
Energy: 0.46146061217799145
Energy: 0.36288857184068174
Energy: 0.355635254778857
Energy: 0.3679678448218725
Energy: 0.36759939699312344
Energy: 0.3577085177076052
Energy: 0.5031237483673009
Energy: 0.356870230646364
Energy: 0.3638110360792618
Energy: 0.42740228489658455
Energy: 0.3570002240057029
Energy: 0.4091738786110697
Energy: 0.4939689945894485
Energy: 0.42681650779962793
Energy: 0.4165979008662944
Energy: 0.42525362586606036
Energy: 0.4254840761884932
Energy: 0.3613515020013735
Energy: 0.32018038027263596
Energy: 0.41764554013062605
Energy: 0.38337927655788573
Energy: 0.34618131762636456
Energy: 0.42904538787352864
Energy: 0.37997437334295747

minimum gb energy = 0.3135016834828166 eV
minimum distance =  2.66087279737044 Angstroms
sigma value = 43


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

Energy: 0.2782961308826124
Energy: 0.4334372496028282
Energy: 0.3485909985588554
Energy: 0.2979611720098058
Energy: 0.3843460876638936
Energy: 0.33374921487057635
Energy: 0.39759957492591413
Energy: 0.3233230236116504
Energy: 0.30549446990670276
Energy: 0.3758114075532018
Energy: 0.3231687936356914
Energy: 0.30083917938520643
Energy: 0.4349896928105808
Energy: 0.28963241753343816
Energy: 0.2859085892843573
Energy: 0.3742208219845885
Energy: 0.2897014747893268
Energy: 0.3056610563051028
Energy: 0.37063654886654984
Energy: 0.28571145958180916
Energy: 0.30650138299564483
Energy: 0.32883935819078347
Energy: 0.30566788446508014
Energy: 0.3311835742382475
Energy: 0.3284014507745771
Energy: 0.31291395055375887
Energy: 0.3049453639420413
Energy: 0.32881846741247545
Energy: 0.32971574129912523
Energy: 0.3005234370285266
Energy: 0.2686468203798854
Energy: 0.32758740974388684
Energy: 0.2960994165617172
Energy: 0.2833188391424391
Energy: 0.3274353618329612
Energy: 0.28683023723267587
Energy: 0.3724278459959039
Energy: 0.32751609654598735
Energy: 0.32743405065685793
Energy: 0.2983314338053245
Energy: 0.33066286962457914
Energy: 0.28844298414674313
Energy: 0.38889300630738194
Energy: 0.27739473327536934
Energy: 0.2830257536717526
Energy: 0.2986862866375385
Energy: 0.2774777306990178
Energy: 0.28281547796941015
Energy: 0.30064000730627444
Energy: 0.28230738836422353
Energy: 0.29933555144380547
Energy: 0.3015260058295728
Energy: 0.275218326385001
Energy: 0.29932204535330603
Energy: 0.28920336618770537
Energy: 0.2801707680166912
Energy: 0.2800593679245457
Energy: 0.2937014225872041
Energy: 0.2801464882450879
Energy: 0.2799387828836371
Energy: 0.2662272469404296
Energy: 0.28215913929061337
Energy: 0.2778283566986456
Energy: 0.2764387693728118
Energy: 0.28217469097894976
Energy: 0.27538012869731243
Energy: 0.3024293299237749
Energy: 0.28230386710201877
Energy: 0.2821976441712004
Energy: 0.2884735423963577
Energy: 0.2823312350252594
Energy: 0.2806044061600459
Energy: 0.36993626669137414
Energy: 0.28689815367521504
Energy: 0.3030501097643667
Energy: 0.33875307106265834
Energy: 0.27481171334194376
Energy: 0.3031253938175515
Energy: 0.2721002328335007
Energy: 0.27535441676034234
Energy: 0.27203403685868904
Energy: 0.2731737880759941
Energy: 0.26710897937768147
Energy: 0.2721567125655246
Energy: 0.27192908717456665
Energy: 0.2732972196663871
Energy: 0.2731425420887617
Energy: 0.2718526847982392
Energy: 0.2726559942808368
Energy: 0.2728759127838501
Energy: 0.2680718992661549
Energy: 0.2673658298711708
Energy: 0.2674262108294023
Energy: 0.27150403292394987
Energy: 0.2673674234530327
Energy: 0.27146010748470134
Energy: 0.2738742300192093
Energy: 0.26750658184731146
Energy: 0.26720484085452184
Energy: 0.2748507707499629
Energy: 0.2674733563713447
Energy: 0.27421643317805106
Energy: 0.26726160044557157
Energy: 0.2742891710045699
Energy: 0.2739110693593077
Energy: 0.26737510318181307
Energy: 0.2956351665321467
Energy: 0.27474057273067776
Energy: 0.2673774111757725
Energy: 0.2745191390458567
Energy: 0.26728592859971134
Energy: 0.26849562049592135
Energy: 0.3173528159702099
Energy: 0.2674269320453227
Energy: 0.2680009294955314
Energy: 0.2777117780335844
Energy: 0.27742530410149974
Energy: 0.26772230621684867
Energy: 0.29677671776290576
Energy: 0.27765361043128794
Energy: 0.2839824128234641
Energy: 0.27213283763180013
Energy: 0.2719327304898059
Energy: 0.2812058554256781
Energy: 0.27228259852199693
Energy: 0.2773469988896559
Energy: 0.26821447149260474
Energy: 0.2721055245282627
Energy: 0.27214386675302005
Energy: 0.27309453990201554
Energy: 0.2722239863014585
Energy: 0.273074612861185
Energy: 0.28200028096261454
Energy: 0.27520456923337705
Energy: 0.27518531142426494
Energy: 0.2820316345919588
Energy: 0.2748461157099223
Energy: 0.27493633500998577
Energy: 0.28222126187107105
Energy: 0.28128903036717173
Energy: 0.28203967449704315
Energy: 0.28323230131483956
Energy: 0.27180574766349336
Energy: 0.28215207428821537
Energy: 0.3774966696859161
Energy: 0.2896633373208396
Energy: 0.2945008380678757
Energy: 0.29482766064884813
Energy: 0.27651753781679034
Energy: 0.2949319774022741
Energy: 0.3299791571410104
Energy: 0.2994862688894869
Energy: 0.2993661200207039
Energy: 0.27849192300070513
Energy: 0.2996468913286511
Energy: 0.2773860338858135
Energy: 0.26755614891949725
Energy: 0.2995282360973873
Energy: 0.29868262831503695
Energy: 0.27675403750292327
Energy: 0.29939635109185786
Energy: 0.2802976477628067
Energy: 0.299152032640304
Energy: 0.29756024871120035
Energy: 0.2897894052159799
Energy: 0.2826384612359496
Energy: 0.29825301941048404
Energy: 0.28748590242548117
Energy: 0.32883028087103355
Energy: 0.29044779581368846
Energy: 0.3274717901086132
Energy: 0.3295554905745383
Energy: 0.28203637305393453
Energy: 0.32753483981041975
Energy: 0.4062159922327514
Energy: 0.2830165382553648
Energy: 0.29114469551801764
Energy: 0.3282966881643139
Energy: 0.28296453206020783
Energy: 0.2912435615666725
Energy: 0.4055475334643203
Energy: 0.3234190792879694
Energy: 0.3216496236019329
Energy: 0.32809974989465174
Energy: 0.3231460787168516
Energy: 0.32103176089465946
Energy: 0.2727667512174672
Energy: 0.37407062847903705
Energy: 0.3116686724117282
Energy: 0.2894095850850032
Energy: 0.3741095975968322
Energy: 0.30018807732189023
Energy: 0.3387292807312597
Energy: 0.34489443362027844
Energy: 0.33278941217699454
Energy: 0.32100334191583285
Energy: 0.37625084549918364
Energy: 0.32969937491054474
Energy: 0.4047447697150504
Energy: 0.3022771637358118
Energy: 0.3153346069751971
Energy: 0.32874224184501233
Energy: 0.3247603623477546
Energy: 0.35701322333342317
Energy: 0.4336045955776836
Energy: 0.2920888917526797
Energy: 0.3257134197446658
Energy: 0.3742553465276793
Energy: 0.29878708710166163
Energy: 0.3262680766983365
Energy: 0.3975677406413206
Energy: 0.35880306794823086
Energy: 0.3333113305117617
Energy: 0.3750937605389789
Energy: 0.3765196921848661
Energy: 0.3562720636074195

minimum gb energy = 0.2662272469404296 eV
minimum distance =  2.62096985496708 Angstroms
sigma value = 81


