Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Au__MO_468407568810_006
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.080054298043251
cohesive_energy=3.930314275214028
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.068807226011498e-19, 1.72237192508268e-19, 2.2702682686116596e-19, 2.75048867112048e-19, 3.18829945812732e-19, 3.59113472921394e-19, 3.9571359594849e-19, 4.2852617341281e-19, 4.57767499159944e-19, 4.83778836812934e-19, 5.06887030405116e-19, 5.2737246084744e-19, 5.45470648105104e-19, 5.61388272963894e-19, 5.75298370500282e-19, 5.87361158377668e-19, 5.97711219433308e-19, 6.064639103848499e-19, 6.137201683602359e-19, 6.195520913079959e-19, 6.24025368470124e-19, 6.27176849909202e-19, 6.29041783511178e-19, 6.296570193386339e-19, 6.2899051385889e-19, 6.26832381932892e-19, 6.229262752991999e-19, 6.16959769514184e-19, 6.08452211587644e-19, 5.96900518056504e-19, 5.81715087919452e-19, 5.62184554750992e-19, 5.374341301089599e-19, 5.06387151295308e-19, 4.67686574701038e-19, 4.1960204956142994e-19, 3.59906550355224e-19, 2.85714556964586e-19, 1.9324813688654397e-19, 7.75266036189822e-20, -6.80838551911764e-20, -2.52636018179022e-19, -4.88748788731602e-19, -7.943880143166119e-19, -1.195294264735896e-18, -1.72852428335724e-18, -2.44934355099384e-18, -3.4441510448107797e-18, -4.8151175687582395e-18, -6.752565685189079e-18, -9.617385680911799e-18, -1.41069249358749e-17, -2.1760923260651398e-17, -3.64504797294804e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -5.96046447753906e-08 eV

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

Energy: 0.011900317569034183
Energy: 0.2551425536478022
Energy: 0.012819092118861987
Energy: 0.013800350693057037
Energy: 0.2550745478209779
Energy: 0.01231647627515706
Energy: 0.2551425536480484
Energy: 0.06442818712135026
Energy: 0.06440876021096721
Energy: 0.06441925243443235
Energy: 0.06442326879719698
Energy: 0.06448866146828734
Energy: 0.012819092119354367
Energy: 0.064408760214578
Energy: 0.06442444448519852
Energy: 0.01241171067631324
Energy: 0.06444734093550605
Energy: 0.0654700269235853
Energy: 0.01380035069330323
Energy: 0.06441925244020416
Energy: 0.012411710676532073
Energy: 0.01223861905381608
Energy: 0.06453296925689773
Energy: 0.012338769281764287
Energy: 0.2550745478209779
Energy: 0.06442326879982303
Energy: 0.06444734093019926
Energy: 0.0645329692516183
Energy: 0.06450201797549136
Energy: 0.06431897995379131
Energy: 0.01231647627564944
Energy: 0.06448866146445771
Energy: 0.06547002692333911
Energy: 0.012338769281764287
Energy: 0.06431897995570611
Energy: 0.01259071902378479

minimum gb energy = 0.011900317569034183 eV
minimum distance =  2.87825164403021 Angstroms
sigma value = 1


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

Energy: 0.7958130738600507
Energy: 0.5227995524601602
Energy: 0.5163378708090263
Energy: 0.4983309854144935
Energy: 0.7430713539925481
Energy: 0.5162595486778243
Energy: 0.7081168964435649
Energy: 0.4809929304444407
Energy: 0.484426129537748
Energy: 0.46724417665325446
Energy: 0.48958669340078625
Energy: 0.4784138427006675
Energy: 0.720840996282602
Energy: 0.4805497086216553
Energy: 0.4822679733814183
Energy: 0.4789263558223128
Energy: 0.4780139746031843
Energy: 0.4832381397306357
Energy: 0.7766448024606731
Energy: 0.4801994778699494
Energy: 0.49802571920363525
Energy: 0.47179636079383896
Energy: 0.4804056191258306
Energy: 0.4797936342345568
Energy: 0.708686103587182
Energy: 0.4865521456809695
Energy: 0.48511172736025415
Energy: 0.4759723956789235
Energy: 0.4876526263983658
Energy: 0.4825467691813287
Energy: 0.7050669464538852
Energy: 0.497534243211283
Energy: 0.4857288004526751
Energy: 0.47922639868856654
Energy: 0.4976102061241953
Energy: 0.4848255267150026
Energy: 0.7062851345123297
Energy: 0.4832437089559893
Energy: 0.48822091173719284
Energy: 0.4786284999296735
Energy: 0.45792203179371893
Energy: 0.47976599335507075
Energy: 0.6959829737396355
Energy: 0.48104407413072253
Energy: 0.4972673868510422
Energy: 0.4578034042738998
Energy: 0.48020681321571446
Energy: 0.4826263570284973
Energy: 0.5849530861717777
Energy: 0.47892857216770895
Energy: 0.4787568910404883
Energy: 0.49499935949876933
Energy: 0.48319000912279003
Energy: 0.48358954140412036
Energy: 0.5911721768920932
Energy: 0.4764885920117336
Energy: 0.4832208530395246
Energy: 0.4818508877696956
Energy: 0.4767642536281322
Energy: 0.4858009948779038
Energy: 0.5835319746053196
Energy: 0.47755719175699557
Energy: 0.47791047851340646
Energy: 0.5170859874825753
Energy: 0.47774737444110477
Energy: 0.48159981247981554
Energy: 0.5336189745067369
Energy: 0.48328250020290603
Energy: 0.4827480476078497
Energy: 0.4871325539719012
Energy: 0.47711860204534745
Energy: 0.4824893266383061
Energy: 0.5297787254046026
Energy: 0.4780131870992654
Energy: 0.47821382319942823
Energy: 0.4856779393725227
Energy: 0.47779274315711895
Energy: 0.4786386405974746
Energy: 0.5721303489648766
Energy: 0.4756677076154243
Energy: 0.4987842440253444
Energy: 0.4899459741878278
Energy: 0.4865062342139237
Energy: 0.48059377437696527
Energy: 0.5529324609234024
Energy: 0.4760828559685742
Energy: 0.48281793157629077
Energy: 0.4916696412455596
Energy: 0.4763379380297513
Energy: 0.4853181033361044
Energy: 0.5482904688252156
Energy: 0.4819265131533758
Energy: 0.4796623200798513
Energy: 0.48573452282621854
Energy: 0.4832497135535354
Energy: 0.47889457644340216
Energy: 0.6644082656120387
Energy: 0.47874009235783715
Energy: 0.4815355454516773
Energy: 0.47703666237045916
Energy: 0.4779657482239874
Energy: 0.47519355754578657
Energy: 0.6429428527996155
Energy: 0.4814177552486264
Energy: 0.49027737951365447
Energy: 0.48520239939492743
Energy: 0.4536457297704278
Energy: 0.4918294929886694
Energy: 0.644267339556735
Energy: 0.493995566602427
Energy: 0.4921050923794791
Energy: 0.4818095683292536
Energy: 0.4853881820972927
Energy: 0.4915176866203624
Energy: 0.6838564490316935
Energy: 0.4855694860414849
Energy: 0.4926017637355143
Energy: 0.4808266114906272
Energy: 0.4858080964579127
Energy: 0.49180075999664297
Energy: 0.7325593526746025
Energy: 0.480599809942897
Energy: 0.48235537960632735
Energy: 0.47685940179581576
Energy: 0.47304204225131896
Energy: 0.4814132170080647
Energy: 0.7394512401362101
Energy: 0.4815265563534847
Energy: 0.4836701748558146
Energy: 0.4758478021816402
Energy: 0.4750304086966509
Energy: 0.47951963953874377
Energy: 0.7328479690322603
Energy: 0.48180314587475015
Energy: 0.4844017515261395
Energy: 0.47719580565393965
Energy: 0.4931630962520768
Energy: 0.477781684444596

minimum gb energy = 0.4536457297704278 eV
minimum distance =  2.69172305001269 Angstroms
sigma value = 33


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

Energy: 0.8750904552401526
Energy: 0.5198098911056541
Energy: 0.5281025550110687
Energy: 0.5272714026066269
Energy: 0.5199943605394048
Energy: 0.5265819771338837
Energy: 0.6600991570869272
Energy: 0.47594395324168937
Energy: 0.474789423082715
Energy: 0.4949278221658739
Energy: 0.5162887522311488
Energy: 0.48739536116158516
Energy: 0.6623963247151424
Energy: 0.4908930797261311
Energy: 0.4756151861228591
Energy: 0.494136179939263
Energy: 0.517024223223602
Energy: 0.486342153792636
Energy: 0.6977818845491863
Energy: 0.503248508856895
Energy: 0.503168657121618
Energy: 0.4904158866575777
Energy: 0.5165746854994835
Energy: 0.48851243929113275
Energy: 0.6577155345745581
Energy: 0.4751158865369925
Energy: 0.49414943779697595
Energy: 0.4724538953818928
Energy: 0.5051806341312255
Energy: 0.5068398919898295
Energy: 0.7012682767972994
Energy: 0.5086621571893544
Energy: 0.5094780276733063
Energy: 0.48896896747050783
Energy: 0.5219577872203938
Energy: 0.496314759374063
Energy: 0.7000577853545901
Energy: 0.4785626297261585
Energy: 0.47952109181146113
Energy: 0.487877702962512
Energy: 0.4776205898522181
Energy: 0.4967282732467186
Energy: 0.6580815760454725
Energy: 0.5090136640190847
Energy: 0.5060968970928533
Energy: 0.5032166377385707
Energy: 0.5054941436771122
Energy: 0.5044479438413504
Energy: 0.5720655681637838
Energy: 0.4710814457348159
Energy: 0.4876345654436799
Energy: 0.5091252778401576
Energy: 0.4700548701358084
Energy: 0.49704239900714714
Energy: 0.5702725023299193
Energy: 0.47471006150477907
Energy: 0.506471780846696
Energy: 0.5045420689284901
Energy: 0.4722256676523106
Energy: 0.507945755004645
Energy: 0.5756319304208108
Energy: 0.49798419910674446
Energy: 0.49797947180382374
Energy: 0.5008148483383241
Energy: 0.47048889678471906
Energy: 0.49840878070535277
Energy: 0.529334552049144
Energy: 0.47191199814065266
Energy: 0.48588435982203654
Energy: 0.5165893801221589
Energy: 0.5037795795081879
Energy: 0.489961095416843
Energy: 0.528315150195319
Energy: 0.4863539545496516
Energy: 0.4859134475193608
Energy: 0.5165494663663025
Energy: 0.4883873520218846
Energy: 0.4938111209231196
Energy: 0.5333763955409472
Energy: 0.48969940124506395
Energy: 0.48957951386292164
Energy: 0.5213581543347777
Energy: 0.47199977476318056
Energy: 0.48982899380952716
Energy: 0.5795630263421074
Energy: 0.4960043120592843
Energy: 0.5069626565455911
Energy: 0.5042597461394316
Energy: 0.4728541473022873
Energy: 0.47581663694765236
Energy: 0.5722337909323401
Energy: 0.48709745178854363
Energy: 0.48818259218898863
Energy: 0.4898841533469664
Energy: 0.49387023987966716
Energy: 0.4908101581646997
Energy: 0.6575883100904516
Energy: 0.4966977357021636
Energy: 0.47934018124668104
Energy: 0.4905138774187751
Energy: 0.4973274489596706
Energy: 0.4783143812294326
Energy: 0.6198658645041284
Energy: 0.47873890253718304
Energy: 0.4789656172594593
Energy: 0.47388026245633263
Energy: 0.47812182010679866
Energy: 0.5048971319317821
Energy: 0.6118734131456486
Energy: 0.5089866182434414
Energy: 0.4983948669791979
Energy: 0.4701470136487229
Energy: 0.5090047386052152
Energy: 0.49438113392657645
Energy: 0.6576574783771642
Energy: 0.4771913094663885
Energy: 0.49528541917003943
Energy: 0.4718224854651655
Energy: 0.5057698151599896
Energy: 0.5069664004613251
Energy: 0.7814803382899876
Energy: 0.49342711014168933
Energy: 0.49817486059220345
Energy: 0.49816644987802045
Energy: 0.4927965668423895
Energy: 0.4979576469062042
Energy: 0.6118777984061602
Energy: 0.49101120988562397
Energy: 0.4933032887020614
Energy: 0.47049193259652256
Energy: 0.5169957041405484
Energy: 0.48641372743011363
Energy: 0.659158920808432
Energy: 0.47589095475693505
Energy: 0.4744157113551586
Energy: 0.4892479051668409
Energy: 0.5161261092846351
Energy: 0.4875677103439952
Energy: 0.6979113160125465
Energy: 0.49473848313259217
Energy: 0.5037991329339576
Energy: 0.4901920407565575
Energy: 0.5214622073471978
Energy: 0.4973180546492529
Energy: 0.6584372758868732
Energy: 0.47640394598939234
Energy: 0.47476620085481125
Energy: 0.4739543834184513
Energy: 0.5035056126307181
Energy: 0.4871200048112451
Energy: 0.7007517444181373
Energy: 0.5085875869057039
Energy: 0.4944548887917502
Energy: 0.49531092037453395
Energy: 0.5102268312279241
Energy: 0.48785236358015555
Energy: 0.6981371688816206
Energy: 0.4903592569215141
Energy: 0.4906265480562993
Energy: 0.5087394207511882
Energy: 0.5016959596596231
Energy: 0.4905757543691847
Energy: 0.6590335893496724
Energy: 0.5072483963133394
Energy: 0.5057549471121177
Energy: 0.478027531685492
Energy: 0.4712817087328471
Energy: 0.4800634644213446
Energy: 0.5750291087182905
Energy: 0.5076298645471321
Energy: 0.5056195792779551
Energy: 0.5058676845030952
Energy: 0.4739669419321214
Energy: 0.5003662129798085
Energy: 0.5743288308933174
Energy: 0.4733507683596286
Energy: 0.5059262707771617
Energy: 0.5055681552329779
Energy: 0.47205148132171415
Energy: 0.4960608883166023
Energy: 0.6244715577043578
Energy: 0.4863492643422277
Energy: 0.4855258133799491
Energy: 0.49072506777409813
Energy: 0.4986591894662521
Energy: 0.49820873335199173
Energy: 0.5332399849205806
Energy: 0.4737448610286731
Energy: 0.4712835751076865
Energy: 0.5176129299419865
Energy: 0.47345013234653405
Energy: 0.48682069639465664
Energy: 0.5309075665828477
Energy: 0.4938506061136657
Energy: 0.48652729656529914
Energy: 0.5317197076594391
Energy: 0.4952385927417967
Energy: 0.474844456179147
Energy: 0.5335713572286095
Energy: 0.4874745072897724
Energy: 0.48709046312165644
Energy: 0.5336102479815301
Energy: 0.48919206457893705
Energy: 0.48666108463989755
Energy: 0.5707934979500816
Energy: 0.48609907398652435
Energy: 0.4858940806461319
Energy: 0.5032389670350942
Energy: 0.4876046687007818
Energy: 0.4759862034624262
Energy: 0.5715289431360338
Energy: 0.48848771556410997
Energy: 0.48733808060291617
Energy: 0.509491056268376
Energy: 0.495172638740219
Energy: 0.49554822457739456
Energy: 0.5708023619626132
Energy: 0.4910910300688252
Energy: 0.4912985582833312
Energy: 0.48911443257634973
Energy: 0.49039515871723016
Energy: 0.49112234542152305
Energy: 0.6121738287541636
Energy: 0.4786219270148639
Energy: 0.498963862402559
Energy: 0.4699297890031731
Energy: 0.4787039224287896
Energy: 0.49508696690689646
Energy: 0.6181124315492186
Energy: 0.49174658608331206
Energy: 0.4914752231190569
Energy: 0.5031895499953413
Energy: 0.5048710243228075
Energy: 0.5048107621784688
Energy: 0.6575817424557276
Energy: 0.49421002917007395
Energy: 0.4951146025973165
Energy: 0.4746453936536333
Energy: 0.5218749810951591
Energy: 0.5049060970228098
Energy: 0.7787199283536456
Energy: 0.4940473934728288
Energy: 0.4852887070478896
Energy: 0.47080060170625293
Energy: 0.5165648646239306
Energy: 0.48518941970077023

minimum gb energy = 0.4699297890031731 eV
minimum distance =  2.69743562584345 Angstroms
sigma value = 51


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

Energy: 0.8270125659600827
Energy: 0.5184410818638229
Energy: 0.4892622672372722
Energy: 0.49245555856399315
Energy: 0.5183841047354286
Energy: 0.5531191262253626
Energy: 0.6283330310406924
Energy: 0.49106513396249984
Energy: 0.49066336963735946
Energy: 0.4749540422075403
Energy: 0.5158172699299042
Energy: 0.49065975998402794
Energy: 0.7216049059350382
Energy: 0.5063991661963696
Energy: 0.49802237209410677
Energy: 0.4911002439482273
Energy: 0.5187940580849298
Energy: 0.5066968279582014
Energy: 0.7199169259664635
Energy: 0.5072803911756125
Energy: 0.5117404080709747
Energy: 0.46675620773587906
Energy: 0.5045460602709774
Energy: 0.5005680410421776
Energy: 0.6284637308959821
Energy: 0.4744400595995463
Energy: 0.47407702143814373
Energy: 0.47469803484937473
Energy: 0.5208689266218535
Energy: 0.5193699388135633
Energy: 0.6281545692581251
Energy: 0.5173563397426668
Energy: 0.5169024830872206
Energy: 0.5192387012114139
Energy: 0.4742668882396494
Energy: 0.5163360465187944
Energy: 0.6308584029615071
Energy: 0.4745917733750377
Energy: 0.47433421439945844
Energy: 0.5196733581036708
Energy: 0.4746328492115463
Energy: 0.4746001504593104
Energy: 0.6201316564527277
Energy: 0.48259695891576726
Energy: 0.48375862825083726
Energy: 0.5041906587365641
Energy: 0.4694510508402197
Energy: 0.4859544067296102
Energy: 0.5413713682811903
Energy: 0.5079351640536347
Energy: 0.5080982334780991
Energy: 0.5181797994454502
Energy: 0.4941007565380756
Energy: 0.5176475886647296
Energy: 0.5415213310403862
Energy: 0.47497071665586005
Energy: 0.4908173748552228
Energy: 0.5164566295469173
Energy: 0.4743778040713225
Energy: 0.5040627626649276
Energy: 0.5413625977583341
Energy: 0.48408306338094853
Energy: 0.4841572960588068
Energy: 0.5419056729758229
Energy: 0.4844817677724384
Energy: 0.48382694316700553
Energy: 0.5655437642093256
Energy: 0.4750439528607692
Energy: 0.47451363041542427
Energy: 0.5062580840687141
Energy: 0.5003967752146511
Energy: 0.5040082737712027
Energy: 0.5645726921789639
Energy: 0.5079860615947165
Energy: 0.5076587229956935
Energy: 0.522108491434883
Energy: 0.49287617987213983
Energy: 0.5139478376139051
Energy: 0.5657489374503455
Energy: 0.4851282463234703
Energy: 0.4861059454186838
Energy: 0.5066244354651062
Energy: 0.469901163487216
Energy: 0.48615245374254196
Energy: 0.6697218534979693
Energy: 0.49277930410978327
Energy: 0.5082206586135563
Energy: 0.5129864095401251
Energy: 0.49192846426056475
Energy: 0.5082299147247499
Energy: 0.6681217323958336
Energy: 0.5069824178468625
Energy: 0.5018206055286516
Energy: 0.48263784671266996
Energy: 0.5195796197172294
Energy: 0.4853290138248064
Energy: 0.6726129664129015
Energy: 0.505356856777518
Energy: 0.490157685576129
Energy: 0.5076916241952986
Energy: 0.5264462021301104
Energy: 0.49086250650111524
Energy: 0.7729934451200325
Energy: 0.5097461688789281
Energy: 0.49470956995310583
Energy: 0.5062594624684277
Energy: 0.4912992740757234
Energy: 0.5043310929612831

minimum gb energy = 0.46675620773587906 eV
minimum distance =  2.64379487971033 Angstroms
sigma value = 19