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

Energy: 0.018803703654399474
Energy: 0.01937630379806435
Energy: 0.01917734620757323
Energy: 0.02028729221394948
Energy: 0.02059700729477492
Energy: 0.01928383010388702
Energy: 0.04139529099652434
Energy: 0.019599356467026003
Energy: 0.019721003498353654
Energy: 0.040684232010349056
Energy: 0.021087657516082832
Energy: 0.01949437223523899
Energy: 0.040369160604663376
Energy: 0.01914920923204308
Energy: 0.019371406089345494
Energy: 0.04006099421457149
Energy: 0.019159286098586865
Energy: 0.04035661529389495
Energy: 0.02070034096072798
Energy: 0.019258277578567743
Energy: 0.019317956373438177
Energy: 0.021040980627206378
Energy: 0.019315337247164374
Energy: 0.04057373779171348
Energy: 0.04030797899809385
Energy: 0.04018283223613458
Energy: 0.040271738830563425
Energy: 0.04084015651803755
Energy: 0.0400395170795653
Energy: 0.040531179666226304
Energy: 0.019770052299114698
Energy: 0.019676613659117277
Energy: 0.019335816716984925
Energy: 0.020417112379934727
Energy: 0.019483459769363956
Energy: 0.019268393931913128
Energy: 0.04079523232137372
Energy: 0.019347798351028133
Energy: 0.019564908950695615
Energy: 0.04035260841350986
Energy: 0.021019855481287205
Energy: 0.019727674010830126
Energy: 0.04019935882971629
Energy: 0.01928553473861932
Energy: 0.01932211530027564
Energy: 0.04014771398766451
Energy: 0.019473998116367925
Energy: 0.041308851892035155
Energy: 0.019769535131495573
Energy: 0.019490351196152486
Energy: 0.0417120979035308
Energy: 0.020322480563544874
Energy: 0.019303942407787687
Energy: 0.041470558445038004
Energy: 0.019639139329455935
Energy: 0.04000491258561207
Energy: 0.04004772192837829
Energy: 0.019453615968720812
Energy: 0.04005066410913743
Energy: 0.04016578713292854

minimum gb energy = 0.018803703654399474 eV
minimum distance =  2.8232771707075 Angstroms
sigma value = 3


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

Energy: 0.3419143141198843
Energy: 0.333082578147203
Energy: 0.33558019615922485
Energy: 0.32298661963033704
Energy: 0.3329924961610541
Energy: 0.3017331245176939
Energy: 0.3453189317626811
Energy: 0.3329784722685025
Energy: 0.3329646519123313
Energy: 0.3337672598503476
Energy: 0.3330399894152381
Energy: 0.34036193575682433
Energy: 0.35570124084098304
Energy: 0.3162221275933655
Energy: 0.3153775789599627
Energy: 0.34293248684365407
Energy: 0.3157315947100099
Energy: 0.33301296592424695
Energy: 0.3195105937984877
Energy: 0.3148886570720511
Energy: 0.31613630282586314
Energy: 0.319400830972496
Energy: 0.28550669549081303
Energy: 0.3371805861569497
Energy: 0.2907864603975544
Energy: 0.3100194244153797
Energy: 0.3101641576207114
Energy: 0.2907245859495392
Energy: 0.33274652738481286
Energy: 0.3090351909453221
Energy: 0.32471270027473936
Energy: 0.33961502168245455
Energy: 0.31428857577694147
Energy: 0.2706547786225734
Energy: 0.3396609545861423
Energy: 0.28776699315437104
Energy: 0.31932808310952066
Energy: 0.2958869997718872
Energy: 0.29582582403691277
Energy: 0.3355169716683486
Energy: 0.2992899664625778
Energy: 0.33361574960380896
Energy: 0.3193391909595982
Energy: 0.29194924622168383
Energy: 0.2925445476791977
Energy: 0.3193270626057807
Energy: 0.29116478477350766
Energy: 0.29154330624971014
Energy: 0.30708933128743465
Energy: 0.3270019643773373
Energy: 0.3251688062921667
Energy: 0.3421661765855301
Energy: 0.27211888002420304
Energy: 0.33816217678793187
Energy: 0.2756267796708835
Energy: 0.2972372820205644
Energy: 0.29581521760236984
Energy: 0.2756323926900862
Energy: 0.2980423413417034
Energy: 0.2975306422280941
Energy: 0.324418681342849
Energy: 0.2984810890708625
Energy: 0.2982223839951927
Energy: 0.26188407142378206
Energy: 0.2619797508834887
Energy: 0.296485124494864
Energy: 0.2782450616672967
Energy: 0.3339252648764596
Energy: 0.330751470303043
Energy: 0.2755206774534826
Energy: 0.330310477083713
Energy: 0.27489814190385753
Energy: 0.2751538444707343
Energy: 0.3081574232873505
Energy: 0.2767600827792885
Energy: 0.27556015430423936
Energy: 0.25266843388356885
Energy: 0.27807997212165164
Energy: 0.31828464658621985
Energy: 0.2636206708287275
Energy: 0.32009685782696484
Energy: 0.2780705512180919
Energy: 0.2615133795587573
Energy: 0.32097413312804324
Energy: 0.31874170921486666
Energy: 0.26153783099533856
Energy: 0.26131630150664653
Energy: 0.3182922080184365
Energy: 0.26320875036964236
Energy: 0.26119951388722423
Energy: 0.31861796836935735
Energy: 0.31045495489703123
Energy: 0.31044964182707707
Energy: 0.2896685816854549
Energy: 0.31525408376535885
Energy: 0.3105065222084558
Energy: 0.2576435273142897
Energy: 0.3102434817844123
Energy: 0.3097266505550875
Energy: 0.2541728444369329
Energy: 0.3087360682049736
Energy: 0.25388473989622146
Energy: 0.25388985085201954
Energy: 0.3068730640823978
Energy: 0.30711853531429556
Energy: 0.25403520244331207
Energy: 0.2546000633391388
Energy: 0.2852380065504401
Energy: 0.31324414502477316
Energy: 0.2856842001316542
Energy: 0.3075833543906019
Energy: 0.2571340679189862
Energy: 0.25509186636637526
Energy: 0.3074203116451503
Energy: 0.31491782134366864
Energy: 0.25401099328889853
Energy: 0.25388285011655687
Energy: 0.31529880057475995
Energy: 0.2575737999090927
Energy: 0.25379762737043465
Energy: 0.31468269438126883
Energy: 0.3105629712773161
Energy: 0.3106351868609414
Energy: 0.31586612135207537
Energy: 0.31987594955160853
Energy: 0.31009110921040617
Energy: 0.26680568920229325
Energy: 0.31041245149310265
Energy: 0.2622795820531263
Energy: 0.2624871629085863
Energy: 0.3101864767162035
Energy: 0.26149562857293734
Energy: 0.2610160109795518
Energy: 0.3222621999170718
Energy: 0.3227076446838669
Energy: 0.2610574835313408
Energy: 0.3232213246033854
Energy: 0.31933647490667416
Energy: 0.31954940905805757
Energy: 0.27764625495136736
Energy: 0.2772545950914848
Energy: 0.2557845700536917
Energy: 0.2767896807180217
Energy: 0.3112986819997612
Energy: 0.2621718599966674
Energy: 0.27560658758520123
Energy: 0.2751967852438011
Energy: 0.26202268426327346
Energy: 0.27857395874196905
Energy: 0.27507785909128085
Energy: 0.32877389660604256
Energy: 0.320280493693404
Energy: 0.3196135055231549
Energy: 0.2635984948585731
Energy: 0.3084251177289294
Energy: 0.2967164555486275
Energy: 0.29770485644768857
Energy: 0.3199662911151364
Energy: 0.28407399654617477
Energy: 0.2973579724260189
Energy: 0.26615578607105483
Energy: 0.2958543522402199
Energy: 0.2822395146660306
Energy: 0.3111074954509103
Energy: 0.3411459425531564
Energy: 0.2822314756566514
Energy: 0.3123299604223794
Energy: 0.34074863651495185
Energy: 0.2657242236048507
Energy: 0.3196359209978324
Energy: 0.3064285099809324
Energy: 0.2648130266514745
Energy: 0.319453432639432
Energy: 0.27929137882520394
Energy: 0.2997546439174611
Energy: 0.32713861904201735
Energy: 0.32581999712427395
Energy: 0.29598714297243994
Energy: 0.32317550217078916
Energy: 0.32035934039864494
Energy: 0.3249264446065864
Energy: 0.2998110517708154
Energy: 0.30043692062443017
Energy: 0.32509645909241863
Energy: 0.26086725770844205
Energy: 0.30148129188244244
Energy: 0.35672095175261237
Energy: 0.29780986761064343
Energy: 0.3433223389448256
Energy: 0.3459669151171697
Energy: 0.27836047050358376
Energy: 0.3265102370712223
Energy: 0.2986565003095356
Energy: 0.31957724636552437
Energy: 0.31899099226189614
Energy: 0.2986194968250907
Energy: 0.3221950180853862
Energy: 0.31818215853610543

minimum gb energy = 0.25266843388356885 eV
minimum distance =  2.63244067844172 Angstroms
sigma value = 67


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

Energy: 0.4210149482915209
Energy: 0.4162418924843158
Energy: 0.41474731237050233
Energy: 0.3321165150736752
Energy: 0.47354063343552877
Energy: 0.41598451685033805
Energy: 0.42116183274693836
Energy: 0.4150032385348069
Energy: 0.40993196072315713
Energy: 0.40432676542972473
Energy: 0.4130625874269049
Energy: 0.38118926059150315
Energy: 0.41519373871357756
Energy: 0.37825971325107594
Energy: 0.37941992362447696
Energy: 0.40562502925681787
Energy: 0.34386848715887747
Energy: 0.37815264817319505
Energy: 0.38069809613581623
Energy: 0.41433685373881873
Energy: 0.3784353454883201
Energy: 0.3813574223249546
Energy: 0.3406563527336599
Energy: 0.41342942610546685
Energy: 0.37620482754890927
Energy: 0.4149384156241211
Energy: 0.3796256220814494
Energy: 0.3761885717065371
Energy: 0.41256799670186967
Energy: 0.38127147950106505
Energy: 0.3964996267168588
Energy: 0.3699786528322259
Energy: 0.37621898408576354
Energy: 0.3462093263375125
Energy: 0.37038064335959225
Energy: 0.37569483038781787
Energy: 0.38267869619519224
Energy: 0.3847728401989826
Energy: 0.38291019207168503
Energy: 0.38277701545988535
Energy: 0.3454323863734143
Energy: 0.3455167593778809
Energy: 0.38290279891772694
Energy: 0.3280998712882567
Energy: 0.3470902634107111
Energy: 0.38298329886878046
Energy: 0.32520797273359736
Energy: 0.34596601707602315
Energy: 0.3285966215519122
Energy: 0.3998262358966519
Energy: 0.4006862324663468
Energy: 0.40190840023278995
Energy: 0.3434865507834304
Energy: 0.3640623842567716
Energy: 0.32522976302171525
Energy: 0.3469558667041749
Energy: 0.3497699390918635
Energy: 0.3268694212784291
Energy: 0.345616730475119
Energy: 0.34456798872463823
Energy: 0.32363441417110006
Energy: 0.35027024224156905
Energy: 0.34655644683489506
Energy: 0.32529027827088497
Energy: 0.39333398181352125
Energy: 0.37566509615110005
Energy: 0.32700470997108294
Energy: 0.3913074340640665
Energy: 0.3904634504270612
Energy: 0.3274773730656408
Energy: 0.36304486235584205
Energy: 0.3242351263822022
Energy: 0.3283304773741406
Energy: 0.3290349519507715
Energy: 0.3890900213242688
Energy: 0.3288629521796198
Energy: 0.3258045742239648
Energy: 0.3244488531846029
Energy: 0.39094101364833883
Energy: 0.33667429492497913
Energy: 0.3875349785098175
Energy: 0.3249420132545846
Energy: 0.35857418093775834
Energy: 0.38833721499802504
Energy: 0.3595127553626291
Energy: 0.3267779960060557
Energy: 0.3302335282456857
Energy: 0.3883967752887263
Energy: 0.32590278013068097
Energy: 0.324414733773327
Energy: 0.38980841273242123
Energy: 0.39494738029780985
Energy: 0.3922368271955331
Energy: 0.3635086247554138
Energy: 0.3247940577814821
Energy: 0.391322221753716
Energy: 0.3483718378711126
Energy: 0.3232011097537425
Energy: 0.3301422065809872
Energy: 0.34898551764711816
Energy: 0.32008827948562574
Energy: 0.34389304905574153
Energy: 0.3445765599543173
Energy: 0.40081304725001937
Energy: 0.40303343709740724
Energy: 0.34477220460274827
Energy: 0.36423982179413344
Energy: 0.34390007324208777
Energy: 0.38875012713111395
Energy: 0.32688349429534014
Energy: 0.3586194202681138
Energy: 0.33188910446361913
Energy: 0.3258689293657233
Energy: 0.3585516921869322
Energy: 0.3444712019496782
Energy: 0.38081106531543873
Energy: 0.34851867374559203
Energy: 0.34416816932839467
Energy: 0.3801720835859792
Energy: 0.346954212845121
Energy: 0.3455715594334801
Energy: 0.39118778285006206
Energy: 0.33207233041030226
Energy: 0.3450919592364939
Energy: 0.3938668996419563
Energy: 0.3311122067799387
Energy: 0.4150639946386298
Energy: 0.35239001914302776
Energy: 0.33037611987130433
Energy: 0.4022856931918718
Energy: 0.36643473512306673
Energy: 0.32972876507886484
Energy: 0.39263188961508694
Energy: 0.3814583430053788
Energy: 0.37797032196800495
Energy: 0.39269699983809453
Energy: 0.38149162596879715
Energy: 0.3822673470318601

minimum gb energy = 0.32008827948562574 eV
minimum distance =  2.62847768888077 Angstroms
sigma value = 33