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

Energy: 0.6858510162499545
Energy: 0.5060759734293555
Energy: 0.547082304883175
Energy: 0.5481748980615482
Energy: 0.5063038763956761
Energy: 0.5072973843591991
Energy: 0.5973181254490523
Energy: 0.5048359041755832
Energy: 0.504472425343622
Energy: 0.5212584308061142
Energy: 0.505014796932079
Energy: 0.5048932267877582
Energy: 0.5966394343048382
Energy: 0.5048062911537091
Energy: 0.5045884393756151
Energy: 0.5216683360084692
Energy: 0.504920440492809
Energy: 0.5048172866533844
Energy: 0.5910052655203653
Energy: 0.5042889385955395
Energy: 0.5044168892463328
Energy: 0.5011841768901444
Energy: 0.5044409324238124
Energy: 0.5054505772460695
Energy: 0.5971442468141197
Energy: 0.5049801283767065
Energy: 0.5215621463021958
Energy: 0.5224692259564728
Energy: 0.5055993973692722
Energy: 0.5208774422829631
Energy: 0.5966409011099132
Energy: 0.486954531329737
Energy: 0.5213128368195606
Energy: 0.5216854375745049
Energy: 0.48684320504516243
Energy: 0.5217447834943891
Energy: 0.5971902145895003
Energy: 0.5221257404761814
Energy: 0.5215043423893103
Energy: 0.5214208832022257
Energy: 0.4961606281482322
Energy: 0.5216314296572201
Energy: 0.5666806235153153
Energy: 0.47928205553636116
Energy: 0.4793657589641545
Energy: 0.506026100230739
Energy: 0.4801254487115991
Energy: 0.47956674358982865
Energy: 0.504829233301156
Energy: 0.479287562475869
Energy: 0.4796290282681798
Energy: 0.5049783504900233
Energy: 0.47997871200735104
Energy: 0.4794517424698364
Energy: 0.5050496717460986
Energy: 0.5037382911411092
Energy: 0.5053698567781711
Energy: 0.5050053981532201
Energy: 0.5227791351919798
Energy: 0.5045631116276399
Energy: 0.5038672355572681
Energy: 0.5017924868883936
Energy: 0.5026807336501832
Energy: 0.5040896900829498
Energy: 0.502091838875608
Energy: 0.5063132958705634
Energy: 0.5970966966811052
Energy: 0.5218334252662558
Energy: 0.521255396722039
Energy: 0.5047900376714929
Energy: 0.5185676569304103
Energy: 0.5048956510255747
Energy: 0.4907020478392259
Energy: 0.5215193402733481
Energy: 0.5214760073703364
Energy: 0.4873453220989512
Energy: 0.5215427015653831
Energy: 0.5212690958391112
Energy: 0.5975180498310304
Energy: 0.522641871014512
Energy: 0.5225356642551232
Energy: 0.5044564452975785
Energy: 0.5221497372101099
Energy: 0.5219515308633356
Energy: 0.6956848209144038
Energy: 0.5051652772769551
Energy: 0.505722199498936
Energy: 0.48014544239252477
Energy: 0.5048139947980124
Energy: 0.4797482754709906
Energy: 0.6901513241775009
Energy: 0.5199862271041663
Energy: 0.4795835456994104
Energy: 0.4793558876016925
Energy: 0.5051707486043231
Energy: 0.47959181591328615
Energy: 0.5970116366616766
Energy: 0.5050299689490163
Energy: 0.5046838694109386
Energy: 0.5218964236529495
Energy: 0.5047163440389427
Energy: 0.5046344215845947
Energy: 0.5945356198638284
Energy: 0.5053849372082674
Energy: 0.5047996911061851
Energy: 0.5010367031073643
Energy: 0.50514290531603
Energy: 0.5051509471244703
Energy: 0.5921022223455955
Energy: 0.5047868993812534
Energy: 0.5048169811817587
Energy: 0.50121747000919
Energy: 0.5046209576637424
Energy: 0.5046527310031433
Energy: 0.597369407631338
Energy: 0.48679835767054447
Energy: 0.5174109799603245
Energy: 0.5214217132225255
Energy: 0.48685872021847554
Energy: 0.5199560810063444
Energy: 0.5911664810752006
Energy: 0.5211712755244835
Energy: 0.5218348740193928
Energy: 0.5222573891473385
Energy: 0.504881300165964
Energy: 0.5224814432194433
Energy: 0.5971140841498432
Energy: 0.49699071721628185
Energy: 0.5215206227137679
Energy: 0.5212229597343534
Energy: 0.4961759741980459
Energy: 0.5214032077590598
Energy: 0.566620729508002
Energy: 0.481410867524709
Energy: 0.4812531843375688
Energy: 0.5667185000700116
Energy: 0.4815652109246418
Energy: 0.4840383114101861
Energy: 0.5049879148286869
Energy: 0.5213577810872263
Energy: 0.5058663478591232
Energy: 0.5049225982847994
Energy: 0.5063881293662064
Energy: 0.5046333754392195
Energy: 0.5048420172586966
Energy: 0.5052766494156172
Energy: 0.506032688634136
Energy: 0.5049125023441108
Energy: 0.5219123725882822
Energy: 0.5045356234547229
Energy: 0.5676140459225621
Energy: 0.5013205309610278
Energy: 0.5039155013465113
Energy: 0.5662292498310101
Energy: 0.5011841912079689
Energy: 0.5045002132003723
Energy: 0.5974969818141103
Energy: 0.5228080615676776
Energy: 0.521291822556529
Energy: 0.5059093893633922
Energy: 0.5186976598875944
Energy: 0.5212370600954586
Energy: 0.49081780358495974
Energy: 0.5226625757884124
Energy: 0.5166018458067233
Energy: 0.48695201953509326
Energy: 0.5222380768666075
Energy: 0.5213920847464564
Energy: 0.5662622086075471
Energy: 0.5223046058722938
Energy: 0.5173677169127261
Energy: 0.4966060437667272
Energy: 0.521782806484976
Energy: 0.5214816352389628
Energy: 0.6911954067056931
Energy: 0.5066062067626432
Energy: 0.47895119648839585
Energy: 0.47979810861350386
Energy: 0.5058739084951145
Energy: 0.47961874968123697

minimum gb energy = 0.47895119648839585 eV
minimum distance =  2.71477631356187 Angstroms
sigma value = 27


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

Energy: 0.5891065234839906
Energy: 0.5017637690741126
Energy: 0.5796212336672755
Energy: 0.4789530999858909
Energy: 0.5019449355520724
Energy: 0.5793185473696661
Energy: 0.5835407034389944
Energy: 0.4928238291961817
Energy: 0.4569167037077389
Energy: 0.44839198670530545
Energy: 0.4972540315418883
Energy: 0.41906223460374353
Energy: 0.5357500601071031
Energy: 0.49104923134353823
Energy: 0.4486842644243444
Energy: 0.4197563772813215
Energy: 0.4955170410271354
Energy: 0.4192601691919912
Energy: 0.5365687593296241
Energy: 0.419397806955337
Energy: 0.4185825266611042
Energy: 0.4519553564241089
Energy: 0.4590997700382449
Energy: 0.4184505153120856
Energy: 0.5840365254098483
Energy: 0.422909476621185
Energy: 0.41955476389642343
Energy: 0.46128205513821635
Energy: 0.4275026159237734
Energy: 0.41945572951581567
Energy: 0.4985153790303147
Energy: 0.39941795943449254
Energy: 0.4237468797753475
Energy: 0.4901438004244541
Energy: 0.4244149803125077
Energy: 0.3971152785089893
Energy: 0.5013501301698045
Energy: 0.44622757309226685
Energy: 0.4418357665991468
Energy: 0.49809464599211006
Energy: 0.44661441824346015
Energy: 0.44744562553866907
Energy: 0.5007293650421146
Energy: 0.44493739239577423
Energy: 0.443392002982426
Energy: 0.5001128806545789
Energy: 0.44601972912911153
Energy: 0.4451332335525169
Energy: 0.5343842483561095
Energy: 0.4185489837284178
Energy: 0.44484458457926906
Energy: 0.49890860109695234
Energy: 0.4443146828173052
Energy: 0.41979198072744284
Energy: 0.5367174251869874
Energy: 0.4487900403615834
Energy: 0.44658894689515094
Energy: 0.48444778198583255
Energy: 0.4526895382394105
Energy: 0.4465729173898234
Energy: 0.535388767586526
Energy: 0.4850916665752629
Energy: 0.4843101251714545
Energy: 0.447641555125837
Energy: 0.4858083411988955
Energy: 0.4477749199527577
Energy: 0.5350217638587637
Energy: 0.44772992703252973
Energy: 0.456935704595817
Energy: 0.4493422785007272
Energy: 0.4477078500943063
Energy: 0.4189804820552215

minimum gb energy = 0.3971152785089893 eV
minimum distance =  2.73549372922708 Angstroms
sigma value = 9


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

Energy: 0.9702305021302553
Energy: 0.39652231178412944
Energy: 0.4369845785720416
Energy: 0.4090699092713367
Energy: 0.41022962516511424
Energy: 0.4367972958456906
Energy: 0.47799642463945075
Energy: 0.39594442822966613
Energy: 0.3830736270567244
Energy: 0.40398897834562286
Energy: 0.42459948559563093
Energy: 0.4038364272509452
Energy: 0.453751895529683
Energy: 0.41778722274695934
Energy: 0.4158662761645999
Energy: 0.4181118055940599
Energy: 0.43059066612010205
Energy: 0.4138914802595933
Energy: 0.45600463775516115
Energy: 0.3852911746065955
Energy: 0.38509568417754897
Energy: 0.4176368615250618
Energy: 0.3997250095985257
Energy: 0.3852864816675397
Energy: 0.4728621717547767
Energy: 0.3997414299152064
Energy: 0.37577264786962433
Energy: 0.4228849943247859
Energy: 0.39913696183002273
Energy: 0.40832682912933543
Energy: 0.42906893568710464
Energy: 0.38213495907481204
Energy: 0.404793507979799
Energy: 0.4287284370764509
Energy: 0.4108306507101738
Energy: 0.4100737645939768
Energy: 0.4291204175238727
Energy: 0.3904693091206547
Energy: 0.3850278872098571
Energy: 0.4298570739912936
Energy: 0.38734920024030445
Energy: 0.4086139256454613
Energy: 0.42973348773960085
Energy: 0.40477042891640136
Energy: 0.3987055603608097
Energy: 0.42986809253803426
Energy: 0.41687241862743507
Energy: 0.40720245642307745
Energy: 0.43143639389297606
Energy: 0.40626412960494535
Energy: 0.40275667569342316
Energy: 0.42439384306208744
Energy: 0.41957996528545666
Energy: 0.4072228520326865
Energy: 0.42574786668252573
Energy: 0.3884197996497896
Energy: 0.3853456692619124
Energy: 0.40983053858494267
Energy: 0.39735590966846246
Energy: 0.3810813844866157
Energy: 0.4205011865430204
Energy: 0.42619093309599265
Energy: 0.4237108046090431
Energy: 0.41208592744844963
Energy: 0.428819295947925
Energy: 0.40804473547456277
Energy: 0.43215480143019547
Energy: 0.4134920633509487
Energy: 0.3974325251811867
Energy: 0.39795639701881785
Energy: 0.4294034458676102
Energy: 0.38480484482334837
Energy: 0.5949667645001946
Energy: 0.4129719626908374
Energy: 0.38503335099258723
Energy: 0.39867571505432275
Energy: 0.4117677926553341
Energy: 0.4078206182182155
Energy: 0.4873202383465761
Energy: 0.4104645723697957
Energy: 0.40837385522521946
Energy: 0.3975512666093795
Energy: 0.4078669573704387
Energy: 0.385469816974957
Energy: 0.4329779684794773
Energy: 0.41185562748379173
Energy: 0.4120145356201593
Energy: 0.425063964852667
Energy: 0.4136581290017814
Energy: 0.4077217170959209
Energy: 0.42997735031548184
Energy: 0.4075873615495207
Energy: 0.418432953289087
Energy: 0.43033384788468565
Energy: 0.4173040440224913
Energy: 0.4114078526778905
Energy: 0.42951863761380044
Energy: 0.3852894039800268
Energy: 0.38296100418282836
Energy: 0.42856395441798606
Energy: 0.3944174235150725
Energy: 0.4066479227828038
Energy: 0.472387655027376
Energy: 0.3972704326179715
Energy: 0.40700524566213103
Energy: 0.41400959710569907
Energy: 0.40291344632565634
Energy: 0.3866794377777901
Energy: 0.4534282323767209
Energy: 0.402569748913823
Energy: 0.40399331224273016
Energy: 0.42464214182914306
Energy: 0.4019962707615747
Energy: 0.40936271039104166
Energy: 0.4535581162730313
Energy: 0.4037345980679729
Energy: 0.40718805746671316
Energy: 0.41901529315330543
Energy: 0.4198690173097642
Energy: 0.40980091560730875
Energy: 0.4537993308975174
Energy: 0.4068804646244519
Energy: 0.4043417762835449
Energy: 0.41257209767537517
Energy: 0.4170708406030827
Energy: 0.41104741423235175
Energy: 0.4733336989441024
Energy: 0.39845437348568585
Energy: 0.39969828640189264
Energy: 0.399907521463709
Energy: 0.41704453224467714
Energy: 0.3964617991530129
Energy: 0.4711905252335891
Energy: 0.39524558093975803
Energy: 0.40636841868563217
Energy: 0.39962711806602386
Energy: 0.4250345348186697
Energy: 0.38735609983978364
Energy: 0.45411693196113034
Energy: 0.3903422624156259
Energy: 0.4078029691339708
Energy: 0.4012235165745728
Energy: 0.4313633971793552
Energy: 0.4127708392534935
Energy: 0.6025251141167894
Energy: 0.3908735944254479
Energy: 0.5026110740039371
Energy: 0.4076845420771029
Energy: 0.40045469971357656
Energy: 0.4087132456230675
Energy: 0.4536250904705782
Energy: 0.38575927312963476
Energy: 0.38236296557989413
Energy: 0.42514124649577373
Energy: 0.3984362452223008
Energy: 0.4076364103476671
Energy: 0.40082409242857353
Energy: 0.38273352202623606
Energy: 0.3826999009150852
Energy: 0.40140858784863126
Energy: 0.406154859915231
Energy: 0.41553667768723923
Energy: 0.4340098029876695
Energy: 0.38529235179053034
Energy: 0.38558543554485897
Energy: 0.4288956866904847
Energy: 0.3993257627465521
Energy: 0.38311594831235846
Energy: 0.4289402316524182
Energy: 0.3982532756546197
Energy: 0.40658796358078364
Energy: 0.4289856256788343
Energy: 0.40962469344477775
Energy: 0.4084876739106991
Energy: 0.4319334328860883
Energy: 0.4042650283238827
Energy: 0.40563903649942373
Energy: 0.42185404945319505
Energy: 0.41661104539617794
Energy: 0.3854746854555406
Energy: 0.42064199315367523
Energy: 0.38644981368719544
Energy: 0.4062452557270902
Energy: 0.4113365427817527
Energy: 0.4058217847535592
Energy: 0.4057398890732215
Energy: 0.4239892415653551
Energy: 0.4064759683575055
Energy: 0.40540600679953753
Energy: 0.4096439936002271
Energy: 0.4290189043013025
Energy: 0.38123589779271216
Energy: 0.44965896417740553
Energy: 0.41336181927587495
Energy: 0.42949730940526143
Energy: 0.4088535785314677
Energy: 0.43070595378767423
Energy: 0.3854758084458388
Energy: 0.44995903761767964
Energy: 0.4288404009460432
Energy: 0.406039724455843
Energy: 0.40638329324234373
Energy: 0.42839769053303745
Energy: 0.3848116361319312
Energy: 0.44628365132433007
Energy: 0.39917548404564956
Energy: 0.409755048385393
Energy: 0.40924102970558757
Energy: 0.4232241416370825
Energy: 0.40807005245940287
Energy: 0.44843424676642907
Energy: 0.4121917609162901
Energy: 0.40346867728060676
Energy: 0.42004310548254814
Energy: 0.41374284807912853
Energy: 0.3895021227188309
Energy: 0.430716115227213
Energy: 0.4182448408975273
Energy: 0.4220671001611252
Energy: 0.430747949400472
Energy: 0.41574820601219603
Energy: 0.3909297104482883
Energy: 0.42974564132348647
Energy: 0.40299620236503153
Energy: 0.40319502335709223
Energy: 0.4288505753853591
Energy: 0.402630490586392
Energy: 0.4107673365950973
Energy: 0.4442536277971968
Energy: 0.3866454316782961
Energy: 0.385823544548409
Energy: 0.395004718803839
Energy: 0.4089323582831869
Energy: 0.43189945150689857
Energy: 0.4537949671729605
Energy: 0.4026156067462041
Energy: 0.40317721671166207
Energy: 0.4243801298750617
Energy: 0.40336510846915635
Energy: 0.40357876958788585
Energy: 0.4514973429036357
Energy: 0.41235449812223096
Energy: 0.407356601150415
Energy: 0.41776637544739187
Energy: 0.4040254703827626
Energy: 0.40622741889725306
Energy: 0.4534857981675686
Energy: 0.42072738459437964
Energy: 0.4083734844752078
Energy: 0.40883057153268654
Energy: 0.42062911169592204
Energy: 0.40512583072764746
Energy: 0.47121069928808657
Energy: 0.3952174787894987
Energy: 0.4086392547581049
Energy: 0.4048781216664901
Energy: 0.4259077116953139
Energy: 0.38728491572708607

minimum gb energy = 0.37577264786962433 eV
minimum distance =  2.69109724929985 Angstroms
sigma value = 57