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

Energy: 0.48578064475885274
Energy: 0.4612873816336468
Energy: 0.48398148692610593
Energy: 0.3818356505122321
Energy: 0.46121130527987114
Energy: 0.4545464816854542
Energy: 0.4784254241952841
Energy: 0.40928570529224123
Energy: 0.409601918302104
Energy: 0.45268434370580224
Energy: 0.45282701357096394
Energy: 0.41439787322938654
Energy: 0.4796136210547413
Energy: 0.4064803996443878
Energy: 0.44981464555167044
Energy: 0.41123389336295463
Energy: 0.4075925141793654
Energy: 0.44856438432412354
Energy: 0.45530281405572065
Energy: 0.43340383476212085
Energy: 0.45020463438974095
Energy: 0.45669767981336645
Energy: 0.40595373442486715
Energy: 0.4498713052335744
Energy: 0.40795513910137815
Energy: 0.4553633301702099
Energy: 0.37295470166170513
Energy: 0.4080428712572345
Energy: 0.45237945124237927
Energy: 0.37354105182930497
Energy: 0.36681983544609137
Energy: 0.3673751944066307
Energy: 0.3685071756562751
Energy: 0.3696801428905663
Energy: 0.36997006195889165
Energy: 0.4080631475297736
Energy: 0.4086353134924429
Energy: 0.41679912179732903
Energy: 0.41461006950290863
Energy: 0.40873216730633
Energy: 0.41529175364755444
Energy: 0.4096182553580538
Energy: 0.41420036415951567
Energy: 0.3673144786728769
Energy: 0.37360506981452535
Energy: 0.4085330671146727
Energy: 0.3698285375438278
Energy: 0.40903885494000386
Energy: 0.36800034586652924
Energy: 0.41234544515073535
Energy: 0.37556089802831794
Energy: 0.3742429422427133
Energy: 0.36764510628071
Energy: 0.44081597214839796
Energy: 0.4038284754402402
Energy: 0.37135880550448663
Energy: 0.367886369175311
Energy: 0.40385652990776444
Energy: 0.36838451364965363
Energy: 0.36757614921513926
Energy: 0.4059460927255854
Energy: 0.37748928376424723
Energy: 0.3689455797922906
Energy: 0.36928611559254465
Energy: 0.368776586211827
Energy: 0.4319298712780051
Energy: 0.3678140254540943
Energy: 0.3963914928736675
Energy: 0.3679487005827911
Energy: 0.3678449983718206
Energy: 0.37761617997259667
Energy: 0.3675650266980254
Energy: 0.3672713561805919
Energy: 0.4384930573531499
Energy: 0.3674608116179897
Energy: 0.36731589755519123
Energy: 0.37319551319521127
Energy: 0.36773233021343144
Energy: 0.3591550760911425
Energy: 0.3739316488230487
Energy: 0.37280846290660047
Energy: 0.35804198832132195
Energy: 0.39654219929300494
Energy: 0.43524738568301324
Energy: 0.3559693781672791
Energy: 0.40877986734709604
Energy: 0.37353934997097743
Energy: 0.35598246067202227
Energy: 0.4095188584900629
Energy: 0.3735216066259921
Energy: 0.3741133216171886
Energy: 0.4225403273643969
Energy: 0.439176617519151
Energy: 0.37385319861478294
Energy: 0.3775488553462552
Energy: 0.3737095996215082
Energy: 0.4800490906342367
Energy: 0.37755223340541144
Energy: 0.4221724337448447
Energy: 0.4804929887065844
Energy: 0.3800947509087688
Energy: 0.39928645729053774
Energy: 0.475398267523564
Energy: 0.40821349734464474
Energy: 0.40810197021058303
Energy: 0.4530238416295604
Energy: 0.4083435378011901
Energy: 0.45303274264328425
Energy: 0.45793815025478296
Energy: 0.413386881826909
Energy: 0.37789780874377416
Energy: 0.3807841392275365
Energy: 0.41266029518412806
Energy: 0.43205006562203974
Energy: 0.4333849272398684
Energy: 0.4554593094900732
Energy: 0.40840521224339854
Energy: 0.4336530842464656
Energy: 0.45278496950921493
Energy: 0.40907916720216986
Energy: 0.4804673676810096
Energy: 0.4335641984450411
Energy: 0.4496311522241323
Energy: 0.41306415778572314
Energy: 0.41424968205285967
Energy: 0.4499909140979147
Energy: 0.41043136797672425
Energy: 0.4068615572579853
Energy: 0.44994213437372044
Energy: 0.4541202067075007
Energy: 0.4079356818752564
Energy: 0.4500810790215574
Energy: 0.4080325181958285
Energy: 0.4089098699819497
Energy: 0.373602922917902
Energy: 0.408366555304772
Energy: 0.45244129515626036
Energy: 0.4138022985714835
Energy: 0.36739712906521005
Energy: 0.3696806855983835
Energy: 0.37096804943977896
Energy: 0.3670055230942895
Energy: 0.3685013889203401
Energy: 0.4062378284793579
Energy: 0.4083382420730834
Energy: 0.41580501256018465
Energy: 0.4165547243944814
Energy: 0.40831365208826914
Energy: 0.4131588525849188
Energy: 0.3726798031647424
Energy: 0.41228261931544197
Energy: 0.3672179914230752
Energy: 0.373039513319533
Energy: 0.4129584364502375
Energy: 0.3695278982299518
Energy: 0.4092995758597553
Energy: 0.4029992047196012
Energy: 0.36799352395106566
Energy: 0.41095456276323344
Energy: 0.40379022579366924
Energy: 0.3789829412201752
Energy: 0.4422511355417678
Energy: 0.40326755593535996
Energy: 0.37166605974090255
Energy: 0.367916963943838
Energy: 0.4034946687471889
Energy: 0.368848065424641
Energy: 0.36762809444543504
Energy: 0.40592077071004024
Energy: 0.3688875933379877
Energy: 0.4097159556789215
Energy: 0.37015375434505826
Energy: 0.36853542300622716
Energy: 0.4326533985726627
Energy: 0.3675286698409723
Energy: 0.3690645234473144
Energy: 0.4097914151054842
Energy: 0.3675537835761258
Energy: 0.3788681733372279
Energy: 0.3675962175742197
Energy: 0.3701886037938228
Energy: 0.43866498798198955
Energy: 0.3677944620890321
Energy: 0.36775987410601885
Energy: 0.3740350703805862
Energy: 0.36777071189749416
Energy: 0.35586105052317335
Energy: 0.37289443446014375
Energy: 0.3731229650272407
Energy: 0.357503289759697
Energy: 0.3944308430044328
Energy: 0.4340659873794985
Energy: 0.35609943324564686
Energy: 0.4118489225259698
Energy: 0.3728557886549026
Energy: 0.3563797687207326
Energy: 0.41010220943604225
Energy: 0.3734392440577741
Energy: 0.40972453750909654
Energy: 0.4218678576617903
Energy: 0.41526720119697463
Energy: 0.3736613316104609
Energy: 0.37733822597073713
Energy: 0.4095532725866919
Energy: 0.48049867567544224
Energy: 0.3776019514682833
Energy: 0.42241133401800945
Energy: 0.48081847808388906
Energy: 0.35943246112708443
Energy: 0.4369155441247558
Energy: 0.4701672492768444
Energy: 0.4082047794213603
Energy: 0.408346715142557
Energy: 0.45546095328431757
Energy: 0.40813539741482663
Energy: 0.413817184458186
Energy: 0.4210213296954191
Energy: 0.41295075307231893
Energy: 0.3780786718136986
Energy: 0.3794920150896563
Energy: 0.4133043391715391
Energy: 0.43751325726802653

minimum gb energy = 0.35586105052317335 eV
minimum distance =  2.62985445600803 Angstroms
sigma value = 41


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

Energy: 0.48623190601966443
Energy: 0.4464992866236871
Energy: 0.48724417110579904
Energy: 0.42192716401006863
Energy: 0.4465351702785415
Energy: 0.4874744671694834
Energy: 0.5143850080157076
Energy: 0.49365124973920993
Energy: 0.43768249193940967
Energy: 0.4910763689647413
Energy: 0.49163129531103594
Energy: 0.438372722800752
Energy: 0.5040569323023972
Energy: 0.4392172577093029
Energy: 0.41776661855556946
Energy: 0.5051581904256485
Energy: 0.4369739540200206
Energy: 0.48818697032925024
Energy: 0.44655439728200447
Energy: 0.4364654309283622
Energy: 0.47178983707654154
Energy: 0.44676993334329435
Energy: 0.47207162631814065
Energy: 0.4376699087325227
Energy: 0.4362955626864174
Energy: 0.49375714933837767
Energy: 0.490753600290133
Energy: 0.43640660614874327
Energy: 0.49208248248775893
Energy: 0.47191010641176784
Energy: 0.4576943308929345
Energy: 0.4694145809361333
Energy: 0.4475451906872095
Energy: 0.41949113329776216
Energy: 0.46946665322605047
Energy: 0.4192104984453545
Energy: 0.43614540438899996
Energy: 0.5039999680625112
Energy: 0.42752563237396607
Energy: 0.4362031276851735
Energy: 0.5023367411035776
Energy: 0.4364859607584255
Energy: 0.43737463526712567
Energy: 0.42002099748541405
Energy: 0.4191648959865567
Energy: 0.4381167507953719
Energy: 0.4222470150664546
Energy: 0.43593425812272646
Energy: 0.49373174071252257
Energy: 0.43782063720676023
Energy: 0.4194280625863352
Energy: 0.49618844279748625
Energy: 0.4371812489383047
Energy: 0.41877807749945667
Energy: 0.46131381314874126
Energy: 0.4393211375407634
Energy: 0.4361162781729372
Energy: 0.45362134874475535
Energy: 0.43656419441553723
Energy: 0.41908350651991866
Energy: 0.5033285859172123
Energy: 0.4373474197200838
Energy: 0.42006449667877055
Energy: 0.5032454857142041
Energy: 0.4081696690407597
Energy: 0.4722804308141227
Energy: 0.5023992102225104
Energy: 0.40853945221817284
Energy: 0.4492189424957572
Energy: 0.5027930206913576
Energy: 0.40822550675050756
Energy: 0.4639956970564142
Energy: 0.5165221744300803
Energy: 0.49032303864619414
Energy: 0.44747891325009276
Energy: 0.44735139008861896
Energy: 0.4904050575381512
Energy: 0.49085345886900744
Energy: 0.4079446086684399
Energy: 0.44646448847800113
Energy: 0.40857308174436247
Energy: 0.4115058847209529
Energy: 0.4464194880496015
Energy: 0.408320552377738

minimum gb energy = 0.4079446086684399 eV
minimum distance =  2.66092443149762 Angstroms
sigma value = 11


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

Energy: 0.7715532181139307
Energy: 0.5557805704820201
Energy: 0.5214996639176089
Energy: 0.5195626975388314
Energy: 0.5678906677383323
Energy: 0.558343002671789
Energy: 0.6001553192086184
Energy: 0.48559494072587694
Energy: 0.48568093407539453
Energy: 0.5246076567446307
Energy: 0.48558397052647445
Energy: 0.4862694936482707
Energy: 0.5764838303943544
Energy: 0.5086409386418759
Energy: 0.5082439161103165
Energy: 0.5765232996653863
Energy: 0.4972465340430865
Energy: 0.5100333316831642
Energy: 0.5432309378615274
Energy: 0.4748870981715968
Energy: 0.49818295545102115
Energy: 0.5100289430288949
Energy: 0.4868159511471418
Energy: 0.4986997086418281
Energy: 0.5226247239698522
Energy: 0.48661987478414914
Energy: 0.48642320717069587
Energy: 0.518424195160538
Energy: 0.48736190688439696
Energy: 0.48598821635662764
Energy: 0.5287295320176382
Energy: 0.4936766108455297
Energy: 0.4986690608742029
Energy: 0.5055198260843474
Energy: 0.4935471069320646
Energy: 0.5053161530144017
Energy: 0.493549033480022
Energy: 0.5020498378262883
Energy: 0.4984947979642555
Energy: 0.4935867781150078
Energy: 0.5069190928564736
Energy: 0.4939774574427184
Energy: 0.4931346542405856
Energy: 0.521099326913275
Energy: 0.48603154808914645
Energy: 0.4862725042238634
Energy: 0.5232257049338788
Energy: 0.4858558414695743
Energy: 0.502621938642234
Energy: 0.5201080726454032
Energy: 0.510619476195395
Energy: 0.4826076033586329
Energy: 0.5134263900523947
Energy: 0.5115559105817514
Energy: 0.489690147583142
Energy: 0.5095044217969614
Energy: 0.5108036284874006
Energy: 0.48290109665337716
Energy: 0.538941382936422
Energy: 0.4787285092039727
Energy: 0.4931730069807163
Energy: 0.5083202440566474
Energy: 0.4860389847138848
Energy: 0.48583620709472336
Energy: 0.4996129227486768
Energy: 0.48571343915418896
Energy: 0.4871351731556881
Energy: 0.509207773400836
Energy: 0.5138709646163764
Energy: 0.4876462146342696
Energy: 0.5084115475492834
Energy: 0.5410358942221681
Energy: 0.48535134060095336
Energy: 0.5233019363386642
Energy: 0.5265174724586372
Energy: 0.48538662372499697
Energy: 0.5247624906349941
Energy: 0.4864370450428981
Energy: 0.5032892001456057
Energy: 0.5609056485828314
Energy: 0.514062501868889
Energy: 0.5160100531939209
Energy: 0.5760285877028805
Energy: 0.5076834733994263
Energy: 0.4759215656450801
Energy: 0.5179854638215193
Energy: 0.4764452913132878
Energy: 0.4762395454346125
Energy: 0.49946562654599036
Energy: 0.4762391406854568
Energy: 0.4760848331710747
Energy: 0.5177557917612444
Energy: 0.4767052727914334
Energy: 0.47701257533280317
Energy: 0.5098101454955427
Energy: 0.47582105375155015
Energy: 0.4757963978158172
Energy: 0.5163925309081557
Energy: 0.48362422645933617
Energy: 0.4759058742858385
Energy: 0.5014319221019763
Energy: 0.5132970755534076
Energy: 0.6121915632898869
Energy: 0.5362586589122867
Energy: 0.5106826029282586
Energy: 0.4963373855280575
Energy: 0.5337209948214305
Energy: 0.4999311580871224
Energy: 0.5001601121466742
Energy: 0.49351336162377485
Energy: 0.4951897187937623
Energy: 0.5003483760160522
Energy: 0.5059081997111624
Energy: 0.5007271257443667
Energy: 0.5175808750135185
Energy: 0.5092125953338201
Energy: 0.5104129652293835
Energy: 0.5184157760936257
Energy: 0.5084833572296645
Energy: 0.5039188987917322
Energy: 0.5321203560609757
Energy: 0.4764089812246521
Energy: 0.5041336772080748
Energy: 0.5057427022404514
Energy: 0.5086714038426143
Energy: 0.5018054751633434
Energy: 0.49368636415628875
Energy: 0.5006553755483417
Energy: 0.5020756890563398
Energy: 0.4844635531469937
Energy: 0.4969661837524153
Energy: 0.500660760126148
Energy: 0.48364580437859833
Energy: 0.5050372605060166
Energy: 0.535893245792337
Energy: 0.49679541265140525
Energy: 0.5192266655441337
Energy: 0.5085320284658766
Energy: 0.5433038021811816
Energy: 0.5006897972210776
Energy: 0.5099246171668758
Energy: 0.5015944447383761
Energy: 0.5003650704611278
Energy: 0.493618955659217
Energy: 0.5318676848169458
Energy: 0.5017622902818877
Energy: 0.5010624901681584
Energy: 0.5327185109879762
Energy: 0.4925120988193943
Energy: 0.49591041072548986
Energy: 0.545230995883146
Energy: 0.4918758965519311
Energy: 0.506648878870671
Energy: 0.5018605880681275
Energy: 0.4761939734636808
Energy: 0.47626392160416875
Energy: 0.5426768407627447
Energy: 0.4758595275180998
Energy: 0.47562939845708535
Energy: 0.49647330777618975
Energy: 0.47748243052532435
Energy: 0.47650014126682927
Energy: 0.5384582010739374
Energy: 0.4860917563670783
Energy: 0.4764353607408084
Energy: 0.499433419376975
Energy: 0.47627927072673154
Energy: 0.4764726909753866
Energy: 0.5762888741760153
Energy: 0.5035452246407323
Energy: 0.5035291666942788
Energy: 0.5762747760893655
Energy: 0.49552984814594475
Energy: 0.5043279444906796
Energy: 0.5983035840857239
Energy: 0.48557863280049524
Energy: 0.48621447747379265
Energy: 0.5243860348703043
Energy: 0.4854291391846073
Energy: 0.5053966592430188
Energy: 0.4780626380733012
Energy: 0.48996098735697713
Energy: 0.507905556668261
Energy: 0.5097382979980404
Energy: 0.48791889105263275
Energy: 0.5109189174531393

minimum gb energy = 0.4748870981715968 eV
minimum distance =  2.62536618456001 Angstroms
sigma value = 57


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

Energy: 0.6871443351083265
Energy: 0.7403356345346489
Energy: 0.5623582932692878
Energy: 0.5623823788981851
Energy: 0.7368864646992532
Energy: 0.5630634890322441
Energy: 0.5517543463160782
Energy: 0.4796024465281777
Energy: 0.4802517197355687
Energy: 0.49641588032962936
Energy: 0.49415408145222584
Energy: 0.4795436158005633
Energy: 0.5210805573034588
Energy: 0.5400884982887298
Energy: 0.5121118950304925
Energy: 0.5217081135899728
Energy: 0.54201897189779
Energy: 0.515185548364298
Energy: 0.5167524108599869
Energy: 0.47969804072516603
Energy: 0.47893125168623746
Energy: 0.5174685089702953
Energy: 0.48822162236546196
Energy: 0.4790694438354032
Energy: 0.489739641411005
Energy: 0.49337161755761666
Energy: 0.481260618199647
Energy: 0.4917471370704034
Energy: 0.518077854326959
Energy: 0.4786204651283166
Energy: 0.4903064212862786
Energy: 0.5197590850301169
Energy: 0.5198547137059074
Energy: 0.49461799482704794
Energy: 0.5189703719240414
Energy: 0.5153417304683852
Energy: 0.5199823506232079
Energy: 0.5137470010506324
Energy: 0.5173093786029168
Energy: 0.5207338571233037
Energy: 0.5095381244940438
Energy: 0.5201829514782691
Energy: 0.551713101603834
Energy: 0.4939774700899693
Energy: 0.47956309899994665
Energy: 0.49339025560344474
Energy: 0.4891936183400378
Energy: 0.47885264656688864
Energy: 0.46488348344087527
Energy: 0.5184789148367855
Energy: 0.5597635686607167
Energy: 0.46507278337770747
Energy: 0.5158387620660636
Energy: 0.560494271174207
Energy: 0.4650004952439496
Energy: 0.5193067485525833
Energy: 0.5597221471885625
Energy: 0.4650741445626624
Energy: 0.5196837069324677
Energy: 0.5407352703087724
Energy: 0.5515654930613054
Energy: 0.4942342362803905
Energy: 0.4805443812115967
Energy: 0.4938820186553462
Energy: 0.4891664301119108
Energy: 0.4792252059078471
Energy: 0.5151118975763425
Energy: 0.541865250876364
Energy: 0.5417876831030568
Energy: 0.5155955112925796
Energy: 0.5433237210989743
Energy: 0.5150973504924502
Energy: 0.49579240736061914
Energy: 0.47942638455342584
Energy: 0.48004584861169414
Energy: 0.49698687287089205
Energy: 0.4959845948981787
Energy: 0.47946887930900367
Energy: 0.49060749203175325
Energy: 0.5233292837863415
Energy: 0.5157023276285813
Energy: 0.5476498313432159
Energy: 0.5203624645113621
Energy: 0.5159781006234131
Energy: 0.5187412300961453
Energy: 0.510678705767385
Energy: 0.4794579085764881
Energy: 0.5193223300004847
Energy: 0.5075247410584606
Energy: 0.4788000197171515
Energy: 0.5222500251137149
Energy: 0.5118730883936754
Energy: 0.46549389450883516
Energy: 0.523075438891138
Energy: 0.5087064082364035
Energy: 0.5156153219009608
Energy: 0.46489141955856983
Energy: 0.49655633197354754
Energy: 0.4802250097650737
Energy: 0.4649365141932271
Energy: 0.4935577241795457
Energy: 0.48029335424256003