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

Energy: 0.3646899927881153
Energy: 0.3553715055792892
Energy: 0.1983610989216657
Energy: 0.19753935853756255
Energy: 0.35520768558389443
Energy: 0.35557569089557167
Energy: 0.47706670939091467
Energy: 0.348317159803481
Energy: 0.3309431758685434
Energy: 0.3847836964792147
Energy: 0.38522411001746265
Energy: 0.34810022882939917
Energy: 0.47867736477448314
Energy: 0.348140652238003
Energy: 0.34832960413450437
Energy: 0.34667940564005967
Energy: 0.3489863648533488
Energy: 0.49395691986447604
Energy: 0.4785766626539348
Energy: 0.43470504267888443
Energy: 0.46076478257760334
Energy: 0.4436490170354394
Energy: 0.42979934714257984
Energy: 0.4484480386362145
Energy: 0.4774898393681101
Energy: 0.28107609034357045
Energy: 0.2795223524129672
Energy: 0.44510452211934803
Energy: 0.19762385204293656
Energy: 0.44429065056491485
Energy: 0.42723251564693787
Energy: 0.2818644725744574
Energy: 0.28399821737358916
Energy: 0.44047818414106144
Energy: 0.20116552911474542
Energy: 0.21041144508897147
Energy: 0.47830117330306826
Energy: 0.44462947516718504
Energy: 0.4430336007533414
Energy: 0.44109052911083474
Energy: 0.45080968266145877
Energy: 0.4412652895747015
Energy: 0.44158427703884484
Energy: 0.4915521114601529
Energy: 0.4700864950878819
Energy: 0.4407354746304033
Energy: 0.4956693212213048
Energy: 0.4415592727112721
Energy: 0.49095749792843113
Energy: 0.48877556443895326
Energy: 0.49222122933755413
Energy: 0.5000516110845105
Energy: 0.49580637647211906
Energy: 0.4914353003177798
Energy: 0.2010323540944262
Energy: 0.505423012573894
Energy: 0.19854252789258395
Energy: 0.2013585699727876
Energy: 0.5119237364325285
Energy: 0.2102939955262011
Energy: 0.19692376113530352
Energy: 0.49376062454187786
Energy: 0.49803075642336
Energy: 0.1971949600468488
Energy: 0.4942620657227474
Energy: 0.19857883119353062
Energy: 0.49892126006640525
Energy: 0.495429004097578
Energy: 0.4898710768211673
Energy: 0.48750537971639846
Energy: 0.49373152147187355
Energy: 0.4870499632817071
Energy: 0.4489339219067732
Energy: 0.46103978186213534
Energy: 0.46630570281033523
Energy: 0.42845508076937694
Energy: 0.467630446345601
Energy: 0.5004718156767044
Energy: 0.4927539452930294
Energy: 0.45902806318194334
Energy: 0.44149401180191267
Energy: 0.44861399845515754
Energy: 0.458268598409495
Energy: 0.44015332589899836
Energy: 0.43862666883115814
Energy: 0.20375471755030108
Energy: 0.1980122285174451
Energy: 0.44813546700085805
Energy: 0.28163543818506037
Energy: 0.2862578898163517
Energy: 0.459845603971599
Energy: 0.4309230170956405
Energy: 0.44004956476365586
Energy: 0.43552127073118024
Energy: 0.2818523795602937
Energy: 0.44680658541250623
Energy: 0.4609435077790032
Energy: 0.4478115614191078
Energy: 0.44663621679936916
Energy: 0.4611938192452183
Energy: 0.38173276855257704
Energy: 0.4869606895362204
Energy: 0.47861298225921445
Energy: 0.33054834428068935
Energy: 0.3480260346232706
Energy: 0.34890109981217765
Energy: 0.3463686251905773
Energy: 0.4931592555664237
Energy: 0.3651452631010685
Energy: 0.3467556220432024
Energy: 0.32970958186094973
Energy: 0.19732701752501253
Energy: 0.33634989428565876
Energy: 0.3301937417014787

minimum gb energy = 0.19692376113530352 eV
minimum distance =  2.7063032817368 Angstroms
sigma value = 11


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

Energy: 0.792851090479172
Energy: 0.34523483935664123
Energy: 0.4016403628766644
Energy: 0.3564585332350732
Energy: 0.3289416584852827
Energy: 0.3980689890713824
Energy: 0.32806729038633353
Energy: 0.32855887468326445
Energy: 0.33036630014264795
Energy: 0.32503915107539677
Energy: 0.32597880128253925
Energy: 0.32378145059754887
Energy: 0.3280977688830668
Energy: 0.33368639900600716
Energy: 0.3288072815316562
Energy: 0.3278251142058885
Energy: 0.3333800092792832
Energy: 0.325014466930238
Energy: 0.3287701827007744
Energy: 0.3398191248633493
Energy: 0.32339786622140654
Energy: 0.32866107857900095
Energy: 0.3260590413160016
Energy: 0.32940551318345984
Energy: 0.32648383745341364
Energy: 0.3902015715444256
Energy: 0.36271349265059805
Energy: 0.33660232602222057
Energy: 0.331594409483294
Energy: 0.3298548589861242
Energy: 0.34990407684239333
Energy: 0.3647154735499551
Energy: 0.3681866388596292
Energy: 0.3339190002920724
Energy: 0.3414088101013956
Energy: 0.3635158624750913
Energy: 0.3536651951618926
Energy: 0.3282492260595351
Energy: 0.3315852315900171
Energy: 0.3253586144237687
Energy: 0.33354281865534147
Energy: 0.32579078157295654
Energy: 0.3353179704618057
Energy: 0.33854366039378425
Energy: 0.3377599872874238
Energy: 0.33637730603892624
Energy: 0.3387825987673727
Energy: 0.3388207136718698
Energy: 0.35361063802909837
Energy: 0.33039284981971073
Energy: 0.32371911925724406
Energy: 0.33876810607932456
Energy: 0.32543682351421427
Energy: 0.32413836478521435
Energy: 0.46797070603163876
Energy: 0.35474485322577637
Energy: 0.36332923852013926
Energy: 0.3311267357803591
Energy: 0.36858555000234444
Energy: 0.3675803675004597
Energy: 0.37158179762215754
Energy: 0.354794856861417
Energy: 0.3554510770491096
Energy: 0.3269406571366069
Energy: 0.3628522082659808
Energy: 0.39007438198678634
Energy: 0.41996891189115443
Energy: 0.319903566498981
Energy: 0.3241168695281412
Energy: 0.40995896269331883
Energy: 0.3173873754452161
Energy: 0.3251005022744408
Energy: 0.39871950053209704
Energy: 0.3206803223354877
Energy: 0.31175110461916483
Energy: 0.341303418009072
Energy: 0.3189294139703929
Energy: 0.3283750753981825
Energy: 0.39930977152829467
Energy: 0.389283443221713
Energy: 0.3880807686844233
Energy: 0.3333389519369728
Energy: 0.39283549995978184
Energy: 0.3878669986761465
Energy: 0.4000701703654962
Energy: 0.332095291146919
Energy: 0.35381181977281434
Energy: 0.3739214895489346
Energy: 0.3234708902028005
Energy: 0.33284191348698167
Energy: 0.504326067643665
Energy: 0.38976372058482583
Energy: 0.388151365475739
Energy: 0.3547462034832173
Energy: 0.39414021694460466
Energy: 0.3884466791614331
Energy: 0.5507219074724745
Energy: 0.36533948844573855
Energy: 0.3262504336589424
Energy: 0.4673487032860816
Energy: 0.3795449300006869
Energy: 0.34436213511427516
Energy: 0.37851342744047306
Energy: 0.35496148247565895
Energy: 0.389346927855047
Energy: 0.3429333706020902
Energy: 0.36294169267464443
Energy: 0.3887397074840847
Energy: 0.37681696557329225
Energy: 0.32821494607494306
Energy: 0.36869308258159517
Energy: 0.33415680064847986
Energy: 0.33496960465393943
Energy: 0.36717914899043336
Energy: 0.44695398007941395
Energy: 0.4119644973101463
Energy: 0.3345231135082171
Energy: 0.4250331738649754
Energy: 0.3367982671272394
Energy: 0.3319971024017379
Energy: 0.5045154218698782
Energy: 0.3646909138760265
Energy: 0.35748915033659123
Energy: 0.36937010359066086
Energy: 0.389917756159337
Energy: 0.35604876999525015
Energy: 0.4610576295145584
Energy: 0.337040480792636
Energy: 0.3464674546397204
Energy: 0.5033226821774871
Energy: 0.3407647347111869
Energy: 0.3931694319875688
Energy: 0.32482579067508127
Energy: 0.36556061869640394
Energy: 0.3580805907817114
Energy: 0.3253635230864861
Energy: 0.3634033015532279
Energy: 0.35663239888686504
Energy: 0.3238235811576799
Energy: 0.3286018200389862
Energy: 0.32527902278860016
Energy: 0.32415899224602085
Energy: 0.32910995860147285
Energy: 0.32955212857019656
Energy: 0.3905670386373944
Energy: 0.3283594014508309
Energy: 0.33047612516715824
Energy: 0.3287105640210175
Energy: 0.3272794192592603
Energy: 0.3283902805569099
Energy: 0.37263720980932313
Energy: 0.32581463052899773
Energy: 0.3287265033453139
Energy: 0.32315977317838224
Energy: 0.324567753098602
Energy: 0.3640094451724628

minimum gb energy = 0.31175110461916483 eV
minimum distance =  2.67565875753688 Angstroms
sigma value = 41


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

Energy: 0.7400067707526986
Energy: 0.3662588526672627
Energy: 0.34869397719449025
Energy: 0.4115985324921165
Energy: 0.3842837013390127
Energy: 0.4115366942533437
Energy: 0.3479992757256385
Energy: 0.3544763976289032
Energy: 0.34665513338262105
Energy: 0.3494389131947887
Energy: 0.34844833769083916
Energy: 0.34646824727731484
Energy: 0.3482133302096894
Energy: 0.3465757676390271
Energy: 0.346078442074108
Energy: 0.34946390521251264
Energy: 0.34964885830713915
Energy: 0.34616231307576995
Energy: 0.34886111739728703
Energy: 0.3452773706972797
Energy: 0.34739392117351275
Energy: 0.34895060291086955
Energy: 0.3497167193410366
Energy: 0.34897799431290394
Energy: 0.34766136559761457
Energy: 0.34687703618403304
Energy: 0.3460273232623097
Energy: 0.35916110037296
Energy: 0.3463909296667213
Energy: 0.3471741236342505
Energy: 0.3928796904382218
Energy: 0.3479409399778287
Energy: 0.34745188365247826
Energy: 0.36231112362437284
Energy: 0.3516464902259868
Energy: 0.35338524538028704
Energy: 0.39160551278171957
Energy: 0.3495626591162646
Energy: 0.3484148052114942
Energy: 0.34928213192062796
Energy: 0.3603143501948887
Energy: 0.34824989674952855
Energy: 0.363317082678569
Energy: 0.3730638954040081
Energy: 0.3719379769904082
Energy: 0.33108912207908536
Energy: 0.375687737729121
Energy: 0.34795841061677185
Energy: 0.3924825838275425
Energy: 0.3481605877329754
Energy: 0.34710102455165565
Energy: 0.3618232751946254
Energy: 0.3495263327069786
Energy: 0.3466640835205632
Energy: 0.5243210816157328
Energy: 0.3522470047265242
Energy: 0.3469325404156661
Energy: 0.452755031684182
Energy: 0.3641197650318629
Energy: 0.34785244328098147
Energy: 0.3926636577738151
Energy: 0.3524390741249727
Energy: 0.3467199125979392
Energy: 0.35099282158212736
Energy: 0.3609298236131339
Energy: 0.34603542228560874
Energy: 0.40312925156230534
Energy: 0.33278699157579555
Energy: 0.3319394519628449
Energy: 0.36323961528580273
Energy: 0.33295721777667503
Energy: 0.3468751387077035
Energy: 0.35034215528948376
Energy: 0.33174912735011214
Energy: 0.33154842962622555
Energy: 0.36356302101815996
Energy: 0.3326651612955694
Energy: 0.3310610128701053
Energy: 0.3510842997407876
Energy: 0.3517827833557935
Energy: 0.34671954610630246
Energy: 0.350438083729899
Energy: 0.36077471144205536
Energy: 0.34718812301578444
Energy: 0.3759678550071838
Energy: 0.36462475779057096
Energy: 0.366325168676004
Energy: 0.37624609436013523
Energy: 0.3469917984895214
Energy: 0.3725598420736565
Energy: 0.34861393197729634
Energy: 0.35474403780853414
Energy: 0.34773769331793086
Energy: 0.36038503962410645
Energy: 0.34908956689956777
Energy: 0.34795637424911496
Energy: 0.6841037006077404
Energy: 0.34858032008243467
Energy: 0.33232070212995823
Energy: 0.36243434110655065
Energy: 0.34982114146089344
Energy: 0.36250818639769744
Energy: 0.3637567545577254
Energy: 0.3506034348687923
Energy: 0.3499416004054259
Energy: 0.35032914174127394
Energy: 0.36020097984288285
Energy: 0.33273139528434714
Energy: 0.3496127585153239
Energy: 0.350642008155619
Energy: 0.34797273759416913
Energy: 0.34956856086681654
Energy: 0.34962030550101986
Energy: 0.34768104344211087
Energy: 0.347397165859241
Energy: 0.34582322223320056
Energy: 0.3465689283726163
Energy: 0.3490712877570382
Energy: 0.3500926448287935
Energy: 0.3470502383843889
Energy: 0.3482105865983195
Energy: 0.34733243090755855
Energy: 0.3464537024773313
Energy: 0.3489618713765312
Energy: 0.3487523999065528
Energy: 0.3464160616503811
Energy: 0.3675825681563696
Energy: 0.36235653841002596
Energy: 0.3840233470738084
Energy: 0.4151612740229265
Energy: 0.3528030695259748
Energy: 0.392177696689652
Energy: 0.39219420906253094
Energy: 0.3481034493939918
Energy: 0.3477348547377708
Energy: 0.3604369463258165
Energy: 0.3488539060546574
Energy: 0.3475264364372002
Energy: 0.3632769569000962
Energy: 0.3773254044875641
Energy: 0.35046581799600873
Energy: 0.35851327226433144
Energy: 0.37694600385107974
Energy: 0.34990769791161425
Energy: 0.3919058911565023
Energy: 0.3493042507164729
Energy: 0.3478936709423199
Energy: 0.36071175924022203
Energy: 0.3498005091009681
Energy: 0.34844595144137064
Energy: 0.5249605267397797
Energy: 0.3521402188035633
Energy: 0.34777394651074683
Energy: 0.35109643112434014
Energy: 0.3612191785337463
Energy: 0.34616456892556313
Energy: 0.524997022307336
Energy: 0.3524962725489365
Energy: 0.3470810932985287
Energy: 0.3505799434044022
Energy: 0.36453582855797934
Energy: 0.3498694064504146
Energy: 0.39304264943606065
Energy: 0.35902978683199965
Energy: 0.3572705797648254
Energy: 0.36071648258205236
Energy: 0.3436685214883856
Energy: 0.35550179880656063
Energy: 0.3508334599910519
Energy: 0.3315014812424804
Energy: 0.3313487776072377
Energy: 0.36595916213502916
Energy: 0.33132351110249336
Energy: 0.3603684867391031
Energy: 0.3502998252107754
Energy: 0.35283854862801356
Energy: 0.35136899563959506
Energy: 0.34823872364430675
Energy: 0.35279543870385366
Energy: 0.3517382409147895
Energy: 0.34975644224123353
Energy: 0.3466280041721781
Energy: 0.3452614816777849
Energy: 0.3496924233708145
Energy: 0.34715918650859534
Energy: 0.34779948908998687
Energy: 0.34925232802043116
Energy: 0.3500579320726472
Energy: 0.34616096774290794
Energy: 0.3502437886608687
Energy: 0.35002197906439364
Energy: 0.3477586041863257
Energy: 0.684216961458807
Energy: 0.3498853466739496
Energy: 0.3335825719778393
Energy: 0.3339432395698558
Energy: 0.3532238782309259
Energy: 0.33251142341228207

minimum gb energy = 0.3310610128701053 eV
minimum distance =  2.69757290903412 Angstroms
sigma value = 33


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

Energy: 0.47518965604212365
Energy: 0.4512950487060218
Energy: 0.3825404898479487
Energy: 0.3775153086757993
Energy: 0.451638490106734
Energy: 0.3815129301422144
Energy: 0.38586892011491714
Energy: 0.37300077666356146
Energy: 0.37225558891845173
Energy: 0.3838601315397801
Energy: 0.3826791566150708
Energy: 0.3734943012064215
Energy: 0.3855239583310723
Energy: 0.3740353101063811
Energy: 0.3741658318948078
Energy: 0.3741525184486457
Energy: 0.3738727888563991
Energy: 0.3810465932235804
Energy: 0.38691670766710934
Energy: 0.37592537151338845
Energy: 0.37800894902885324
Energy: 0.3738891044069498
Energy: 0.37754140618203164
Energy: 0.3779021761611467
Energy: 0.3847116461435174
Energy: 0.3777379716458404
Energy: 0.36285528407454637
Energy: 0.38519016370325637
Energy: 0.3893467079202049
Energy: 0.3635932126668361
Energy: 0.4097837533522294
Energy: 0.3770598134221504
Energy: 0.3780584871682796
Energy: 0.36271951956687243
Energy: 0.37722402538677124
Energy: 0.37900462719920425
Energy: 0.4109744708776625
Energy: 0.3861966562261503
Energy: 0.386842870367795
Energy: 0.38329929086684444
Energy: 0.4018799230965846
Energy: 0.3775877167259764
Energy: 0.40441996212836456
Energy: 0.39469590179806785
Energy: 0.37766555116206607
Energy: 0.3621288343708462
Energy: 0.39383809229235905
Energy: 0.3784074804512871
Energy: 0.41031851102049166
Energy: 0.36279395488599375
Energy: 0.36316818864666905
Energy: 0.39839410164305783
Energy: 0.36474362471786537
Energy: 0.3654967871359903
Energy: 0.4105891830257223
Energy: 0.3740269319258085
Energy: 0.3736978278004749
Energy: 0.373694561144389
Energy: 0.3735530522127628
Energy: 0.380593839166727
Energy: 0.40949566814727684
Energy: 0.37457917803445184
Energy: 0.3764034678641911
Energy: 0.37351306806198514
Energy: 0.3650151768567428
Energy: 0.3762919369953002
Energy: 0.4257610553142038
Energy: 0.36222964514246164
Energy: 0.3619931087300003
Energy: 0.38126917830404616
Energy: 0.36927764426424387
Energy: 0.36194578774739317
Energy: 0.42061511375588084
Energy: 0.3625056161353389
Energy: 0.36259934622231527
Energy: 0.3632157693651221
Energy: 0.37164424626225684
Energy: 0.36211228337111734
Energy: 0.39064156140802164
Energy: 0.3754477488879678
Energy: 0.37554794875563885
Energy: 0.38717395698336027
Energy: 0.38507801779423
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Energy: 0.37858920987352307
Energy: 0.37453232300147626
Energy: 0.3743517280028418
Energy: 0.3741319530271888
Energy: 0.3750299139556676
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Energy: 0.3866796980557341
Energy: 0.3833578646584009
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Energy: 0.3972894484726255
Energy: 0.38452332187560184
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Energy: 0.6301166367689855
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Energy: 0.374803517502997
Energy: 0.3769242070920885
Energy: 0.4084159331308858
Energy: 0.3804813472357394
Energy: 0.4134912778047609
Energy: 0.3630354773561282
Energy: 0.363208825585064
Energy: 0.4026685716452029
Energy: 0.36521805783444816
Energy: 0.36299501493162895
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Energy: 0.3630465705167664
Energy: 0.373674704085814
Energy: 0.3643099030542109
Energy: 0.37804187962387065
Energy: 0.36633992941243604
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Energy: 0.363485179497956
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Energy: 0.36400869115478096
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Energy: 0.36563042994834777
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Energy: 0.36612506887587154
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Energy: 0.41530598330961327
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Energy: 0.37910379121674515
Energy: 0.41490109242073914
Energy: 0.3800655498508087
Energy: 0.39378643460957974
Energy: 0.38617317081242575
Energy: 0.38437010410556943
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Energy: 0.40914733830914873
Energy: 0.3701807882478354
Energy: 0.3623052027186713
Energy: 0.3621198251001343
Energy: 0.37281543208685725
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Energy: 0.37274016274159083
Energy: 0.38432979101117415
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Energy: 0.3759418267214357
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Energy: 0.3807292310260742
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Energy: 0.3621086931199359
Energy: 0.3881309528277649
Energy: 0.38650398787142504
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Energy: 0.36496675432767856
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Energy: 0.38816576635162653
Energy: 0.3623658741849979
Energy: 0.36218277383020187
Energy: 0.3757703093561874
Energy: 0.3618132021696826
Energy: 0.3651993411344583
Energy: 0.36318261479927766
Energy: 0.36368222713170284
Energy: 0.36574536675369546
Energy: 0.36396420209648384
Energy: 0.36491915882769627
Energy: 0.3630852203739742
Energy: 0.4148703491278559
Energy: 0.38021745462762574
Energy: 0.39254027626343174
Energy: 0.41408497515442755
Energy: 0.380840631883929
Energy: 0.3932208444602213
Energy: 0.3871362126373136
Energy: 0.3737588696295959
Energy: 0.3755361783387564
Energy: 0.37736152391661615
Energy: 0.3832434034696778
Energy: 0.3761699536700214
Energy: 0.6341501203762695
Energy: 0.3651625271276801
Energy: 0.3623823789592697
Energy: 0.36295897613297473
Energy: 0.3702163626266418
Energy: 0.3619901328616979

minimum gb energy = 0.3618132021696826 eV
minimum distance =  2.70253135318905 Angstroms
sigma value = 67