minimum gb energy = 0.46488348344087527 eV
minimum distance =  2.64653808901703 Angstroms
sigma value = 9


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

Energy: 0.8348168417886515
Energy: 0.5367935474252582
Energy: 0.5817591367496585
Energy: 0.5527001982778884
Energy: 0.7760891085396777
Energy: 0.589671667766885
Energy: 0.5790119350409906
Energy: 0.5370796009360579
Energy: 0.5246568367275259
Energy: 0.523257819236651
Energy: 0.5278902078214291
Energy: 0.5299472294301574
Energy: 0.573197147150982
Energy: 0.5319075827552372
Energy: 0.5257557164163418
Energy: 0.5737915261218186
Energy: 0.536167325894223
Energy: 0.5254145888085381
Energy: 0.5363670548846702
Energy: 0.5262300225586445
Energy: 0.5250703048042299
Energy: 0.5231771944787711
Energy: 0.5257305008226235
Energy: 0.5269278561559833
Energy: 0.5472693228811935
Energy: 0.508876325399869
Energy: 0.5062880492454533
Energy: 0.5064388210287305
Energy: 0.5289049684434347
Energy: 0.5062180865212322
Energy: 0.5291251597177355
Energy: 0.5288125271918171
Energy: 0.5275126737595783
Energy: 0.5301854884571444
Energy: 0.5312561093571165
Energy: 0.5279404842844957
Energy: 0.5184989497317307
Energy: 0.5742208108536941
Energy: 0.515303105987424
Energy: 0.5189451758139639
Energy: 0.5329144879305127
Energy: 0.5151876880521807
Energy: 0.5350114387026289
Energy: 0.5264338720897523
Energy: 0.5309246023539943
Energy: 0.5185808939445409
Energy: 0.5267838329517402
Energy: 0.5379440515620197
Energy: 0.6198928348838434
Energy: 0.5375840501784338
Energy: 0.5080411782506769
Energy: 0.5406425068003183
Energy: 0.5357122395826508
Energy: 0.5288467573751159
Energy: 0.6222539014506705
Energy: 0.5104469786546304
Energy: 0.5088004460520322
Energy: 0.5418086994584463
Energy: 0.5195342057367508
Energy: 0.5083451189601129
Energy: 0.5354157585187046
Energy: 0.5065099238025388
Energy: 0.5096928784970731
Energy: 0.5164869898287953
Energy: 0.509184114222426
Energy: 0.509485319421951
Energy: 0.5354365485563538
Energy: 0.5245617537048013
Energy: 0.5257297266991179
Energy: 0.5281534842595368
Energy: 0.5236013657754715
Energy: 0.5258574743841965
Energy: 0.6328918473661813
Energy: 0.5499617097942796
Energy: 0.5089007866485438
Energy: 0.5325853480514869
Energy: 0.5468782225706623
Energy: 0.526809614085127
Energy: 0.5376331308254767
Energy: 0.528052110276154
Energy: 0.5265829748324098
Energy: 0.5426408900064036
Energy: 0.5474997948594533
Energy: 0.5269331768001153
Energy: 0.5508753107896391
Energy: 0.5078689789777134
Energy: 0.5079845067367053
Energy: 0.5353007040109912
Energy: 0.5077561175232721
Energy: 0.5058593146820125
Energy: 0.5290219223435225
Energy: 0.5326264355807396
Energy: 0.5075692801595181
Energy: 0.529510365542155
Energy: 0.5392062882964062
Energy: 0.5350520987683243
Energy: 0.5284864331741851
Energy: 0.5255456270300438
Energy: 0.5350033261926099
Energy: 0.5279630899047867
Energy: 0.5256433899303249
Energy: 0.527403650494462
Energy: 0.5916802915237874
Energy: 0.5483767684623688
Energy: 0.5453961712019813
Energy: 0.5631793893238018
Energy: 0.5565244289965252
Energy: 0.5327599480247553
Energy: 0.536776104732603
Energy: 0.5264740691482128
Energy: 0.5321270058015786
Energy: 0.5330960726905349
Energy: 0.5204977206152871
Energy: 0.5299997529674898
Energy: 0.556224110551252
Energy: 0.5263451129518423
Energy: 0.5328269367760443
Energy: 0.5447681351644049
Energy: 0.5262697451829973
Energy: 0.5296761491301217
Energy: 0.5280700769300185
Energy: 0.532382479659876
Energy: 0.5062056117354098
Energy: 0.5267059705011766
Energy: 0.53048123084789
Energy: 0.5058231486060669

minimum gb energy = 0.5058231486060669 eV
minimum distance =  2.6554533701488 Angstroms
sigma value = 27