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

Energy: 0.5623747133488569
Energy: 0.4235520926528555
Energy: 0.40749624265344997
Energy: 0.4080807609497237
Energy: 0.4233204955969753
Energy: 0.40909187540917463
Energy: 0.41973728580039055
Energy: 0.3947445187844172
Energy: 0.39486047685818804
Energy: 0.3945229236267995
Energy: 0.39560162254558906
Energy: 0.3944877536639149
Energy: 0.41474156053856787
Energy: 0.38278560951890783
Energy: 0.3955630391791178
Energy: 0.39541405136286295
Energy: 0.38106746990259044
Energy: 0.39537945463524765
Energy: 0.41492271126736013
Energy: 0.3953085944146417
Energy: 0.3953811040600532
Energy: 0.3940143220949749
Energy: 0.39545773171777027
Energy: 0.39540748682645316
Energy: 0.4179067389169347
Energy: 0.39534617627950014
Energy: 0.3962878904140251
Energy: 0.41801562702440626
Energy: 0.3953206760162046
Energy: 0.3966346732613982
Energy: 0.4188616387854602
Energy: 0.39742666541841665
Energy: 0.39741305721835635
Energy: 0.41917461032573206
Energy: 0.39761730452811517
Energy: 0.3976943926052502
Energy: 0.4438465977256532
Energy: 0.3955247562168547
Energy: 0.3946231177990542
Energy: 0.37815310992344003
Energy: 0.39519073635450624
Energy: 0.3944201139007317

minimum gb energy = 0.37815310992344003 eV
minimum distance =  2.74432429336881 Angstroms
sigma value = 3


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

Energy: 0.6318983497652877
Energy: 0.5194966224931735
Energy: 0.4607220761844215
Energy: 0.5016598744824415
Energy: 0.5283836046441439
Energy: 0.45745814493155873
Energy: 0.4518665221967236
Energy: 0.46039373427811703
Energy: 0.46146328013103133
Energy: 0.47617598000899636
Energy: 0.47046406812840874
Energy: 0.45794854836460747
Energy: 0.4781227073598806
Energy: 0.4561415900838632
Energy: 0.45623100175778886
Energy: 0.477998136778813
Energy: 0.4559781934742428
Energy: 0.45352331556595116
Energy: 0.4518157219538888
Energy: 0.4552141977071305
Energy: 0.4532900266263319
Energy: 0.45241291424852625
Energy: 0.4556025257276372
Energy: 0.4531570299852802
Energy: 0.45970760336843897
Energy: 0.45695905967414
Energy: 0.45688038090711136
Energy: 0.4598498710361882
Energy: 0.45988255724180144
Energy: 0.4522488159493574
Energy: 0.45128190161235276
Energy: 0.45541278130882407
Energy: 0.45471421303124493
Energy: 0.4514078634589974
Energy: 0.459231626424231
Energy: 0.45250375904136975
Energy: 0.4525617517310923
Energy: 0.46702318696606127
Energy: 0.4651397074627889
Energy: 0.4535240782616471
Energy: 0.4582753449471209
Energy: 0.461303146872508
Energy: 0.5896153604374426
Energy: 0.47679221960733476
Energy: 0.47689385609193585
Energy: 0.4768156195955989
Energy: 0.47674137851367315
Energy: 0.47871580101783634
Energy: 0.4539441163555608
Energy: 0.4562807766443741
Energy: 0.45948302237253225
Energy: 0.45873415180904414
Energy: 0.45981219010178853
Energy: 0.46592490257062213
Energy: 0.4532042366915689
Energy: 0.449499589476624
Energy: 0.4503424656320052
Energy: 0.49065327752945515
Energy: 0.4484680134463538
Energy: 0.4733566447777734
Energy: 0.4930701564669182
Energy: 0.4523637466322301
Energy: 0.45406491812592037
Energy: 0.46105722665748805
Energy: 0.4484563923883909
Energy: 0.471699062821
Energy: 0.4542590376586195
Energy: 0.4618779768955467
Energy: 0.46091227930202505
Energy: 0.45641652797222276
Energy: 0.4571222468139762
Energy: 0.45032066193691733
Energy: 0.4663420959073915
Energy: 0.4500083669535455
Energy: 0.45054582173589913
Energy: 0.4485904518499524
Energy: 0.4500584262388245
Energy: 0.45024354890139184
Energy: 0.4882728645233391
Energy: 0.45341061300052526
Energy: 0.4523397668872992
Energy: 0.46078403591033457
Energy: 0.45111250473002773
Energy: 0.4503821628311334
Energy: 0.516205279987362
Energy: 0.4551536057506198
Energy: 0.5003634915521373
Energy: 0.4551556534281494
Energy: 0.47869639702876293
Energy: 0.45264020570925245
Energy: 0.4754401187430269
Energy: 0.4613406562122612
Energy: 0.46626797698297084
Energy: 0.48348165811239857
Energy: 0.4603555217409837
Energy: 0.45914722891259246
Energy: 0.53340342795228
Energy: 0.4561494297329486
Energy: 0.458186029761869
Energy: 0.4723696016003544
Energy: 0.4562994924312253
Energy: 0.46362928659602304
Energy: 0.4641048586573041
Energy: 0.45810532742758897
Energy: 0.4651348069100131
Energy: 0.4638186073648383
Energy: 0.4562201647548319
Energy: 0.47053453864387756
Energy: 0.4641884653688634
Energy: 0.4529816663530235
Energy: 0.4512353312637985
Energy: 0.45128466357833
Energy: 0.49258408321951974
Energy: 0.4522752666206158
Energy: 0.5091608005725206
Energy: 0.4537991862360434
Energy: 0.4538112911834947
Energy: 0.4556163618495517
Energy: 0.45603781505452873
Energy: 0.45034860066709553
Energy: 0.4735867475316649
Energy: 0.46437953026900847
Energy: 0.4671220004078293
Energy: 0.455004641104009
Energy: 0.4650365751505751
Energy: 0.46723593949512526
Energy: 0.4605505010319876
Energy: 0.46256378939108417
Energy: 0.4586876912095321
Energy: 0.460446714759859
Energy: 0.4682023845428237
Energy: 0.45842164780766376
Energy: 0.4650920318094056
Energy: 0.461150723956714
Energy: 0.46167155551703504
Energy: 0.46580544050700634
Energy: 0.4654491745006137
Energy: 0.4609513350974887
Energy: 0.4623278248167475
Energy: 0.45128625670888245
Energy: 0.45098851583445126
Energy: 0.4628099017544992
Energy: 0.4499822374203577
Energy: 0.46122152032924196
Energy: 0.45987127070803574
Energy: 0.45831547164773845
Energy: 0.45565167804629486
Energy: 0.4561897402753198
Energy: 0.46262942551702374
Energy: 0.4562065734992008
Energy: 0.6219534538966223
Energy: 0.4877662800094468
Energy: 0.48807193519970693
Energy: 0.45918055750697473
Energy: 0.45346001088287374
Energy: 0.4589106872218747
Energy: 0.4423192229073711
Energy: 0.47342350563360697
Energy: 0.46710179871429025
Energy: 0.4424019495020789
Energy: 0.4682985946114111
Energy: 0.457206077873716
Energy: 0.4616212093967807
Energy: 0.45795235471018697
Energy: 0.454735420474506
Energy: 0.47553613594942323
Energy: 0.4718090760313944
Energy: 0.45600195243131586
Energy: 0.4685034973303283
Energy: 0.4562579662031292
Energy: 0.45622152537042304
Energy: 0.4694946296762038
Energy: 0.45649436499069784
Energy: 0.458935690512354
Energy: 0.459406935349036
Energy: 0.46457240021914503
Energy: 0.4602714051800524
Energy: 0.4602008397721026
Energy: 0.4717515642846495
Energy: 0.46571788964458594
Energy: 0.45948263897948766
Energy: 0.4606942346703294
Energy: 0.46033832726850465
Energy: 0.45884127447709505
Energy: 0.46276264873551837
Energy: 0.4628117583445527
Energy: 0.46450226925167665
Energy: 0.4603082368380714
Energy: 0.4614458849096426
Energy: 0.45837812247783905
Energy: 0.460674637164501
Energy: 0.46662986266273804
Energy: 0.570794372104854
Energy: 0.46805494042452456
Energy: 0.46514147355824403
Energy: 0.4491856178215071
Energy: 0.45820502727454593
Energy: 0.45712301251512294
Energy: 0.44944601755312846
Energy: 0.46035121379173977
Energy: 0.47065221590570655
Energy: 0.45439794796543104
Energy: 0.45153792934315784
Energy: 0.4498837181090363
Energy: 0.46316652636541095
Energy: 0.46370637087707517
Energy: 0.4712977078164208
Energy: 0.45614231359514734
Energy: 0.44863382988443506
Energy: 0.47122356931411585
Energy: 0.4818130560948352
Energy: 0.44954057662604796
Energy: 0.4502165534185793
Energy: 0.4807796921294296
Energy: 0.4486737846345296
Energy: 0.4550763348346833
Energy: 0.4819555079573455
Energy: 0.46669480008541964
Energy: 0.4691998392381855
Energy: 0.46058110720072976
Energy: 0.4656580682758878
Energy: 0.4691259918155529
Energy: 0.46663222204804466
Energy: 0.45107604376865035
Energy: 0.45070609942383405
Energy: 0.4484105546802467
Energy: 0.4512204106715467
Energy: 0.4501993755200412
Energy: 0.4930392754029645
Energy: 0.4565247804314877
Energy: 0.4582464963293901
Energy: 0.4657442050412356
Energy: 0.4540646928699577
Energy: 0.45502163168085674
Energy: 0.48732348950610826
Energy: 0.45438432336078277
Energy: 0.4512946070020079
Energy: 0.45523933747615924
Energy: 0.4539328488115443
Energy: 0.4517984765676576
Energy: 0.453418776193277
Energy: 0.45242744587625555
Energy: 0.4531235974483639
Energy: 0.4702443470403517
Energy: 0.45699952482930534
Energy: 0.45114064855160824
Energy: 0.49305047647891964
Energy: 0.4570115149485696
Energy: 0.4593613943120779
Energy: 0.4734168557668226
Energy: 0.45887519701214824
Energy: 0.4772194158447006
Energy: 0.5190258976455764
Energy: 0.45617769123848273
Energy: 0.4561718029364477
Energy: 0.5008575861936301
Energy: 0.45575151682651366
Energy: 0.4775844986486126
Energy: 0.4589878907229662
Energy: 0.4530397273581759
Energy: 0.4537274962635199
Energy: 0.4535521862799844
Energy: 0.4571055156395482
Energy: 0.4514518345755342
Energy: 0.5824935975263911
Energy: 0.45059242986340053
Energy: 0.4665666598839522
Energy: 0.48921430752831496
Energy: 0.4499633464293235
Energy: 0.4665432377753622
Energy: 0.45860755270106524
Energy: 0.4538254549991381
Energy: 0.4545246553435557
Energy: 0.45654004953328603
Energy: 0.4545664937690875
Energy: 0.4557173358862054
Energy: 0.4519742990947334
Energy: 0.4530132838216656
Energy: 0.4524764004501899
Energy: 0.45455075631105296
Energy: 0.4532770027664167
Energy: 0.45105581122851296
Energy: 0.44983874527700257
Energy: 0.45600047157746365
Energy: 0.46301234875383734
Energy: 0.45069483188249215
Energy: 0.4512652120426188
Energy: 0.4631354274048174
Energy: 0.45050494237318695
Energy: 0.45167208781754964
Energy: 0.453942737412079
Energy: 0.4510845757706526
Energy: 0.45320566476601537
Energy: 0.4507710908721703
Energy: 0.45503550985394015
Energy: 0.45155852707041394
Energy: 0.45068272643823354
Energy: 0.46209336563351533
Energy: 0.45133104754375897
Energy: 0.45361448005346877
Energy: 0.4538979618339428
Energy: 0.46361741092310055
Energy: 0.46386019232838654
Energy: 0.46760963112764975
Energy: 0.4656792505403652
Energy: 0.45930927763390483

minimum gb energy = 0.4423192229073711 eV
minimum distance =  2.6627409302811 Angstroms
sigma value = 81


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

Energy: 0.9140540630765853
Energy: 0.45619316642540425
Energy: 0.43481990204799875
Energy: 0.43424979541264397
Energy: 0.45623701348564294
Energy: 0.4884253263778356
Energy: 0.4500681439450724
Energy: 0.4522115128855382
Energy: 0.452846652016456
Energy: 0.4467362389753754
Energy: 0.4207111208953478
Energy: 0.42101299814820764
Energy: 0.44867904600964104
Energy: 0.4832680795166182
Energy: 0.4842693033692121
Energy: 0.4540946675033878
Energy: 0.4821513578401321
Energy: 0.4548140490876281
Energy: 0.45231557268189027
Energy: 0.48760987356613666
Energy: 0.4338157123442521
Energy: 0.5021018271958282
Energy: 0.4854650081245671
Energy: 0.46117451242781754
Energy: 0.44846049305678265
Energy: 0.45377326018192515
Energy: 0.543256202622007
Energy: 0.5415902026329078
Energy: 0.45228793888950414
Energy: 0.4543065691610502
Energy: 0.4567807046346405
Energy: 0.5062153121109414
Energy: 0.5036156120224462
Energy: 0.5440810936667304
Energy: 0.4229212550913293
Energy: 0.5416543124398622
Energy: 0.479979705878826
Energy: 0.49237941225324594
Energy: 0.4906191058800794
Energy: 0.48221988038523245
Energy: 0.4539761949126817
Energy: 0.49541976571577195
Energy: 0.6049559818359754
Energy: 0.5905991607221236
Energy: 0.5276601423205809
Energy: 0.47676900749013323
Energy: 0.5298819770165465
Energy: 0.48727819784737963
Energy: 0.4784319457528676
Energy: 0.48454069889267315
Energy: 0.47945640990807636
Energy: 0.4892488797543015
Energy: 0.4788425917309476
Energy: 0.48073523367432425
Energy: 0.5001906760666732
Energy: 0.4714124848666687
Energy: 0.47684664142035993
Energy: 0.48795908925451803
Energy: 0.4471664714600247
Energy: 0.4474962316393972
Energy: 0.49700260747008146
Energy: 0.47036819435218513
Energy: 0.4699707139023663
Energy: 0.4845681544101793
Energy: 0.4429314907241557
Energy: 0.48157791768173086
Energy: 0.5142851374415494
Energy: 0.480754379991086
Energy: 0.478199689688959
Energy: 0.4873141309936299
Energy: 0.4845676256216433
Energy: 0.47948531418339013
Energy: 0.5024135113524375
Energy: 0.4824950093615759
Energy: 0.482451559609817
Energy: 0.493182050405387
Energy: 0.4801707644590445
Energy: 0.4834269169059722
Energy: 0.4805518119208441
Energy: 0.4761200062668791
Energy: 0.47473176134192024
Energy: 0.503626446236013
Energy: 0.47397940298696833
Energy: 0.4743604630708504
Energy: 0.6126218217360534
Energy: 0.5487002838089392
Energy: 0.5437292437434201
Energy: 0.5503888733484226
Energy: 0.5537304749953917
Energy: 0.5453262257322792
Energy: 0.5081672888895399
Energy: 0.5480444424289329
Energy: 0.5526429761540546
Energy: 0.5087455904906883
Energy: 0.5245459640620457
Energy: 0.4870816882002175
Energy: 0.570615038465631
Energy: 0.4798124378956314
Energy: 0.48160537660884545
Energy: 0.5369278289166708
Energy: 0.48052227661409164
Energy: 0.4834832683444185
Energy: 0.5318787639534047
Energy: 0.5475984138676919
Energy: 0.5428626706809995
Energy: 0.5386194724398585
Energy: 0.48330975259275744
Energy: 0.5368846967372957
Energy: 0.4635531814944627
Energy: 0.5464859178769048
Energy: 0.48254739314085066
Energy: 0.4710554167999754
Energy: 0.5527224701710147
Energy: 0.4715992676368829
Energy: 0.4632502230447596
Energy: 0.5521181868917431
Energy: 0.4823101287802812
Energy: 0.4715773196052645
Energy: 0.48340217701622223
Energy: 0.47371737236109823
Energy: 0.5321320342063856
Energy: 0.48539961858159714
Energy: 0.5370490294150166
Energy: 0.5411466812332102
Energy: 0.4833635244781607
Energy: 0.537570184213221
Energy: 0.5058557886314039
Energy: 0.4839964641650293
Energy: 0.4842438151341832
Energy: 0.5058026044355414
Energy: 0.4829517880405717
Energy: 0.4839967599805473
Energy: 0.5034966689310605
Energy: 0.5292692766020923
Energy: 0.5496605090801054
Energy: 0.5045945160429478
Energy: 0.5384192833949356
Energy: 0.553390424685086
Energy: 0.511314161987556
Energy: 0.5443838645200524
Energy: 0.54341429687639
Energy: 0.5522890923581978
Energy: 0.5452279566314024
Energy: 0.543870845529437
Energy: 0.47765860520201026
Energy: 0.48267227614411323
Energy: 0.4875513335187068
Energy: 0.502876485022201
Energy: 0.48054745175175395
Energy: 0.48912377753495984
Energy: 0.5663765601914271
Energy: 0.521862441721965
Energy: 0.5214223203353999
Energy: 0.4799315528240581
Energy: 0.5228230296519136
Energy: 0.4845222030070678
Energy: 0.5213377683139923
Energy: 0.4782390752379883
Energy: 0.4781110744217374
Energy: 0.4849111336521275
Energy: 0.48306049653486993
Energy: 0.4787467303821819
Energy: 0.4957250592904115
Energy: 0.4472934480026646
Energy: 0.48067844823084777
Energy: 0.48571634898457866
Energy: 0.46904728937589724
Energy: 0.4875093255537615
Energy: 0.49923233745575524
Energy: 0.4459124844602732
Energy: 0.4483400176886498
Energy: 0.48715467755079955
Energy: 0.4719550271614095
Energy: 0.48067657497169025
Energy: 0.48197395310142144
Energy: 0.4838574743313292
Energy: 0.4836733633263996
Energy: 0.4875550790691602
Energy: 0.4830803763546399
Energy: 0.48414468690560214
Energy: 0.5029103120203403
Energy: 0.5049271016567645
Energy: 0.48834681204116265
Energy: 0.48714313765879796
Energy: 0.5041349250353877
Energy: 0.48272312694862707
Energy: 0.48303328266829926
Energy: 0.48033788258739335
Energy: 0.4218114503722689
Energy: 0.4820973281286018
Energy: 0.44783528009209295
Energy: 0.47884997596596174
Energy: 0.4531166070122048
Energy: 0.49780527766214383
Energy: 0.5382775325007437
Energy: 0.5052608202253009
Energy: 0.49930480838288566
Energy: 0.4949431163240572
Energy: 0.4515345296202481
Energy: 0.41932239256833465
Energy: 0.5420864164985376
Energy: 0.4549181283368599
Energy: 0.44559337665279575
Energy: 0.4616601559991781
Energy: 0.4556783432214637
Energy: 0.41885482094365184
Energy: 0.5432456744441403
Energy: 0.45726099658716857
Energy: 0.48039826862135093
Energy: 0.4622267348635503
Energy: 0.5673267530699181
Energy: 0.47994523354200064
Energy: 0.47984517198544013
Energy: 0.49374550782880783
Energy: 0.48077797848253856
Energy: 0.4924258693348166
Energy: 0.45086434061666897
Energy: 0.45240422007510017
Energy: 0.46395392171787847
Energy: 0.446736021378651
Energy: 0.411162390874892
Energy: 0.4227778503502209
Energy: 0.5713013099756441
Energy: 0.450491157569848
Energy: 0.43583489023198496
Energy: 0.42500735712041937
Energy: 0.41626111242192326
Energy: 0.487240725748766

minimum gb energy = 0.411162390874892 eV
minimum distance =  2.64185723646401 Angstroms
sigma value = 43


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

Energy: 0.6492658697739704
Energy: 0.4743079265381006
Energy: 0.4398970366128219
Energy: 0.44183759389630345
Energy: 0.5267215250514071
Energy: 0.4386048999398646
Energy: 0.4337296805981723
Energy: 0.441709545900505
Energy: 0.4462669526128423
Energy: 0.46632937985218526
Energy: 0.4418940027496896
Energy: 0.4351600668674864
Energy: 0.48397935947848286
Energy: 0.4277732809561826
Energy: 0.4274362101844958
Energy: 0.45151723293836016
Energy: 0.42778005144439835
Energy: 0.43526410442016156
Energy: 0.43260463538135413
Energy: 0.4254415313856238
Energy: 0.43652137139615027
Energy: 0.43253609487196226
Energy: 0.431780025093175
Energy: 0.43583255906405727
Energy: 0.43097509876423895
Energy: 0.43768423292547953
Energy: 0.4348716302047124
Energy: 0.4330412775006525
Energy: 0.43341149191412803
Energy: 0.43464116801558206
Energy: 0.4322590852191951
Energy: 0.43497424392772355
Energy: 0.4334677127467178
Energy: 0.43540124037103417
Energy: 0.43527019284294627
Energy: 0.4336065859165639
Energy: 0.43336236334953504
Energy: 0.43682572555375543
Energy: 0.4328706253323593
Energy: 0.4366143831958309
Energy: 0.43176583535956226
Energy: 0.4348236486235312
Energy: 0.4861849710547353
Energy: 0.43026433864980174
Energy: 0.4304148438327664
Energy: 0.4364122096441956
Energy: 0.43011658019644017
Energy: 0.43196237321985415
Energy: 0.43274109788120574
Energy: 0.429930461885813
Energy: 0.43172614649025204
Energy: 0.43353457119767264
Energy: 0.4308189515351744
Energy: 0.434667329899829
Energy: 0.4319035566819487
Energy: 0.4372483642520469
Energy: 0.4372406328158386
Energy: 0.4460354370964369
Energy: 0.4353563274559695
Energy: 0.4368211280973814
Energy: 0.4371304893750156
Energy: 0.4450570399189836
Energy: 0.4521993353258194
Energy: 0.43249275661263303
Energy: 0.43369784580041326
Energy: 0.446764953093012
Energy: 0.4397956526807721
Energy: 0.4323233171457512
Energy: 0.43588391067360394
Energy: 0.4338323003085099
Energy: 0.4317985319837589
Energy: 0.4348060662756561
Energy: 0.44002393291030945
Energy: 0.4316106215383019
Energy: 0.44137336341571964
Energy: 0.4298897862390538
Energy: 0.43336462396564135
Energy: 0.44137550018535937
Energy: 0.43695057969418133
Energy: 0.4340216020639202
Energy: 0.43673375685069415
Energy: 0.4355458641764973
Energy: 0.43319297027329773
Energy: 0.441466657215861
Energy: 0.43707659064394205
Energy: 0.4394987050874994
Energy: 0.4396428765304064
Energy: 0.44130497459712176
Energy: 0.4308495849082687
Energy: 0.4389873774836722
Energy: 0.43729811003225744
Energy: 0.43764989347082645
Energy: 0.4414080686920494
Energy: 0.4372629361285358
Energy: 0.43428230625670744
Energy: 0.4420403418750676
Energy: 0.43744815272750265
Energy: 0.45275422099634394
Energy: 0.4527556603831609
Energy: 0.4376167036375929
Energy: 0.43924879652177584
Energy: 0.43726310098420024
Energy: 0.43679584865298365
Energy: 0.44740779099799044
Energy: 0.4522996120453336
Energy: 0.4447976072044833
Energy: 0.44489664803689694
Energy: 0.4438513456489588
Energy: 0.4345772899691303
Energy: 0.43687094987269093
Energy: 0.44381568501516194
Energy: 0.43598975471748863
Energy: 0.4368828649256998
Energy: 0.4380440538359828
Energy: 0.43419145405185333
Energy: 0.43698982990792284
Energy: 0.44370618828197034
Energy: 0.4374234357935231
Energy: 0.4371578211527345
Energy: 0.4355778476860519
Energy: 0.43645251300743076
Energy: 0.4485907862487005
Energy: 0.44767238607382
Energy: 0.4498972217658757
Energy: 0.4411923624659531
Energy: 0.44459909158408606
Energy: 0.49343470877008
Energy: 0.44223150909434006
Energy: 0.43938887015320455
Energy: 0.4761187899794566
Energy: 0.42680206782267055
Energy: 0.48391240177246264
Energy: 0.44760965993490154
Energy: 0.44836435746152825
Energy: 0.4483874688242355
Energy: 0.44535386484077916
Energy: 0.44512415989863474
Energy: 0.4506544000592012
Energy: 0.4734915665243168
Energy: 0.4371434033005397
Energy: 0.4368736975681843
Energy: 0.4557925178559634
Energy: 0.4385285394721481
Energy: 0.44307533928918014
Energy: 0.48732386027441965
Energy: 0.43676301248452454
Energy: 0.4372674191829374
Energy: 0.44165139498254363
Energy: 0.43674340844405585
Energy: 0.44331291129961836
Energy: 0.4698303110865575
Energy: 0.44241502735271515
Energy: 0.44031471851995635
Energy: 0.44466721732148407
Energy: 0.4381132352658018
Energy: 0.4397512301279036
Energy: 0.4695306349369734
Energy: 0.4426208208037287
Energy: 0.4444436462548352
Energy: 0.43569847929204586
Energy: 0.4421995660224139
Energy: 0.4441656117628146
Energy: 0.4706274520981853
Energy: 0.43838404709454715
Energy: 0.4371794327005989
Energy: 0.43136810771216516
Energy: 0.4356224465421852
Energy: 0.4360772594993249
Energy: 0.4286668404123507
Energy: 0.43517362775331553
Energy: 0.43412999637375266
Energy: 0.42861639829143183
Energy: 0.43631166234554525
Energy: 0.43303143047341136
Energy: 0.43318341446883596
Energy: 0.43827752184687957
Energy: 0.4372881744015925
Energy: 0.4295589690060526
Energy: 0.4330134659545397
Energy: 0.4339881816687465
Energy: 0.4302684958748201
Energy: 0.4675280370186644
Energy: 0.44745211739688595
Energy: 0.442403867759203
Energy: 0.46370943571084816
Energy: 0.42742520103761433

minimum gb energy = 0.4254415313856238 eV
minimum distance =  2.6780716521665 Angstroms
sigma value = 57


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

Energy: 0.6157906932875306
Energy: 0.49917118048862
Energy: 0.4461825051967708
Energy: 0.4207129861502833
Energy: 0.49947432238651623
Energy: 0.44664701692281805
Energy: 0.4438354297835473
Energy: 0.44007367362872335
Energy: 0.43127566168998344
Energy: 0.4511853217563296
Energy: 0.45102850829805946
Energy: 0.4320988376544497
Energy: 0.45639304268362035
Energy: 0.4145476774757045
Energy: 0.4125679976161638
Energy: 0.4416907406674248
Energy: 0.41373367730903926
Energy: 0.41356092685727613
Energy: 0.44250150078418254
Energy: 0.41178569564045087
Energy: 0.4123611591661498
Energy: 0.4425003610696195
Energy: 0.412004754010023
Energy: 0.4336767351200778
Energy: 0.4492230278942834
Energy: 0.4281720330619782
Energy: 0.42814052593153085
Energy: 0.4353125345582925
Energy: 0.4317035564984904
Energy: 0.43506539758756413
Energy: 0.4129683868049867
Energy: 0.43066554383207145
Energy: 0.4271878779484706
Energy: 0.4341410017887851
Energy: 0.4296667456738263
Energy: 0.4284056553281067
Energy: 0.451475341570295
Energy: 0.43343828605233214
Energy: 0.43333434930894216
Energy: 0.4352356347481034
Energy: 0.44486256431635984
Energy: 0.43153981320078044
Energy: 0.4542063487104026
Energy: 0.435032325892877
Energy: 0.42675977197475595
Energy: 0.43119799139563025
Energy: 0.4370908819687215
Energy: 0.43824300321121523
Energy: 0.4510145142591032
Energy: 0.43201922850586444
Energy: 0.4287878274961218
Energy: 0.45199360864878785
Energy: 0.4504869728763278
Energy: 0.43240106277596096
Energy: 0.4335238010313798
Energy: 0.4325895690241012
Energy: 0.4355930678358945
Energy: 0.4328845530834544
Energy: 0.4357947739104652
Energy: 0.442213602927962
Energy: 0.4553993791055535
Energy: 0.4299538302471294
Energy: 0.4342152725193137
Energy: 0.43878376138705405
Energy: 0.43127755162565645
Energy: 0.4303475775891696
Energy: 0.4188734392355529
Energy: 0.4505019656369358
Energy: 0.4324042862728272
Energy: 0.41922636525960694
Energy: 0.45218248531924654
Energy: 0.4306704370532461
Energy: 0.4206018464322041
Energy: 0.4430368910330567
Energy: 0.46062324177483416
Energy: 0.41643801388880636
Energy: 0.45919513660682726
Energy: 0.41244706506654416
Energy: 0.45297348938810944
Energy: 0.4338345316082962
Energy: 0.43204772918004575
Energy: 0.45209272786356286
Energy: 0.4284828880811003
Energy: 0.4333967577472628
Energy: 0.4311001536926378
Energy: 0.4190187499559024
Energy: 0.42022606145864644
Energy: 0.4300531815366273
Energy: 0.4117226895816777
Energy: 0.4207664756358683
Energy: 0.44499516896544267
Energy: 0.4326439724312392
Energy: 0.4313730774478632
Energy: 0.44480223291949894
Energy: 0.4312261283045569
Energy: 0.43158272874744147
Energy: 0.45187279750096304
Energy: 0.43115673611050365
Energy: 0.4311493530515352
Energy: 0.4288083417152719
Energy: 0.4307818530590548
Energy: 0.4289515234071679
Energy: 0.4518371390105618
Energy: 0.4327867781785897
Energy: 0.4331235360279825
Energy: 0.4272173776851287
Energy: 0.4343656400873731
Energy: 0.4344423394881837
Energy: 0.4527248887767931
Energy: 0.44376340102494916
Energy: 0.43387384325097317
Energy: 0.4305512061733593
Energy: 0.44256588877231384
Energy: 0.4303247093871244
Energy: 0.45305999515920375
Energy: 0.4429053955730183
Energy: 0.434833008639911
Energy: 0.4309814242705948
Energy: 0.4426246206033896
Energy: 0.43044464973827284
Energy: 0.43800880588437685
Energy: 0.43011814172479834
Energy: 0.4323171536547876
Energy: 0.4396922295586758
Energy: 0.45270822052175996
Energy: 0.43189561645067737
Energy: 0.470855775056393
Energy: 0.43499984573593675
Energy: 0.42826716074670246
Energy: 0.4291514307682622
Energy: 0.4392403442203933
Energy: 0.43522137276161565
Energy: 0.4529059176666029
Energy: 0.436483077729716
Energy: 0.4303349282388446
Energy: 0.42909940525135204
Energy: 0.4528987876745378
Energy: 0.4324241076382968
Energy: 0.42085435218656436
Energy: 0.4425449388846308
Energy: 0.46039137067151475
Energy: 0.4171920153394337
Energy: 0.4265779767524375
Energy: 0.41225082796047086

minimum gb energy = 0.4117226895816777 eV
minimum distance =  2.69822447277627 Angstroms
sigma value = 17


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

Energy: 0.7270988988052363
Energy: 0.462999372891979
Energy: 0.4745841351593445
Energy: 0.42362695256569877
Energy: 0.4628607752752633
Energy: 0.43190262432384485
Energy: 0.533288954579789
Energy: 0.47770502674579407
Energy: 0.43382769855448894
Energy: 0.4844505578761201
Energy: 0.4782822847538794
Energy: 0.44014509935045415
Energy: 0.41681699570152597
Energy: 0.41326941749732543
Energy: 0.41293753835601066
Energy: 0.4666429988150494
Energy: 0.4131407463843058
Energy: 0.42337488862744865
Energy: 0.4675659052596257
Energy: 0.4222401298050196
Energy: 0.42215340744735635
Energy: 0.46785262275004486
Energy: 0.38932377256031153
Energy: 0.43828955802466496
Energy: 0.420943804296513
Energy: 0.4097512882653043
Energy: 0.4068710025112774
Energy: 0.4215188238778527
Energy: 0.4134904095295756
Energy: 0.4076183138457082
Energy: 0.42383471136976947
Energy: 0.4146727187961644
Energy: 0.4062275677672742
Energy: 0.39241529202853237
Energy: 0.420087890214286
Energy: 0.3912099924099542
Energy: 0.419576398736713
Energy: 0.4152815788570925
Energy: 0.41582661926255166
Energy: 0.4149390365277403
Energy: 0.41792204297435215
Energy: 0.4026556181756196
Energy: 0.4116989294424703
Energy: 0.39106722640406755
Energy: 0.3912039873607168
Energy: 0.3910884773753053
Energy: 0.3908181427923175
Energy: 0.3909215984815511
Energy: 0.41665162515255266
Energy: 0.3892513413953555
Energy: 0.38926747979056986
Energy: 0.4176323799489954
Energy: 0.3901839358552228
Energy: 0.40374011468593474
Energy: 0.419892908417289
Energy: 0.40599795029945424
Energy: 0.40625475091315644
Energy: 0.4200757510306063
Energy: 0.4055119802977756
Energy: 0.40594411021341803
Energy: 0.4114489664105251
Energy: 0.4070631326103499
Energy: 0.40769223149567924
Energy: 0.41347181388357596
Energy: 0.4218222048856067
Energy: 0.4070943184125454
Energy: 0.42189937073507844
Energy: 0.46916396194706933
Energy: 0.4676787101717267
Energy: 0.40443152553009737
Energy: 0.46943765695723855
Energy: 0.442843538649524
Energy: 0.4142801373828244
Energy: 0.46678511475295964
Energy: 0.46283950167192717
Energy: 0.4037208746661062
Energy: 0.4665710278817072
Energy: 0.4629547778244345
Energy: 0.420218307199795
Energy: 0.4809448704987971
Energy: 0.4324989684618735
Energy: 0.42199850667313565
Energy: 0.4854015165623081
Energy: 0.4381666002597357
Energy: 0.4497685883954386
Energy: 0.46616278022527613
Energy: 0.46653124050950584
Energy: 0.46425677244418456
Energy: 0.4664097104421983
Energy: 0.45506860161602014
Energy: 0.41832956262476034
Energy: 0.480883076100137
Energy: 0.43308393077471513
Energy: 0.47825380735755796
Energy: 0.4868429672423998
Energy: 0.4322501685152051
Energy: 0.4015611333184737
Energy: 0.4667516744241529
Energy: 0.4961892893279194
Energy: 0.4162548152835836
Energy: 0.4664700366274653
Energy: 0.4695142866692321

minimum gb energy = 0.3892513413953555 eV
minimum distance =  2.6509335459431 Angstroms
sigma value = 17