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

Energy: 0.7208907807211586
Energy: 0.6869903858441531
Energy: 0.5433299360483643
Energy: 0.5502799192864846
Energy: 0.7331006632150355
Energy: 0.5294446954669969
Energy: 0.6670587369821761
Energy: 0.5665140311028516
Energy: 0.5574011607615724
Energy: 0.532056923169355
Energy: 0.5574567421579951
Energy: 0.5501781361275966
Energy: 0.5766952934240454
Energy: 0.5272937568655309
Energy: 0.5255057875343047
Energy: 0.5070409973802197
Energy: 0.5282365340573426
Energy: 0.5255257845247401
Energy: 0.6002173366531016
Energy: 0.5276418435160204
Energy: 0.5143336104554185
Energy: 0.560989171914196
Energy: 0.514498957009483
Energy: 0.5575339874630488
Energy: 0.5314853256080982
Energy: 0.5395964488571663
Energy: 0.5775557167447886
Energy: 0.531788282500724
Energy: 0.552631224187604
Energy: 0.5389970096996681
Energy: 0.6086372497324734
Energy: 0.5603106747064471
Energy: 0.5594081161987727
Energy: 0.5634550237267226
Energy: 0.562075917678785
Energy: 0.5577294435033353
Energy: 0.5913006348765386
Energy: 0.5352640726184038
Energy: 0.5551057488119238
Energy: 0.5229212956963561
Energy: 0.5540384523522541
Energy: 0.5449241048938646
Energy: 0.5751849013445918
Energy: 0.5414501620914907
Energy: 0.5245888181585908
Energy: 0.5687256350592239
Energy: 0.5400015479224753
Energy: 0.577844201007206
Energy: 0.638544618203141
Energy: 0.5626831279222654
Energy: 0.5446059706107264
Energy: 0.5541635761374282
Energy: 0.5637472801177076
Energy: 0.5681487307762655
Energy: 0.6388926810360918
Energy: 0.5419304827975107
Energy: 0.5374757905538432
Energy: 0.5545266668275279
Energy: 0.5422719149515887
Energy: 0.549171150209974
Energy: 0.5730256473959374
Energy: 0.5111200352878247
Energy: 0.5299029515708357
Energy: 0.5684199247974642
Energy: 0.5301609572590246
Energy: 0.5637308879197142
Energy: 0.5491286968806834
Energy: 0.5340458491626991
Energy: 0.5337317117914374
Energy: 0.5387948425038251
Energy: 0.5348467899382793
Energy: 0.5336462884400451
Energy: 0.5916341585832257
Energy: 0.5470922167711454
Energy: 0.5458164234687508
Energy: 0.5533814759092395
Energy: 0.5524291982323923
Energy: 0.5466398159680272
Energy: 0.587047196457319
Energy: 0.5429739337339856
Energy: 0.545382500433593
Energy: 0.5445222601095516
Energy: 0.5425394225381057
Energy: 0.5460161910559388
Energy: 0.5483485114524898
Energy: 0.5341745355349612
Energy: 0.5333915083141958
Energy: 0.5397584363877564
Energy: 0.5356608102228766
Energy: 0.5340105822518917
Energy: 0.558992786073962
Energy: 0.5537674971689956
Energy: 0.5524294285046992
Energy: 0.5505042986371341
Energy: 0.5347661051839101
Energy: 0.5529562973685438
Energy: 0.5338614983890678
Energy: 0.5544298465865799
Energy: 0.5542145742819817
Energy: 0.534141575544149
Energy: 0.5606903980536171
Energy: 0.5340169933471268
Energy: 0.5595646526559767
Energy: 0.5583162320785737
Energy: 0.5574303920473689
Energy: 0.5550776067421922
Energy: 0.5750019328654763
Energy: 0.5564957277672364
Energy: 0.568432295518282
Energy: 0.5332727586094754
Energy: 0.5564094267207628
Energy: 0.5674033778815515
Energy: 0.54456037297657
Energy: 0.5480202810475351
Energy: 0.593540383773439
Energy: 0.5351801299824748
Energy: 0.5343044851604147
Energy: 0.5245594011426076
Energy: 0.5447046865216979
Energy: 0.5556719793986592
Energy: 0.6710762819985842
Energy: 0.5618608217123253
Energy: 0.5581414287470055
Energy: 0.553825879087497
Energy: 0.5627982444091975
Energy: 0.5567335096264264
Energy: 0.5273750501165819
Energy: 0.5743878008429941
Energy: 0.5957234292478102
Energy: 0.5279043396465835
Energy: 0.5734915766618524
Energy: 0.5001361179051265
Energy: 0.5750669579382682
Energy: 0.5711064979898356
Energy: 0.510971471857358
Energy: 0.5102286473422187
Energy: 0.509126984142527
Energy: 0.5723679349636925
Energy: 0.5744457668098963
Energy: 0.5284117120409456
Energy: 0.5279542578384451
Energy: 0.5120220238372392
Energy: 0.5297791660061301
Energy: 0.5824181595845559
Energy: 0.5869542372918674
Energy: 0.5549090825741484
Energy: 0.5463502508974316
Energy: 0.5213251886912162
Energy: 0.5578120370605044
Energy: 0.5376117720709563

minimum gb energy = 0.5001361179051265 eV
minimum distance =  2.58551425571425 Angstroms
sigma value = 19


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

Energy: 0.8020419111652051
Energy: 0.503971093101045
Energy: 0.5029040548513432
Energy: 0.5145944939981948
Energy: 0.5041104868290518
Energy: 0.5067075493327159
Energy: 0.5729727015382374
Energy: 0.5086290395175334
Energy: 0.5037556680077171
Energy: 0.5092144656179961
Energy: 0.5169572520340134
Energy: 0.5094069307863585
Energy: 0.5316436630375366
Energy: 0.5109646775366508
Energy: 0.5104302654856927
Energy: 0.5115877867972939
Energy: 0.5103366989450925
Energy: 0.5106709408745284
Energy: 0.5319797626213721
Energy: 0.5097422708252649
Energy: 0.5096563723683982
Energy: 0.5164574051886186
Energy: 0.5099834614871361
Energy: 0.5096965500291611
Energy: 0.5138335062774557
Energy: 0.5126691033352858
Energy: 0.5109501976141151
Energy: 0.5159493158112778
Energy: 0.5115778822195737
Energy: 0.511318857583101
Energy: 0.5290979450043588
Energy: 0.535512014672102
Energy: 0.5339969087281019
Energy: 0.5293381349158892
Energy: 0.5145872165993208
Energy: 0.5339912586427965
Energy: 0.5126508580340777
Energy: 0.5133992858172897
Energy: 0.5132465435936752
Energy: 0.5136735578549588
Energy: 0.5142857320071201
Energy: 0.5119794589558941
Energy: 0.5284173465580555
Energy: 0.5150295148326263
Energy: 0.5098904468562941
Energy: 0.5152752501681711
Energy: 0.5133833566013662
Energy: 0.5080643566010724
Energy: 0.505806346271932
Energy: 0.5099149044977349
Energy: 0.509547032381308
Energy: 0.5113219474399163
Energy: 0.5128006707541134
Energy: 0.5093994145774905
Energy: 0.5057440974937704
Energy: 0.5140158632507911
Energy: 0.5141930920030607
Energy: 0.5093907536348803
Energy: 0.5223842195631418
Energy: 0.5044173832800536
Energy: 0.5299673088940644
Energy: 0.5034390872433269
Energy: 0.5043157531901864
Energy: 0.5301438429437391
Energy: 0.5029116937183764
Energy: 0.5061169067436273
Energy: 0.5400097018461493
Energy: 0.5019585355737023
Energy: 0.5022035983286005
Energy: 0.5027358575490274
Energy: 0.5184730699019148
Energy: 0.503047016734206
Energy: 0.5248866268836967
Energy: 0.5119693847319934
Energy: 0.5151284694813315
Energy: 0.5162909175182698
Energy: 0.5117589601438131
Energy: 0.5059216523714132
Energy: 0.5463855002596587
Energy: 0.5105588831092259
Energy: 0.5102061808622615
Energy: 0.4972563941857488
Energy: 0.5143561043498812
Energy: 0.5103655473435933
Energy: 0.5233863242637669
Energy: 0.501012463594583
Energy: 0.5021997460818064
Energy: 0.5048864212420002
Energy: 0.5002642231892173
Energy: 0.5032406935278472
Energy: 0.5234194901824477
Energy: 0.5025598702392001
Energy: 0.502923773690975
Energy: 0.5060159473066813
Energy: 0.5004856522727668
Energy: 0.5029088105418664
Energy: 0.5136713387219275
Energy: 0.5170399871864467
Energy: 0.5158270548528678
Energy: 0.4965508534496728
Energy: 0.5233838481388674
Energy: 0.5147776157330751
Energy: 0.5294993750326844
Energy: 0.5003943096488227
Energy: 0.5033915533185033
Energy: 0.5062203580430278
Energy: 0.50155224645526
Energy: 0.5032176125942314
Energy: 0.5311361204985338
Energy: 0.5021235085646442
Energy: 0.5029445837100458
Energy: 0.5188337980412822
Energy: 0.49801713278260973
Energy: 0.5019454910117168
Energy: 0.5209781677701935
Energy: 0.5005349387849318
Energy: 0.5026336931459452
Energy: 0.5089682337685005
Energy: 0.498290531067377
Energy: 0.5075100186718476
Energy: 0.4998255581299815
Energy: 0.5011548217005521
Energy: 0.5033512373863374
Energy: 0.49880551667151124
Energy: 0.4930927427739203
Energy: 0.5031665570923405
Energy: 0.5060585754789982
Energy: 0.5016329829369072
Energy: 0.5027370566306121
Energy: 0.5062409469638238
Energy: 0.4902413451234703
Energy: 0.5031607486258991
Energy: 0.5226038938999414
Energy: 0.518508548858147
Energy: 0.5029663503235122
Energy: 0.5233604175578479
Energy: 0.5061023669770474
Energy: 0.5083229283088081
Energy: 0.5366266546326348
Energy: 0.4979547137359274
Energy: 0.503832168256081
Energy: 0.5295524530851673
Energy: 0.49381988346557476
Energy: 0.5033783307907187
Energy: 0.5334614938083087
Energy: 0.4930883691918388
Energy: 0.5021674617018121
Energy: 0.4989343160895361
Energy: 0.5009642356346561
Energy: 0.5033662138158791
Energy: 0.5142548955473675
Energy: 0.5074816806048484
Energy: 0.5093057159429372
Energy: 0.5077714640608647
Energy: 0.5152069783756502
Energy: 0.5136211021162012
Energy: 0.5317895961468313
Energy: 0.5106095086970688
Energy: 0.5103209019891299
Energy: 0.5113415477047667
Energy: 0.5097338572991748
Energy: 0.509952727153475
Energy: 0.5309392279974268
Energy: 0.5096611360578848
Energy: 0.5094589627797094
Energy: 0.512271777338059
Energy: 0.5098254391695429
Energy: 0.5095892556049777
Energy: 0.5360414253598954
Energy: 0.5348187787783032
Energy: 0.5282486441148055
Energy: 0.4916553011549114
Energy: 0.538473122729367
Energy: 0.5027611970937635

minimum gb energy = 0.4902413451234703 eV
minimum distance =  2.6023598671134 Angstroms
sigma value = 101