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

Energy: 0.772021886559155
Energy: 0.5380013263406136
Energy: 0.43015176423121815
Energy: 0.4068053464763669
Energy: 0.6362493469317755
Energy: 0.4310132256197795
Energy: 0.5137177288650421
Energy: 0.3945926707534194
Energy: 0.3891726175611343
Energy: 0.48216726578701957
Energy: 0.4887680295044719
Energy: 0.42893336430071444
Energy: 0.5647926899042673
Energy: 0.3713389158730853
Energy: 0.39885000210247074
Energy: 0.48149376172368047
Energy: 0.3710713375393942
Energy: 0.40263900508540484
Energy: 0.47795882711278853
Energy: 0.42202414410343203
Energy: 0.4216261151751647
Energy: 0.4783965977711473
Energy: 0.37177381688128486
Energy: 0.41989176649541476
Energy: 0.4149107756528595
Energy: 0.39264586003325774
Energy: 0.3941399425523384
Energy: 0.41525679775091073
Energy: 0.4034818439804113
Energy: 0.39012283359066896
Energy: 0.4199784412447412
Energy: 0.3899578285973144
Energy: 0.36889797158291576
Energy: 0.3732416877479819
Energy: 0.4093458774868068
Energy: 0.36962384547254684
Energy: 0.3818375535549478
Energy: 0.4142614904627438
Energy: 0.40936968474149316
Energy: 0.36577199036893066
Energy: 0.41127330610113455
Energy: 0.364437218055509
Energy: 0.39920394343562027
Energy: 0.36314425025331193
Energy: 0.3665778659490424
Energy: 0.3663703217191556
Energy: 0.35927122374515147
Energy: 0.3671049442858757
Energy: 0.38229201419208
Energy: 0.3772370166841971
Energy: 0.37832636849877643
Energy: 0.38318354506700114
Energy: 0.3733381942591585
Energy: 0.3814896698648445
Energy: 0.38147934416383994
Energy: 0.3600743845117887
Energy: 0.36055247855820044
Energy: 0.3815875943926893
Energy: 0.3595834878566661
Energy: 0.36017894782388626
Energy: 0.3923241900106744
Energy: 0.35972997208754587
Energy: 0.35950193263903407
Energy: 0.3603876462699597
Energy: 0.3817243159411093
Energy: 0.36007257085184785
Energy: 0.38344622735385425
Energy: 0.3878386627934076
Energy: 0.38163812671555036
Energy: 0.38343531738021364
Energy: 0.38507590733218405
Energy: 0.37835134084686967
Energy: 0.3933875814336628
Energy: 0.36721273249604064
Energy: 0.3677871875063628
Energy: 0.36450850083742253
Energy: 0.3924546050255813
Energy: 0.3698951395483495
Energy: 0.408671600836455
Energy: 0.36458847584124554
Energy: 0.3645375772206177
Energy: 0.4096547710541468
Energy: 0.3643469004707481
Energy: 0.4091739966059844
Energy: 0.4090927139265407
Energy: 0.36932632779789093
Energy: 0.36809188550575367
Energy: 0.40913671874335844
Energy: 0.36910432704297863
Energy: 0.3850482050034705
Energy: 0.4757188435023565
Energy: 0.41102424317575753
Energy: 0.3895430040832692
Energy: 0.4039678600166251
Energy: 0.41543478107453347
Energy: 0.39297103494391566
Energy: 0.3822151421994755
Energy: 0.48362603210097843
Energy: 0.4589757972206407
Energy: 0.3781750884709169
Energy: 0.4812236005289006
Energy: 0.3955389701564871
Energy: 0.38215376715380805
Energy: 0.47256716761587625
Energy: 0.4684148478885812
Energy: 0.3788616113779761
Energy: 0.48042321142712147
Energy: 0.4023842757657778
Energy: 0.47672487092700017
Energy: 0.46297068545965414
Energy: 0.4293536350980183
Energy: 0.4144236883185567
Energy: 0.3979980528747671
Energy: 0.3894441699525908
Energy: 0.5638999413765974
Energy: 0.4053475757432612
Energy: 0.4053888591999766
Energy: 0.4548864850872069
Energy: 0.4055131217068352
Energy: 0.45318922249775406
Energy: 0.4633670371249011
Energy: 0.45515669270447034
Energy: 0.4282052436257889
Energy: 0.4776149022870729
Energy: 0.44174336267603886
Energy: 0.38929210287327043
Energy: 0.3879145027039509
Energy: 0.4517826084499729
Energy: 0.4869575308148661
Energy: 0.37345919425821644
Energy: 0.4639128997527478
Energy: 0.4238886154561326
Energy: 0.39016055533227406
Energy: 0.4720818445366162
Energy: 0.3909518713143054
Energy: 0.3860543072761012
Energy: 0.47039752818154074
Energy: 0.45130146819300165
Energy: 0.5633516448301845
Energy: 0.4122977018456043
Energy: 0.3908056556990517
Energy: 0.47755213904012894
Energy: 0.38399037647463247
Energy: 0.46799124280741167
Energy: 0.484875820016451
Energy: 0.3733185926608857
Energy: 0.39885920714002454
Energy: 0.4775229223805237
Energy: 0.3733324814420481
Energy: 0.40287460832217853
Energy: 0.41694688359178406
Energy: 0.4057769878086281
Energy: 0.39222905712423906
Energy: 0.4161546919971923
Energy: 0.40442709873990274
Energy: 0.4045303399099603
Energy: 0.37553600606810367
Energy: 0.39441175883279844
Energy: 0.39507694625955825
Energy: 0.3710367356295204
Energy: 0.3933423268690458
Energy: 0.37931479763842546
Energy: 0.37972134840172705
Energy: 0.4133604020544555
Energy: 0.4082552573410695
Energy: 0.3802409561267158
Energy: 0.41066126125631763
Energy: 0.4082962700981818
Energy: 0.39526292516940126
Energy: 0.36557547273838764
Energy: 0.3657719412409899
Energy: 0.364903416179658
Energy: 0.4096724489578671
Energy: 0.36592694085389954
Energy: 0.3882400890323045
Energy: 0.36019607145815974
Energy: 0.36483720004658865
Energy: 0.3875216650055587
Energy: 0.35861172066831737
Energy: 0.36719681943316207
Energy: 0.385001835313158
Energy: 0.3592442498385099
Energy: 0.35863208017547304
Energy: 0.3859228171740217
Energy: 0.35882293112228675
Energy: 0.3583004785623129
Energy: 0.3891780913886763
Energy: 0.35924734496515454
Energy: 0.35962715157306613
Energy: 0.35896335251039496
Energy: 0.3584025477894364
Energy: 0.3596068940685856
Energy: 0.3869750783506964
Energy: 0.38587559067674004
Energy: 0.38115899998151037
Energy: 0.38768299203062234
Energy: 0.3826106933118597
Energy: 0.3815302544084148
Energy: 0.3786668490117251
Energy: 0.36769052588252976
Energy: 0.36370233829922527
Energy: 0.36555905709745984
Energy: 0.3676519004420793
Energy: 0.3644535071425886
Energy: 0.4137422566649354
Energy: 0.3639656414680968
Energy: 0.36380078383778186
Energy: 0.41465281551007516
Energy: 0.3640672592714075
Energy: 0.3644304195821806
Energy: 0.41406476999340486
Energy: 0.3650248968807593
Energy: 0.3892637268765871
Energy: 0.41475723690862726
Energy: 0.3649758933176147
Energy: 0.40615336536471586
Energy: 0.5320073887205443
Energy: 0.38545657755230206
Energy: 0.38778111419930583
Energy: 0.40545176228237295
Energy: 0.41022990169658946
Energy: 0.39035479201921985
Energy: 0.3858762282426333
Energy: 0.40481916641007226
Energy: 0.4040009768536058
Energy: 0.39855859618180184
Energy: 0.4773710790623504
Energy: 0.40465852928914187
Energy: 0.38183925722033524
Energy: 0.44588945647956374
Energy: 0.40372616011500995
Energy: 0.3854707132847373
Energy: 0.4497201947965636
Energy: 0.39965863058677714
Energy: 0.40927188984037527
Energy: 0.4542303430328384
Energy: 0.47055537019264587
Energy: 0.41564465847364845
Energy: 0.47885128786268955
Energy: 0.42756123279692176
Energy: 0.5349015031177536
Energy: 0.39067542785712683
Energy: 0.45004270572166366
Energy: 0.47927678553176994
Energy: 0.39160610019168846
Energy: 0.4545725799499374
Energy: 0.5621877110607403
Energy: 0.4357031042560898
Energy: 0.39055202627365526
Energy: 0.4778751359932589
Energy: 0.40889573253011996
Energy: 0.4684713361580752
Energy: 0.39131759679359374
Energy: 0.4712997808690015
Energy: 0.46826370137789464
Energy: 0.38688520260076364
Energy: 0.4698210406797972
Energy: 0.4365608045009287

minimum gb energy = 0.3583004785623129 eV
minimum distance =  2.67403319046725 Angstroms
sigma value = 57


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

Energy: 0.3578598629577582
Energy: 0.5646849156792202
Energy: 0.41012189232544893
Energy: 0.3597788803956155
Energy: 0.5667951818935201
Energy: 0.4108632307462388
Energy: 0.43528702890027526
Energy: 0.37351122569495343
Energy: 0.36962760111684434
Energy: 0.4677679695594336
Energy: 0.371556552403617
Energy: 0.3706218294599183
Energy: 0.5350473272868048
Energy: 0.3549974193223807
Energy: 0.3559101231125323
Energy: 0.46805670085108025
Energy: 0.35291825321357734
Energy: 0.38665869126538355
Energy: 0.45892457900439493
Energy: 0.35649038407588685
Energy: 0.40877117470227364
Energy: 0.39286453311562936
Energy: 0.3531304359043573
Energy: 0.41183020005410004
Energy: 0.3962450538145495
Energy: 0.37326450765780944
Energy: 0.37519974411561946
Energy: 0.3964624066200933
Energy: 0.390532874072122
Energy: 0.37136984258041067
Energy: 0.3506575157348688
Energy: 0.37024694958787807
Energy: 0.35200651400631516
Energy: 0.342038309301235
Energy: 0.4109798680867075
Energy: 0.35312463256458515
Energy: 0.37908788916974695
Energy: 0.40524396473087565
Energy: 0.40825563121951136
Energy: 0.3455613660585958
Energy: 0.40302765519491895
Energy: 0.3446385233113873
Energy: 0.48487777353827266
Energy: 0.34288229080939786
Energy: 0.34262765995128897
Energy: 0.3946147731018595
Energy: 0.335404297283122
Energy: 0.35172867466209784
Energy: 0.3702679656653864
Energy: 0.36287685642788414
Energy: 0.36091033141426815
Energy: 0.3708332558859035
Energy: 0.35512329846491064
Energy: 0.37723554694266187
Energy: 0.3770751505534218
Energy: 0.33467914307774477
Energy: 0.3345823144195234
Energy: 0.37740830477712384
Energy: 0.33534541524169137
Energy: 0.33428652507928436
Energy: 0.35721775979460635
Energy: 0.36390094212536334
Energy: 0.3407665362288727
Energy: 0.3355864133635333
Energy: 0.36248093177787
Energy: 0.33958359846969477
Energy: 0.37057229504281197
Energy: 0.35934476951232774
Energy: 0.3615840102879186
Energy: 0.3488017778549537
Energy: 0.3566433145308112
Energy: 0.3323448773051884
Energy: 0.3630155000104921
Energy: 0.3679126525633741
Energy: 0.33431883365959125
Energy: 0.3335414253507364
Energy: 0.3714401650010457
Energy: 0.3343365487188922
Energy: 0.35443788656140296
Energy: 0.33237770653839055
Energy: 0.3450259172383364
Energy: 0.3554389091695293
Energy: 0.35289364280071434
Energy: 0.3628715707850131
Energy: 0.3661224759378012
Energy: 0.33487513845406824
Energy: 0.3338568679985884
Energy: 0.35420216808015864
Energy: 0.337620953763549
Energy: 0.3336578918626481
Energy: 0.378649828667807
Energy: 0.376454977754543
Energy: 0.33504821566130893
Energy: 0.3355711695426677
Energy: 0.3751058280714666
Energy: 0.3348113247027071
Energy: 0.3549046676333384
Energy: 0.37512322700022355
Energy: 0.3772040184689356
Energy: 0.33829302814845175
Energy: 0.3727963689440505
Energy: 0.35023332511070054
Energy: 0.35554125707737416
Energy: 0.3499603483295194
Energy: 0.34977985162274255
Energy: 0.3562221167646313
Energy: 0.3510453215156898
Energy: 0.3502335690117774
Energy: 0.40097810453567123
Energy: 0.3453959677209464
Energy: 0.37358959689558224
Energy: 0.4015528383192409
Energy: 0.35128510641759386
Energy: 0.4092048508199848
Energy: 0.4558097921626226
Energy: 0.35294455692494503
Energy: 0.3532996518327301
Energy: 0.3906291701474229
Energy: 0.35044625075667885
Energy: 0.3694050108345751
Energy: 0.5062916294087965
Energy: 0.3922788472619356
Energy: 0.3919844579070183
Energy: 0.3903585073098476
Energy: 0.3918441084410904
Energy: 0.37361641154017283
Energy: 0.3537543448570325
Energy: 0.4402296857205071
Energy: 0.39007307874587577
Energy: 0.3448395293740794
Energy: 0.46945436457761
Energy: 0.37103258756245094
Energy: 0.37132720150327175
Energy: 0.4298807094777531
Energy: 0.4204334368672725
Energy: 0.3618768752622737
Energy: 0.46703709520315445
Energy: 0.4284428361481598
Energy: 0.5040198284728347
Energy: 0.3932548368785326
Energy: 0.3728408068712886
Energy: 0.3915203532583052
Energy: 0.3837702771026541
Energy: 0.3712422625889495
Energy: 0.537646250381561
Energy: 0.3673429098857139
Energy: 0.3707388677994881
Energy: 0.4433037552382116
Energy: 0.3712477182240737
Energy: 0.4274140133050919
Energy: 0.5018232769889512
Energy: 0.4178022858198757
Energy: 0.3702245385367358
Energy: 0.4650157367029673
Energy: 0.4159907336288994
Energy: 0.39165964163239986
Energy: 0.35717273945145234
Energy: 0.4225662507019811
Energy: 0.4087818773102307
Energy: 0.35441580984457166
Energy: 0.42145890944473924
Energy: 0.38296197087985817

minimum gb energy = 0.3323448773051884 eV
minimum distance =  2.69920967823609 Angstroms
sigma value = 43


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

Energy: 0.3082766888247758
Energy: 0.3991051436618145
Energy: 0.3624338497079798
Energy: 0.3042259177507397
Energy: 0.407149506583537
Energy: 0.3413497848716325
Energy: 0.4290158639892407
Energy: 0.31164687651940354
Energy: 0.30767638403019704
Energy: 0.3191631042262842
Energy: 0.3165157826279452
Energy: 0.3083313071068738
Energy: 0.45914478318594737
Energy: 0.2946745180138063
Energy: 0.3061596586138003
Energy: 0.3384324681306749
Energy: 0.29524728926752364
Energy: 0.3055740220528813
Energy: 0.40267000957054483
Energy: 0.3052915276734504
Energy: 0.3077813399722628
Energy: 0.3411043590105535
Energy: 0.34008239683905744
Energy: 0.35228524051104565
Energy: 0.356094402040422
Energy: 0.311033236134794
Energy: 0.3112617205164069
Energy: 0.34597310453303043
Energy: 0.31154805005424313
Energy: 0.3072195169686225
Energy: 0.2979083327816705
Energy: 0.3109923057602425
Energy: 0.29860943455639727
Energy: 0.29781622757518245
Energy: 0.356735578534417
Energy: 0.307070985826215
Energy: 0.4238462067091331
Energy: 0.35710524754290435
Energy: 0.33924849437801463
Energy: 0.29171108763044395
Energy: 0.35987596385843623
Energy: 0.290249417726976
Energy: 0.4200076827059556
Energy: 0.28134420733067816
Energy: 0.2863353275998692
Energy: 0.2911816174042336
Energy: 0.2821933668170414
Energy: 0.2861312787363151
Energy: 0.32942386403935664
Energy: 0.28558506279277596
Energy: 0.31184067061667714
Energy: 0.3303645708373856
Energy: 0.29432539604610125
Energy: 0.3283815933245783
Energy: 0.3292301230292903
Energy: 0.28117170843764455
Energy: 0.2811421964897438
Energy: 0.32905564150833777
Energy: 0.2807908149097838
Energy: 0.2807144534726596
Energy: 0.2949121223897018
Energy: 0.31127795916594336
Energy: 0.27957668755434933
Energy: 0.2730798239993185
Energy: 0.3113209747338621
Energy: 0.2771576803095894
Energy: 0.33093270824594884
Energy: 0.31135521889277096
Energy: 0.3114458203827866
Energy: 0.2770102037733098
Energy: 0.31534162404289057
Energy: 0.2767838719518823
Energy: 0.33001513500471713
Energy: 0.2998483952899033
Energy: 0.30391484845289696
Energy: 0.30408025019578505
Energy: 0.2997292193118957
Energy: 0.30490708112166975
Energy: 0.3008955883892801
Energy: 0.2749178619669228
Energy: 0.30100929560999834
Energy: 0.30178476598375964
Energy: 0.29768945845292977
Energy: 0.301200324771462
Energy: 0.30122291649648636
Energy: 0.27354862883084846
Energy: 0.27312860917503917
Energy: 0.30092290242733977
Energy: 0.27351030318749514
Energy: 0.2729232573150426
Energy: 0.29786755312825675
Energy: 0.2967041288721124
Energy: 0.27224103042983666
Energy: 0.2858945814559701
Energy: 0.29638683880333283
Energy: 0.2733609835717075
Energy: 0.30246217969101197
Energy: 0.29645539547095057
Energy: 0.2968011917977945
Energy: 0.28605604626129366
Energy: 0.29623031564920227
Energy: 0.27427363203725286
Energy: 0.2975319986200561
Energy: 0.27318596280435553
Energy: 0.2733626571529451
Energy: 0.2967995090105503
Energy: 0.29790084977990766
Energy: 0.2737489470234284
Energy: 0.2962353334180763
Energy: 0.2892617732270612
Energy: 0.29668265513150627
Energy: 0.2970165461408931
Energy: 0.32425466290665117
Energy: 0.2963889116880389
Energy: 0.29690033345947936
Energy: 0.30228444826109335
Energy: 0.27570533800171926
Energy: 0.30256718114809966
Energy: 0.29814054772088405
Energy: 0.276302754470103
Energy: 0.312750780402065
Energy: 0.30112345581394606
Energy: 0.3015327645280819
Energy: 0.2716524861662275
Energy: 0.3009428703319384
Energy: 0.2765469336882824
Energy: 0.2971430972558613
Energy: 0.3011827738937205
Energy: 0.27536697160724316
Energy: 0.27570960447511467
Energy: 0.3009806103008657
Energy: 0.27353884494792857
Energy: 0.3118917469073868
Energy: 0.27575953375528006
Energy: 0.2754823831526032
Energy: 0.31123753166278795
Energy: 0.2759481161200423
Energy: 0.27493985045355573
Energy: 0.31092378610203086
Energy: 0.278559584335518
Energy: 0.31102663795066393
Energy: 0.31182452811772654
Energy: 0.29248455019732394
Energy: 0.31117992058676736
Energy: 0.4090897778751664
Energy: 0.29052525148848957
Energy: 0.295837342247484
Energy: 0.3138134060106098
Energy: 0.29058201037801534
Energy: 0.31370077437635047
Energy: 0.37827352214429383
Energy: 0.32851519048075883
Energy: 0.32884893487324757
Energy: 0.2802975863026084
Energy: 0.33270413958391193
Energy: 0.27980615601777037
Energy: 0.29645354811475305
Energy: 0.3284390397557539
Energy: 0.2893715157045805
Energy: 0.27851800105310887
Energy: 0.32870678929324726
Energy: 0.28350443378380197
Energy: 0.33751964615223157
Energy: 0.29208375449572954
Energy: 0.29137076012478
Energy: 0.33768403605832886
Energy: 0.29217740825343724
Energy: 0.29045134278956025
Energy: 0.3582179643704915
Energy: 0.2952756376206297
Energy: 0.34154489684576617
Energy: 0.3590109032091861
Energy: 0.2832472728567454
Energy: 0.3343198161660268
Energy: 0.4359175298382448
Energy: 0.28804549443692207
Energy: 0.2964175764497706
Energy: 0.3103105085744649
Energy: 0.28872940405645087
Energy: 0.2965612548948897
Energy: 0.43565012354715993
Energy: 0.33993645589704147
Energy: 0.3133184359234146
Energy: 0.3158895255242762
Energy: 0.340019002294765
Energy: 0.3108595436363792
Energy: 0.3022793642948972
Energy: 0.352542530043628
Energy: 0.3262287512031429
Energy: 0.2935725376526489
Energy: 0.3796763769040306
Energy: 0.3093687185910387
Energy: 0.36766635533176056
Energy: 0.3412218997843281
Energy: 0.33763946764032143
Energy: 0.343236367925313
Energy: 0.3400874785984791
Energy: 0.31565651340535084
Energy: 0.4360653501933017
Energy: 0.3195803500856926
Energy: 0.32472198309099176
Energy: 0.3412483392263078
Energy: 0.33968350345017007
Energy: 0.3699190928408203
Energy: 0.46042867916927765
Energy: 0.30633433024362705
Energy: 0.3206767090169361
Energy: 0.3758602650186367
Energy: 0.30593915583666875
Energy: 0.34685831819136986
Energy: 0.42770083427203204
Energy: 0.34038404652270626
Energy: 0.341811041396106
Energy: 0.31320105960996525
Energy: 0.3397975216751429
Energy: 0.30915801584140745

minimum gb energy = 0.2716524861662275 eV
minimum distance =  2.7208665750739 Angstroms
sigma value = 81


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

Energy: 0.014541380394139275
Energy: 0.015779621253265676
Energy: 0.015193939085594872
Energy: 0.016155988644508307
Energy: 0.016435369781860536
Energy: 0.015119170773454248
Energy: 0.03480111064686593
Energy: 0.015119898453109182
Energy: 0.015399411087234896
Energy: 0.034816109059258624
Energy: 0.017203162916448984
Energy: 0.01539465334548637
Energy: 0.03374049255357256
Energy: 0.015090536247519971
Energy: 0.015026535652933139
Energy: 0.033712743808273576
Energy: 0.014958672608946936
Energy: 0.034219442328474625
Energy: 0.017244763424769903
Energy: 0.015321481310237544
Energy: 0.015093525716196637
Energy: 0.01819559515486406
Energy: 0.015027708321658529
Energy: 0.0343468550870281
Energy: 0.03399167956801207
Energy: 0.03369233484052294
Energy: 0.03382616617465183
Energy: 0.03447348438367031
Energy: 0.0336799457154985
Energy: 0.03468850433259185
Energy: 0.015346016191065268
Energy: 0.015393922315439247
Energy: 0.015238047480774234
Energy: 0.01636156885331984
Energy: 0.015399533988076601
Energy: 0.01503489887894052
Energy: 0.03479780022185617
Energy: 0.015316836723151633
Energy: 0.015319813842020724
Energy: 0.033609220569919315
Energy: 0.015125650553898485
Energy: 0.01543204369661254
Energy: 0.03365744521228909
Energy: 0.015006845357083255
Energy: 0.015254771230832298
Energy: 0.033770976575180904
Energy: 0.014880602474993187
Energy: 0.0348747999096598
Energy: 0.015653979316926147
Energy: 0.01499469917480153
Energy: 0.03543042938352128
Energy: 0.01656608355652338
Energy: 0.015071396235400963
Energy: 0.035030131975736734
Energy: 0.015341196093189846
Energy: 0.03363229213762362
Energy: 0.03377739764711767
Energy: 0.01541442016683208
Energy: 0.03367550408047794
Energy: 0.03396143370789412

minimum gb energy = 0.014541380394139275 eV
minimum distance =  2.85843477567597 Angstroms
sigma value = 3


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

Energy: 0.34772906502672435
Energy: 0.3424614761460009
Energy: 0.3465018021632726
Energy: 0.28712047199882007
Energy: 0.3425655738883749
Energy: 0.3209752346611938
Energy: 0.3532138144400121
Energy: 0.34224665591439735
Energy: 0.35803766501074014
Energy: 0.346027339694613
Energy: 0.3447719929313745
Energy: 0.36447926350507454
Energy: 0.3526490385148658
Energy: 0.3293067920878849
Energy: 0.3295219787384858
Energy: 0.34053491046732876
Energy: 0.29805399209748945
Energy: 0.35801633459475973
Energy: 0.3365101271692818
Energy: 0.3296697320618881
Energy: 0.32975727915164565
Energy: 0.33652795479751374
Energy: 0.29664169871486623
Energy: 0.34428869454215355
Energy: 0.3045878939648806
Energy: 0.34724535157915776
Energy: 0.34388735814787247
Energy: 0.3043908112188405
Energy: 0.344593821528114
Energy: 0.364725633593313
Energy: 0.33333807880809846
Energy: 0.34789403302259514
Energy: 0.336203024632234
Energy: 0.28360968923218643
Energy: 0.34861916859146974
Energy: 0.31909941565667016
Energy: 0.3354841192287891
Energy: 0.31431960715598534
Energy: 0.34068179631101325
Energy: 0.33548127633727304
Energy: 0.3151992722422631
Energy: 0.3431835108161213
Energy: 0.33288725270829483
Energy: 0.28833829772868264
Energy: 0.3262563688815325
Energy: 0.33282720804240395
Energy: 0.2727177064259211
Energy: 0.31424813027773535
Energy: 0.3532745205096626
Energy: 0.3273234794187164
Energy: 0.3376986126213108
Energy: 0.34170159059938443
Energy: 0.28558477539187127
Energy: 0.33884855832093785
Energy: 0.2919435023301633
Energy: 0.3107090500514464
Energy: 0.31032956244963633
Energy: 0.31867154048451535
Energy: 0.3144294938348022
Energy: 0.32003355645589204
Energy: 0.27273094219792665
Energy: 0.3304480930919942
Energy: 0.33156936373937435
Energy: 0.2757466001330284
Energy: 0.27542625208497445
Energy: 0.3156196012996374
Energy: 0.29517557732044636
Energy: 0.33591542797971613
Energy: 0.33655493474705556
Energy: 0.29389806876386493
Energy: 0.28620740507110176
Energy: 0.28959184565581286
Energy: 0.29091486268534616
Energy: 0.26672905818228926
Energy: 0.3197614029991715
Energy: 0.29098896087603127
Energy: 0.26916630475794073
Energy: 0.29240236174050327
Energy: 0.3308743665955146
Energy: 0.30086401544998864
Energy: 0.3224938365121227
Energy: 0.29236942444954256
Energy: 0.2762930668046127
Energy: 0.3220712238351852
Energy: 0.33174202674531617
Energy: 0.27571039773107253
Energy: 0.27535899063401226
Energy: 0.33133207098849626
Energy: 0.27969635598637893
Energy: 0.2753556202347115
Energy: 0.2703979676764391
Energy: 0.3143868429181843
Energy: 0.31372012134277016
Energy: 0.27136108026145783
Energy: 0.3284297431429192
Energy: 0.31384041631695253
Energy: 0.27319066320423396
Energy: 0.31420434065301145
Energy: 0.31183014676146076
Energy: 0.2716826033060698
Energy: 0.27819717036149566
Energy: 0.26749221467294915
Energy: 0.2681753509106411
Energy: 0.3113855908901423
Energy: 0.3107407529860117
Energy: 0.2682647753688476
Energy: 0.2716794812964116
Energy: 0.3094950053543468
Energy: 0.3365839605042018
Energy: 0.2921862136084468
Energy: 0.30895065562466184
Energy: 0.27136102452222716
Energy: 0.26814637111387407
Energy: 0.30928654168397984
Energy: 0.3298665433951826
Energy: 0.26849616743130966
Energy: 0.26759989768923087
Energy: 0.3298184801628286
Energy: 0.27238695472955166
Energy: 0.2677200885759648
Energy: 0.3290986427515034
Energy: 0.3138921166609541
Energy: 0.3139526619419844
Energy: 0.3283821254274527
Energy: 0.31332115564882035
Energy: 0.31285873230331485
Energy: 0.2788259365614124
Energy: 0.31114611355107974
Energy: 0.2963255529931833
Energy: 0.2787223604947201
Energy: 0.311621136726437
Energy: 0.2754095686284633
Energy: 0.27553966378250255
Energy: 0.32195924413304455
Energy: 0.32278405021859047
Energy: 0.2755411540617161
Energy: 0.2938872606200663
Energy: 0.31958001990583934
Energy: 0.2740622550522391
Energy: 0.29078433116726426
Energy: 0.2907893701311615
Energy: 0.26961183309265424
Energy: 0.2902188765932534
Energy: 0.31293447784791406
Energy: 0.3065891141256558
Energy: 0.2901528236511247
Energy: 0.28979986176978983
Energy: 0.27769366745865975
Energy: 0.29498034822376085
Energy: 0.2899865654149322
Energy: 0.27588219137988196
Energy: 0.2808785928113632
Energy: 0.32275133421841595
Energy: 0.27601682511550796
Energy: 0.2928749414326785
Energy: 0.3317839316819239
Energy: 0.3132271663033316
Energy: 0.322465514336572
Energy: 0.3254737788275812
Energy: 0.3132893743941373
Energy: 0.2825557020634694
Energy: 0.32038388854597105
Energy: 0.29662424825413725
Energy: 0.3036030988810268
Energy: 0.3050346851499666
Energy: 0.29657977451731227
Energy: 0.30413142578517843
Energy: 0.3070761291465539
Energy: 0.3370002150167182
Energy: 0.33355986584551955
Energy: 0.32895725838980167
Energy: 0.27882065329961936
Energy: 0.3336425517923905
Energy: 0.31795399174243333
Energy: 0.31607738837553745
Energy: 0.3446346604019166
Energy: 0.3430634548035613
Energy: 0.31611408035019856
Energy: 0.3380394226046292
Energy: 0.33793339597990213
Energy: 0.33767405789981175
Energy: 0.293036492044959
Energy: 0.3289889824758025
Energy: 0.33738167675177144
Energy: 0.27482476828277935
Energy: 0.32924777751530526
Energy: 0.35349692701120516
Energy: 0.33100941760241953
Energy: 0.3522455984709544
Energy: 0.36266102932474226
Energy: 0.2916794337965275
Energy: 0.36392932203560935
Energy: 0.3110240860450753
Energy: 0.3332889645985732
Energy: 0.33657188384292697
Energy: 0.3110880165007782
Energy: 0.33693872219334087
Energy: 0.3266743762717819

minimum gb energy = 0.26672905818228926 eV
minimum distance =  2.66218335910205 Angstroms
sigma value = 67


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

Energy: 0.4229465091192209
Energy: 0.42546027251606444
Energy: 0.41965255147006975
Energy: 0.3555702166955273
Energy: 0.42476225365910475
Energy: 0.41888347951295507
Energy: 0.4370727901096244
Energy: 0.4273614977818583
Energy: 0.434310131467536
Energy: 0.41957217073003966
Energy: 0.42607133993696494
Energy: 0.42006598578169724
Energy: 0.4298629499833961
Energy: 0.3689189552579899
Energy: 0.4138594774038593
Energy: 0.41964021063280516
Energy: 0.3672218104378578
Energy: 0.41278636983830924
Energy: 0.40230383951285714
Energy: 0.4008840139913218
Energy: 0.40779118507597795
Energy: 0.4029098204630908
Energy: 0.40293200467554363
Energy: 0.41707759794232296
Energy: 0.394503507113965
Energy: 0.4342066854640708
Energy: 0.43779030055318435
Energy: 0.39471179928168393
Energy: 0.4267674142907802
Energy: 0.4180908448467096
Energy: 0.4052635764828975
Energy: 0.38952841220508766
Energy: 0.40551628366908826
Energy: 0.3706353001151643
Energy: 0.3898124598179208
Energy: 0.4043860430153551
Energy: 0.40542401063941713
Energy: 0.3715586369852617
Energy: 0.41265981407714314
Energy: 0.40615907309480814
Energy: 0.3716653634562599
Energy: 0.37283562167453366
Energy: 0.4024093421060681
Energy: 0.35377815354412817
Energy: 0.40132385027752066
Energy: 0.4016898732788322
Energy: 0.3521482194220951
Energy: 0.4009194515692453
Energy: 0.4171529424625295
Energy: 0.37228619006817476
Energy: 0.3717174961769887
Energy: 0.3723764110838176
Energy: 0.3689369139107913
Energy: 0.4189690012492736
Energy: 0.388026963890923
Energy: 0.3735493553470435
Energy: 0.3748254202811003
Energy: 0.3881378545378694
Energy: 0.3710801172388638
Energy: 0.36911590488487545
Energy: 0.35143884082692217
Energy: 0.40202066527021835
Energy: 0.4026077182465438
Energy: 0.3539090272368597
Energy: 0.4117171416929056
Energy: 0.4033813043878972
Energy: 0.35627081070387323
Energy: 0.3741659922913274
Energy: 0.39995395739490325
Energy: 0.35693836890680164
Energy: 0.37128383228594425
Energy: 0.35257903035066174
Energy: 0.35861556287990426
Energy: 0.35639357048571596
Energy: 0.39588454176607735
Energy: 0.3591167655970859
Energy: 0.3538013946351695
Energy: 0.35254172927661365
Energy: 0.41656461637471115
Energy: 0.37914694504626684
Energy: 0.39622559423785386
Energy: 0.35283190225977507
Energy: 0.38521193250954044
Energy: 0.395305807456809
Energy: 0.40962430524432447
Energy: 0.35581378054288243
Energy: 0.35755460433038905
Energy: 0.41042799859410867
Energy: 0.3533399973625118
Energy: 0.35307735890473113
Energy: 0.40894964340895695
Energy: 0.4047208604236534
Energy: 0.40225408805940294
Energy: 0.3708576493463609
Energy: 0.38556353085111916
Energy: 0.399990960145517
Energy: 0.3749070917480639
Energy: 0.3504610232562587
Energy: 0.394007693735409
Energy: 0.37510843659225585
Energy: 0.3483525741123985
Energy: 0.3703761717670642
Energy: 0.3757822171738599
Energy: 0.37326638892523806
Energy: 0.42103661688178484
Energy: 0.37647058523901417
Energy: 0.37191267931087135
Energy: 0.3697171670092918
Energy: 0.40510874484945875
Energy: 0.35837819494631207
Energy: 0.4083880842551658
Energy: 0.35901245958623046
Energy: 0.35782831708460594
Energy: 0.4096768320061804
Energy: 0.3731414979556726
Energy: 0.4071342793897613
Energy: 0.4111688189136498
Energy: 0.3740475689688974
Energy: 0.40183152798386723
Energy: 0.4043817623739428
Energy: 0.40686711398568454
Energy: 0.38529229114170144
Energy: 0.42178789653207666
Energy: 0.4066753028958561
Energy: 0.39790412719836565
Energy: 0.4226250072416433
Energy: 0.42914869763196256
Energy: 0.3577789358547784
Energy: 0.4212456712561167
Energy: 0.41905418433837094
Energy: 0.3556895493399179
Energy: 0.4213148439855252
Energy: 0.41789380197369974
Energy: 0.40516352929418725
Energy: 0.41014646220045864
Energy: 0.4178774049536487
Energy: 0.40305718683856107
Energy: 0.41253293655770806

minimum gb energy = 0.3483525741123985 eV
minimum distance =  2.65485483817749 Angstroms
sigma value = 33


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

Energy: 0.7259472497401984
Energy: 0.45544701914031227
Energy: 0.49502546783387275
Energy: 0.4230098061255197
Energy: 0.4553290802929131
Energy: 0.47552670708699823
Energy: 0.503152653733271
Energy: 0.44323262676034886
Energy: 0.44726438520599
Energy: 0.44155399481953106
Energy: 0.48809018354465344
Energy: 0.4482120464296188
Energy: 0.4978493133657033
Energy: 0.4446512980109211
Energy: 0.4464309251959377
Energy: 0.44881304160956764
Energy: 0.44275838386406946
Energy: 0.47200764012023116
Energy: 0.4425448343341645
Energy: 0.4447059887676552
Energy: 0.4554655718044968
Energy: 0.443080169741106
Energy: 0.4493074276681484
Energy: 0.4715667391982159
Energy: 0.4418777561048267
Energy: 0.409392884395149
Energy: 0.4936474237879386
Energy: 0.4415409374674803
Energy: 0.44585998491526796
Energy: 0.4471071231707116
Energy: 0.40495706806863413
Energy: 0.40789011434519357
Energy: 0.4090519728246026
Energy: 0.4088360669565947
Energy: 0.4075919646554671
Energy: 0.4056160067405679
Energy: 0.44137803863517316
Energy: 0.44824472859534786
Energy: 0.4502113025463374
Energy: 0.44196923727744336
Energy: 0.4086721948233002
Energy: 0.44684382035796233
Energy: 0.44313468756372326
Energy: 0.4132355931495673
Energy: 0.40829222816244987
Energy: 0.4431150212344748
Energy: 0.4103452935722818
Energy: 0.44628550479724555
Energy: 0.437570457210354
Energy: 0.41058967443948424
Energy: 0.4431291333439367
Energy: 0.4128493521013006
Energy: 0.40851630206543615
Energy: 0.46123464928584573
Energy: 0.4371557490893815
Energy: 0.4119574974905255
Energy: 0.4083568824327497
Energy: 0.43593304331810667
Energy: 0.4092015776193895
Energy: 0.407716395115854
Energy: 0.4350669601683656
Energy: 0.40943770911015975
Energy: 0.4089150759538761
Energy: 0.4094750743658341
Energy: 0.43694292213501223
Energy: 0.407819565879006
Energy: 0.4144399406992807
Energy: 0.4078618376508064
Energy: 0.4081136705411524
Energy: 0.4078651836559324
Energy: 0.41950531360431087
Energy: 0.4083073941875896
Energy: 0.4127442741516999
Energy: 0.44853314545247314
Energy: 0.4279320948782756
Energy: 0.41363282942704405
Energy: 0.4123809048195604
Energy: 0.40781143140733966
Energy: 0.39666683547305726
Energy: 0.4120047999697953
Energy: 0.4488630974007061
Energy: 0.39875029211167035
Energy: 0.4370373506552835
Energy: 0.39642117232856683
Energy: 0.3983012843220458
Energy: 0.44854624087011247
Energy: 0.44972371806853956
Energy: 0.3977467165094156
Energy: 0.44394447230925244
Energy: 0.4307024909567192
Energy: 0.4135266838786883
Energy: 0.41635002756450074
Energy: 0.45119742541673596
Energy: 0.41304659651248443
Energy: 0.41607955649481304
Energy: 0.4497656767509311
Energy: 0.49505179447777287
Energy: 0.4215351697982415
Energy: 0.415798113404156
Energy: 0.44940091003601895
Energy: 0.41850051634992713
Energy: 0.46324818612264396
Energy: 0.5193432978134627
Energy: 0.4461875796350316
Energy: 0.44931504473015704
Energy: 0.48900832092698054
Energy: 0.44437881651076966
Energy: 0.47903888104255526
Energy: 0.46458666621940775
Energy: 0.44628428202381953
Energy: 0.4173506886189783
Energy: 0.4182187638144097
Energy: 0.44651920265136885
Energy: 0.4492047507632812
Energy: 0.46183387449169916
Energy: 0.44545678619893775
Energy: 0.41278361103468647
Energy: 0.46280895622286805
Energy: 0.4461961483218516
Energy: 0.4475562181340451
Energy: 0.49603435713744704
Energy: 0.4080282540739905
Energy: 0.42609521331667655
Energy: 0.44683899187179155
Energy: 0.45013706445040974
Energy: 0.4431049420949504
Energy: 0.4423438337710619
Energy: 0.44389549777879117
Energy: 0.4463732773289274
Energy: 0.44256702439428786
Energy: 0.4429695643260454
Energy: 0.471923430589888
Energy: 0.4418920653757553
Energy: 0.4124230300309812
Energy: 0.44730668203258783
Energy: 0.44204469291591175
Energy: 0.4457772155338542
Energy: 0.4483454857844539
Energy: 0.40629044755832516
Energy: 0.4081838412628833
Energy: 0.40828777711940156
Energy: 0.41085735699833764
Energy: 0.4077841790352614
Energy: 0.44585257117179455
Energy: 0.44125611914357254
Energy: 0.4479749647411116
Energy: 0.44957362241093596
Energy: 0.4417428465969939
Energy: 0.44669651023342805
Energy: 0.44662952027669245
Energy: 0.4460596442660544
Energy: 0.41261364748603996
Energy: 0.4083678468055636
Energy: 0.4458764383782457
Energy: 0.4097475347614457
Energy: 0.44653773186544554
Energy: 0.437278543034181
Energy: 0.40809043124640476
Energy: 0.4085249692390383
Energy: 0.4131358456955534
Energy: 0.4187541581360102
Energy: 0.46186519336671245
Energy: 0.4374220326163433
Energy: 0.41227278634935477
Energy: 0.40840160801162456
Energy: 0.4129524521120769
Energy: 0.40933728826193655
Energy: 0.40777074072957986
Energy: 0.4428199852241653
Energy: 0.43714897830286187
Energy: 0.41062717082320493
Energy: 0.41055498086167375
Energy: 0.4088629402217357
Energy: 0.4077964981670702
Energy: 0.40746746421266694
Energy: 0.4078276829237296
Energy: 0.4079479910510889
Energy: 0.40753103681405123
Energy: 0.41642764965926965
Energy: 0.4080484893532565
Energy: 0.41074653607630573
Energy: 0.44847310904963855
Energy: 0.4080416567044567
Energy: 0.41150230546858113
Energy: 0.41261295647175666
Energy: 0.4079293015240402
Energy: 0.39775758814144097
Energy: 0.4485286102734605
Energy: 0.4487125553847966
Energy: 0.39816199873405195
Energy: 0.4371815994751117
Energy: 0.39638288478956935
Energy: 0.3981897005773691
Energy: 0.4490242778007813
Energy: 0.4497296356218484
Energy: 0.39881477954026007
Energy: 0.4446087989432367
Energy: 0.4283940524349042
Energy: 0.41334749061991705
Energy: 0.45348453398193644
Energy: 0.44666916686298214
Energy: 0.41275490960331646
Energy: 0.41580570511891896
Energy: 0.4507932582418192
Energy: 0.5198502838508369
Energy: 0.41649651584991926
Energy: 0.415841335758897
Energy: 0.44667351953162066
Energy: 0.39837811086308983
Energy: 0.4521912807861398
Energy: 0.517059447118465
Energy: 0.44238690445712897
Energy: 0.41265376661650427
Energy: 0.44446604101392445
Energy: 0.4457192223084896
Energy: 0.477777556267875
Energy: 0.44441935352941575
Energy: 0.44773740714074517
Energy: 0.4183891782916155
Energy: 0.4168313925769049
Energy: 0.44799997130826763
Energy: 0.4133396946540102

minimum gb energy = 0.39638288478956935 eV
minimum distance =  2.65693173666985 Angstroms
sigma value = 41