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

Energy: 0.7280117284228775
Energy: 0.49321861942396245
Energy: 0.502864603452594
Energy: 0.501285676287971
Energy: 0.4929987247045051
Energy: 0.47682041055212
Energy: 0.5574566985995898
Energy: 0.4936019043506997
Energy: 0.4904582331180122
Energy: 0.4857756014983202
Energy: 0.5008963041547183
Energy: 0.4892363466328442
Energy: 0.5270445885746512
Energy: 0.4904047160487264
Energy: 0.4958303031554243
Energy: 0.491554535833903
Energy: 0.4863134773823608
Energy: 0.4916873325589156
Energy: 0.524163675009769
Energy: 0.4883807846681509
Energy: 0.4899497617580374
Energy: 0.4994865001261874
Energy: 0.48816837559947496
Energy: 0.48989577748235685
Energy: 0.48987178627608535
Energy: 0.4926785694123891
Energy: 0.4917221765029662
Energy: 0.49224827256857345
Energy: 0.49185550953488655
Energy: 0.4979778514355554
Energy: 0.5105015558838681
Energy: 0.4897103086409965
Energy: 0.49845359155530905
Energy: 0.5107330823193171
Energy: 0.5178140313819555
Energy: 0.5008864880368811
Energy: 0.5161762449653441
Energy: 0.4846456565521709
Energy: 0.49478461884910757
Energy: 0.5085189484789373
Energy: 0.4827212016740957
Energy: 0.4898149758285424
Energy: 0.5089213864777012
Energy: 0.4883068593576204
Energy: 0.49030972384966237
Energy: 0.5050960506516048
Energy: 0.5081565761583939
Energy: 0.49271334335394507
Energy: 0.4818610258260547
Energy: 0.49093690302194587
Energy: 0.4949711410324487
Energy: 0.48357645110676417
Energy: 0.49022017318633726
Energy: 0.4921301924727014
Energy: 0.4804883101417906
Energy: 0.49219267266974026
Energy: 0.49127771990879104
Energy: 0.4864116984064462
Energy: 0.5088801462978709
Energy: 0.490836466574372
Energy: 0.527420786439427
Energy: 0.4817386007713109
Energy: 0.47372870766187414
Energy: 0.4912920861739769
Energy: 0.4723706049676734
Energy: 0.4742780205352334
Energy: 0.529035237055785
Energy: 0.4891627373244107
Energy: 0.4903860522408402
Energy: 0.5066516100174151
Energy: 0.4849749053279176
Energy: 0.49217798460593
Energy: 0.49448126419471516
Energy: 0.4910891472136835
Energy: 0.491573148296344
Energy: 0.47983209206083427
Energy: 0.4907042251992811
Energy: 0.49100560646333885
Energy: 0.49447015348344386
Energy: 0.49802678992582317
Energy: 0.4942500767831326
Energy: 0.48369997486064337
Energy: 0.49073732377752655
Energy: 0.4919566611202301
Energy: 0.5259951644763605
Energy: 0.48667310877403264
Energy: 0.4909561761410352
Energy: 0.4918586807439884
Energy: 0.48376997271734046
Energy: 0.4943161846706575
Energy: 0.5263263231383453
Energy: 0.48906736518795907
Energy: 0.4900933766713819
Energy: 0.49794824301922846
Energy: 0.4890575694204492
Energy: 0.48838670774316256
Energy: 0.49554027154883645
Energy: 0.5401764560959051
Energy: 0.5015867155474651
Energy: 0.467666796588573
Energy: 0.5092300484856035
Energy: 0.46609780071427603
Energy: 0.5446896009465564
Energy: 0.49076434358032445
Energy: 0.4908474420903577
Energy: 0.5008168587860066
Energy: 0.5011550789617536
Energy: 0.5006585956118158
Energy: 0.5267492425199378
Energy: 0.48566436832103654
Energy: 0.4929261176874295
Energy: 0.4905463695216949
Energy: 0.48491177883969955
Energy: 0.49286373605999034
Energy: 0.5228023320299825
Energy: 0.4863392640955698
Energy: 0.48946363777874236
Energy: 0.49073641344303776
Energy: 0.48517216113104766
Energy: 0.4907511060883159
Energy: 0.49170103967723744
Energy: 0.4909243177583458
Energy: 0.4914674428995931
Energy: 0.49435509392245525
Energy: 0.4906070189260344
Energy: 0.4983065999366713
Energy: 0.5076300288314114
Energy: 0.4916493389655915
Energy: 0.49075415129340716
Energy: 0.5083946411894846
Energy: 0.49446802204474405
Energy: 0.4896546295553761
Energy: 0.5062335980052945
Energy: 0.48252899651443226
Energy: 0.48227645581059797
Energy: 0.5030694723374086
Energy: 0.48400071003425704
Energy: 0.4830852985136234
Energy: 0.5147651529518186
Energy: 0.4855600271262144
Energy: 0.48237799897186745
Energy: 0.49099678933822766
Energy: 0.48337860430991586
Energy: 0.4913914475287194
Energy: 0.4852760808293789
Energy: 0.49657856589385624
Energy: 0.49081833289382726
Energy: 0.4877646766473895
Energy: 0.4908881939384553
Energy: 0.48910010639483653
Energy: 0.48180397028976535
Energy: 0.49518610968466026
Energy: 0.492865744475767
Energy: 0.48449657169406224
Energy: 0.4955090817031292
Energy: 0.4914372464823184
Energy: 0.5236191637685459
Energy: 0.47274938168635683
Energy: 0.4802991140440807
Energy: 0.5015530550686682
Energy: 0.46942791720586335
Energy: 0.48257923674484493
Energy: 0.5279209224739223
Energy: 0.4718592248344071
Energy: 0.4679237954818726
Energy: 0.4921188379654666
Energy: 0.46879495892994755
Energy: 0.49500827762465405
Energy: 0.49425354024728646
Energy: 0.48920152062187444
Energy: 0.4962400583847333
Energy: 0.4811341469862974
Energy: 0.4975110129502808
Energy: 0.4949747089205006
Energy: 0.4952668447932185
Energy: 0.5000540787379848
Energy: 0.5083998320729246
Energy: 0.4824087005679539
Energy: 0.5019383998539718
Energy: 0.5038869723103694
Energy: 0.5281904301941948
Energy: 0.48573279254300616
Energy: 0.49557703201547504
Energy: 0.4917678374116684
Energy: 0.48500338312544355
Energy: 0.4925381612307061
Energy: 0.5262028975506453
Energy: 0.48505516628350076
Energy: 0.4894367149431938
Energy: 0.4910334188323116
Energy: 0.48372903892113606
Energy: 0.4906079242617479
Energy: 0.4964473622673056
Energy: 0.4835772450261063
Energy: 0.4717504493951496
Energy: 0.46779273321166476
Energy: 0.4811731081713126
Energy: 0.4971479641213571

minimum gb energy = 0.46609780071427603 eV
minimum distance =  2.59288713486873 Angstroms
sigma value = 33


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

Energy: 0.011788125933579245
Energy: 0.41175230054172535
Energy: 0.013195429321128752
Energy: 0.013008459244034648
Energy: 0.4122244899540449
Energy: 0.012131228919263966
Energy: 0.27700254241507877
Energy: 0.0715334773455852
Energy: 0.07075479868042797
Energy: 0.07218482083250197
Energy: 0.07220852501536643
Energy: 0.07080412598235433
Energy: 0.6186407265859283
Energy: 0.4125339288736613
Energy: 0.41120013784677084
Energy: 0.4131425090230866
Energy: 0.41212715540615197
Energy: 0.41152750401627153
Energy: 0.27700254241369227
Energy: 0.07153347734522869
Energy: 0.07075479868042797
Energy: 0.07218482083214545
Energy: 0.07220852501570314
Energy: 0.07080412598235433

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