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

Energy: 0.6815587867215649
Energy: 0.5408078397321656
Energy: 0.5377364957581003
Energy: 0.4744375006115902
Energy: 0.5406057228342049
Energy: 0.47641697316627546
Energy: 0.5646889786419704
Energy: 0.5030686253970988
Energy: 0.4841650472405534
Energy: 0.5005074706903814
Energy: 0.5019635236457429
Energy: 0.48362759390939714
Energy: 0.5760175041977773
Energy: 0.473590500466286
Energy: 0.47208482595049095
Energy: 0.5002672421281843
Energy: 0.4960522006186473
Energy: 0.47172853607666093
Energy: 0.5036802356989027
Energy: 0.4736887880208653
Energy: 0.4722323110184555
Energy: 0.5038524209892232
Energy: 0.4752456417093062
Energy: 0.4925101480267841
Energy: 0.4921666299190532
Energy: 0.48510331815194646
Energy: 0.47410468480077916
Energy: 0.4919775221728682
Energy: 0.5033261325434577
Energy: 0.47371058532808896
Energy: 0.5107750402351771
Energy: 0.5098311361003526
Energy: 0.4737169871542914
Energy: 0.4746413844077888
Energy: 0.5217720386970107
Energy: 0.4736077056084565
Energy: 0.49143516283407473
Energy: 0.4844079073616331
Energy: 0.4747211231512671
Energy: 0.4916553231828427
Energy: 0.5053109446752884
Energy: 0.4750738968678863
Energy: 0.4933548382560803
Energy: 0.4743495151332102
Energy: 0.4738514362350216
Energy: 0.4941779409112832
Energy: 0.4753751059386133
Energy: 0.47627367203776644
Energy: 0.5381802865997329
Energy: 0.47433579022320754
Energy: 0.4737237888267994
Energy: 0.4648378019470083
Energy: 0.48465158743414083
Energy: 0.4734701476663977
Energy: 0.5096477033057254
Energy: 0.4954788763435815
Energy: 0.47483768444150815
Energy: 0.47637518577221133
Energy: 0.49192428853657216
Energy: 0.47295191521086893
Energy: 0.5044171537920789
Energy: 0.48242085078272795
Energy: 0.475284659265613
Energy: 0.4757860274156912
Energy: 0.4643319090560736
Energy: 0.4754226916465542
Energy: 0.5650191785681962
Energy: 0.46398392280145306
Energy: 0.46385564549913044
Energy: 0.5653243035551458
Energy: 0.4690570957380623
Energy: 0.5000331572881334
Energy: 0.578669669392494
Energy: 0.49639860254820906
Energy: 0.48199909965139087
Energy: 0.5006868669568428
Energy: 0.4918660267971725
Energy: 0.48284910020885463
Energy: 0.4663613420976256
Energy: 0.5003126484729781
Energy: 0.4696456006614623
Energy: 0.4663063285925144
Energy: 0.4999659253748943
Energy: 0.46436052729277627

minimum gb energy = 0.46385564549913044 eV
minimum distance =  2.6661087507632 Angstroms
sigma value = 11


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

Energy: 0.5403829839227465
Energy: 0.6208710615016566
Energy: 0.6026717068533034
Energy: 0.5708846045768695
Energy: 0.5762758473262491
Energy: 0.5625515953661877
Energy: 0.6514087196158753
Energy: 0.5475313796195392
Energy: 0.5530431359369251
Energy: 0.5699647442343089
Energy: 0.5476009816902528
Energy: 0.5689004992328958
Energy: 0.6147683803916778
Energy: 0.5388800939312647
Energy: 0.5502666706132388
Energy: 0.561940055735743
Energy: 0.5388613196245553
Energy: 0.5574093442041659
Energy: 0.5710397499632541
Energy: 0.5388322559876864
Energy: 0.5394264062554482
Energy: 0.551993845522204
Energy: 0.5407343540912619
Energy: 0.5653858612253374
Energy: 0.5608824819289273
Energy: 0.5476444061334024
Energy: 0.5567784377188352
Energy: 0.5650578243952008
Energy: 0.5469740032751059
Energy: 0.5673099066974858
Energy: 0.5653188629164098
Energy: 0.5552551220355435
Energy: 0.5584391669879958
Energy: 0.5486783100534238
Energy: 0.562759133594164
Energy: 0.5598348472200899
Energy: 0.5607847500907168
Energy: 0.5572686984652327
Energy: 0.5574993755748917
Energy: 0.5594692869103597
Energy: 0.5536673520121907
Energy: 0.5616985448705226
Energy: 0.5594753754304795
Energy: 0.5556709486578014
Energy: 0.5679805299461156
Energy: 0.5471119762558098
Energy: 0.5653500097303598
Energy: 0.5673459798799623
Energy: 0.5483526057382416
Energy: 0.5655180011942114
Energy: 0.5656187948762497
Energy: 0.5385283095846038
Energy: 0.5612126792441507
Energy: 0.5413389789900288
Energy: 0.5472306093803143
Energy: 0.5652442234818017
Energy: 0.5659315860666213
Energy: 0.5510243978747617
Energy: 0.5615355554881089
Energy: 0.5414178120300775
Energy: 0.5597060941352529
Energy: 0.5520514078205828
Energy: 0.5681755459811723
Energy: 0.5471261961760838
Energy: 0.5577633842423194
Energy: 0.5575235352737106
Energy: 0.5499716163941931
Energy: 0.5624704454721697
Energy: 0.5630379758418737
Energy: 0.5504262907021882
Energy: 0.5493499063953887
Energy: 0.56264663766705
Energy: 0.5468335431578615
Energy: 0.5649086915911026
Energy: 0.5640309627851162
Energy: 0.5467446687005896
Energy: 0.5603557194940381
Energy: 0.5606067828924913
Energy: 0.5566523710502703
Energy: 0.5626453707539193
Energy: 0.5652696282010874
Energy: 0.5398288841445357
Energy: 0.5817879685175604
Energy: 0.5576988660670747
Energy: 0.5391695486084823
Energy: 0.5644945793278293
Energy: 0.5637840977069825
Energy: 0.5395506680856755
Energy: 0.5612998584962334
Energy: 0.562797199173981
Energy: 0.5394733337760517
Energy: 0.5647760232240326
Energy: 0.5639422320862503
Energy: 0.5404387545264249
Energy: 0.5635100728005306
Energy: 0.5394861680106751
Energy: 0.5388994279625678
Energy: 0.5574438462244551
Energy: 0.5647756310560338
Energy: 0.5390903056045955
Energy: 0.5580135282583806
Energy: 0.5580244415124068
Energy: 0.5858785549960511
Energy: 0.5863142015004542
Energy: 0.5810774339297313
Energy: 0.5661086094912573
Energy: 0.5854341206135655
Energy: 0.5628541141831161
Energy: 0.5505703720784275
Energy: 0.5571808412681142
Energy: 0.5647934596235141
Energy: 0.5507360278261914
Energy: 0.5545976266743112
Energy: 0.563998540965431
Energy: 0.5720616678439169
Energy: 0.5400302653837596
Energy: 0.540169841260241
Energy: 0.5598318295138324
Energy: 0.5401174345863705
Energy: 0.5656824585168866
Energy: 0.6013458040064856
Energy: 0.5396882797492732
Energy: 0.5593828478090516
Energy: 0.5590884517769451
Energy: 0.5487012308986463
Energy: 0.5656597676189935
Energy: 0.5537720381922671
Energy: 0.5619345646287702
Energy: 0.5645844204710668
Energy: 0.5701275934993328
Energy: 0.5584353702109137
Energy: 0.5639677341043284
Energy: 0.5442137867348009
Energy: 0.5572904506922592
Energy: 0.5562291937428646
Energy: 0.538354255923528
Energy: 0.5572720291822608
Energy: 0.5635265822627458
Energy: 0.6025252209666434
Energy: 0.5632505693117105
Energy: 0.5565624585563271
Energy: 0.5534432652798141
Energy: 0.5580754648308066
Energy: 0.564706234791154
Energy: 0.6040505350638496
Energy: 0.5617428116961328
Energy: 0.5573917893698961
Energy: 0.5853200052966123
Energy: 0.5608321703914599
Energy: 0.5595569631686949
Energy: 0.5913841791104282
Energy: 0.5548310846350186
Energy: 0.5396574838960313
Energy: 0.5544998162670025
Energy: 0.5399291142250563
Energy: 0.5637733433177894
Energy: 0.6042924852805365
Energy: 0.539162319548721
Energy: 0.5392153648134741
Energy: 0.5605333356389343
Energy: 0.5410517602716834
Energy: 0.563317175724866
Energy: 0.5905510069558306
Energy: 0.53991005766222
Energy: 0.5618346051141045
Energy: 0.5606563279075291
Energy: 0.5501369042014133
Energy: 0.5634278597660217
Energy: 0.5900049981308813
Energy: 0.5546549202571446
Energy: 0.553178901642658
Energy: 0.5732787107687658
Energy: 0.5655823089615117
Energy: 0.5581292072643848
Energy: 0.6518284807106649
Energy: 0.5469529082667917
Energy: 0.5599945858797156
Energy: 0.557460915068265
Energy: 0.5467641736015693
Energy: 0.5633833240271007
Energy: 0.5412855640530121
Energy: 0.5524763145044486
Energy: 0.5629490098381501
Energy: 0.54018385756803
Energy: 0.5512475861708881
Energy: 0.5667473285028709

minimum gb energy = 0.538354255923528 eV
minimum distance =  2.65627176863189 Angstroms
sigma value = 57


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

Energy: 0.7813596090408955
Energy: 0.557081641640299
Energy: 0.5250321016339946
Energy: 0.5657807319152519
Energy: 0.5384343163620938
Energy: 0.5252876133270129
Energy: 0.6028684805912133
Energy: 0.539777037003856
Energy: 0.5374829290479427
Energy: 0.539069471918404
Energy: 0.5388127254730513
Energy: 0.5370109731759625
Energy: 0.5573685705615772
Energy: 0.5354935524030655
Energy: 0.5359980154681754
Energy: 0.5997781287818419
Energy: 0.5495070757985607
Energy: 0.5385252977494215
Energy: 0.5498141232100079
Energy: 0.539001691280074
Energy: 0.5371020072535564
Energy: 0.5496243264581546
Energy: 0.548216938824088
Energy: 0.5372279172319816
Energy: 0.5491362003893914
Energy: 0.5392745971203348
Energy: 0.5380489967168754
Energy: 0.5388454410740977
Energy: 0.5403756492916879
Energy: 0.5368785222723741
Energy: 0.550231715760151
Energy: 0.5582850711264461
Energy: 0.5376771846645563
Energy: 0.5395605104438144
Energy: 0.538773907761097
Energy: 0.5376734492715071
Energy: 0.552507732394574
Energy: 0.5675229004721544
Energy: 0.5252294659890447
Energy: 0.5375913759386868
Energy: 0.5688936946857965
Energy: 0.5572760056755877
Energy: 0.603822886576712
Energy: 0.5395745586223784
Energy: 0.5374580033470104
Energy: 0.541012639497889
Energy: 0.5382639931558867
Energy: 0.5369144694400715
Energy: 0.5245593278407958
Energy: 0.5400289105372602
Energy: 0.5259642259711709
Energy: 0.5278435072873354
Energy: 0.5497793346669979
Energy: 0.5255311694800582
Energy: 0.5528732568892976
Energy: 0.5394887308872831
Energy: 0.5259052168305037
Energy: 0.5274137244694083
Energy: 0.5489603459815935
Energy: 0.5255483594180522
Energy: 0.603553025523117
Energy: 0.5491902990824481
Energy: 0.5382036912679512
Energy: 0.5387841843496088
Energy: 0.5377530628542192
Energy: 0.5372728536466927
Energy: 0.5506493232467186
Energy: 0.5351853022603044
Energy: 0.549186389286364
Energy: 0.5501112824939959
Energy: 0.5398029645706378
Energy: 0.5384846607731992
Energy: 0.5531922416531501
Energy: 0.5381030817992186
Energy: 0.5381989552416485
Energy: 0.540128496710988
Energy: 0.5392580602923801
Energy: 0.5368028306493674
Energy: 0.5500127221337158
Energy: 0.6005914506472548
Energy: 0.5496567011007147
Energy: 0.538915880225092
Energy: 0.5528531010902907
Energy: 0.5382243521121293
Energy: 0.5609039317360599
Energy: 0.5252180329870779
Energy: 0.5371444879572231
Energy: 0.558973354609026
Energy: 0.5665586835175633
Energy: 0.5369516301572614
Energy: 0.5981765435808414
Energy: 0.5251595884998145
Energy: 0.52477023480363
Energy: 0.5498126477226205
Energy: 0.567172417811795
Energy: 0.53783643456227
Energy: 0.525348280542001
Energy: 0.5396919084441584
Energy: 0.5378622480456868
Energy: 0.524649481438513
Energy: 0.5424735105231956
Energy: 0.5375135385304762

minimum gb energy = 0.5245593278407958 eV
minimum distance =  2.66980755864859 Angstroms
sigma value = 9


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

Energy: 0.9701747695013977
Energy: 0.6136936679020335
Energy: 0.6473180107914229
Energy: 0.6062920635831519
Energy: 0.602908246466235
Energy: 0.6466977284379645
Energy: 0.641013397702936
Energy: 0.5982274872594499
Energy: 0.5853675850862481
Energy: 0.5829517756505702
Energy: 0.598053059899756
Energy: 0.5876882002537974
Energy: 0.6068824795144782
Energy: 0.5901808584110134
Energy: 0.5926060846691805
Energy: 0.6073393569121466
Energy: 0.5830148536029989
Energy: 0.590689576399531
Energy: 0.5917797605720886
Energy: 0.5935434581140908
Energy: 0.5884205548881021
Energy: 0.5930248740572353
Energy: 0.5834247062000634
Energy: 0.5927905392071451
Energy: 0.5830771970485509
Energy: 0.5725149249874661
Energy: 0.5734629319237227
Energy: 0.5697265492828406
Energy: 0.5800840358549277
Energy: 0.5700950640985527
Energy: 0.5843163234107464
Energy: 0.5835382769449841
Energy: 0.5817877332534529
Energy: 0.5899655847498289
Energy: 0.5853448388460647
Energy: 0.5815667105028743
Energy: 0.5890966162966093
Energy: 0.5817066633406264
Energy: 0.5972968758414389
Energy: 0.5895484418563752
Energy: 0.5843317719604085
Energy: 0.6116971482364563
Energy: 0.5994616450303178
Energy: 0.5838816392130289
Energy: 0.5843933873786761
Energy: 0.5924885002784093
Energy: 0.5820233077417288
Energy: 0.5848881021372333
Energy: 0.6115677293109472
Energy: 0.5732837324921437
Energy: 0.5750404875557684
Energy: 0.6026168274753142
Energy: 0.5810256507087959
Energy: 0.5905751699749311
Energy: 0.5989844256571701
Energy: 0.5731428008368388
Energy: 0.5753453582907769
Energy: 0.6023811471915667
Energy: 0.5806757427583458
Energy: 0.5697942025851193
Energy: 0.6001523506854095
Energy: 0.5798783322416182
Energy: 0.5877425489907809
Energy: 0.582755779859566
Energy: 0.5818089318320637
Energy: 0.5774730153857855
Energy: 0.6053553985000347
Energy: 0.5885792436314697
Energy: 0.5890767218898364
Energy: 0.5959998627439248
Energy: 0.5839644468068791
Energy: 0.5870755921288116
Energy: 0.6158642787147146
Energy: 0.5840651849132048
Energy: 0.5854784901218837
Energy: 0.5853543500757284
Energy: 0.5832603397376962
Energy: 0.5805539870484175
Energy: 0.5955189416048355
Energy: 0.588826094980921
Energy: 0.5912904767449445
Energy: 0.5936307421040945
Energy: 0.5861992338902132
Energy: 0.5925440315373166
Energy: 0.599728751163348
Energy: 0.5791746911943841
Energy: 0.589480858560186
Energy: 0.5907915704644806
Energy: 0.579162185318275
Energy: 0.5721855947612519
Energy: 0.59009959638539
Energy: 0.5937033590414083
Energy: 0.581000515299709
Energy: 0.59063994280626
Energy: 0.5993284632272489
Energy: 0.580390196450584
Energy: 0.6025837993143568
Energy: 0.589809102046885
Energy: 0.5928832279363964
Energy: 0.6029904902990714
Energy: 0.5924903422924749
Energy: 0.5918239458132021
Energy: 0.6726634288428959
Energy: 0.5846768915776188
Energy: 0.5731789175906025
Energy: 0.5747040925208519
Energy: 0.5933958226168886
Energy: 0.5877506018759533
Energy: 0.5974554524938119
Energy: 0.5944855092037592
Energy: 0.589844958130523
Energy: 0.5965480892242485
Energy: 0.5830156947778077
Energy: 0.587308389746744
Energy: 0.5909002782447229
Energy: 0.5945456457335976
Energy: 0.5909620806263722
Energy: 0.5699453947140967
Energy: 0.5953614199291012
Energy: 0.5871657146648372
Energy: 0.5932064844326357
Energy: 0.5980650246593415
Energy: 0.5851426679062417
Energy: 0.5814320779131457
Energy: 0.5968884723023427
Energy: 0.5893513562548073

minimum gb energy = 0.5697265492828406 eV
minimum distance =  2.62916099389464 Angstroms
sigma value = 27


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

Energy: 0.6805223702338318
Energy: 0.9013608995885035
Energy: 0.5637666305794133
Energy: 0.563102904622739
Energy: 0.588712386702985
Energy: 0.5662245743993631
Energy: 0.5978969352494848
Energy: 0.5760898958244958
Energy: 0.5749692378910044
Energy: 0.5777862701668346
Energy: 0.5777127866370905
Energy: 0.5758385839143434
Energy: 0.5976134666829319
Energy: 0.5771722747063485
Energy: 0.5814535539222024
Energy: 0.587867388648187
Energy: 0.5799029998153874
Energy: 0.574251616625328
Energy: 0.5894093908639322
Energy: 0.5771651788892589
Energy: 0.5756964946405303
Energy: 0.5901667417982979
Energy: 0.5765439223018108
Energy: 0.5765924258150664
Energy: 0.5885621263572943
Energy: 0.574139031433052
Energy: 0.5705319920398854
Energy: 0.5665031936206237
Energy: 0.5873351616902455
Energy: 0.5725683384995428
Energy: 0.5995983663666209
Energy: 0.576948460271752
Energy: 0.5768292494344254
Energy: 0.5842960180318633
Energy: 0.5776680418031587
Energy: 0.5777534768383743
Energy: 0.5832229502743675
Energy: 0.5467095238862537
Energy: 0.5431316652859941
Energy: 0.5687225673150513
Energy: 0.5472698954053574
Energy: 0.5423996773217793
Energy: 0.582952815677126
Energy: 0.5596597275777356
Energy: 0.5836734640262506
Energy: 0.5795685859373307
Energy: 0.5613586220045118
Energy: 0.5832334618341104
Energy: 0.6761343910761587
Energy: 0.5756032142704413
Energy: 0.5739910060489946
Energy: 0.5743302535543884
Energy: 0.5756596832309218
Energy: 0.5740358182379857
Energy: 0.5824771332860625
Energy: 0.5713685048805852
Energy: 0.5716255611500967
Energy: 0.571670067750462
Energy: 0.5717476539052607
Energy: 0.5693804679217352
Energy: 0.5823052370856379
Energy: 0.5713642479802096
Energy: 0.5706672890935713
Energy: 0.5828219378843736
Energy: 0.5589945004824262
Energy: 0.5698769209746734
Energy: 0.5874456461934741
Energy: 0.582743554431373
Energy: 0.5801604319992103
Energy: 0.5808239709273618
Energy: 0.5730136303036136
Energy: 0.5790982938405472
Energy: 0.5676368270686905
Energy: 0.5837105832915453
Energy: 0.5448951778794291
Energy: 0.5667658439545381
Energy: 0.5897534925794361
Energy: 0.5447386480157665
Energy: 0.5655036630244006
Energy: 0.5956489648273302
Energy: 0.5824779478669941
Energy: 0.5423506624116473
Energy: 0.5900084380951746
Energy: 0.5411607402385248
Energy: 0.5919161535065377
Energy: 0.580325665198808
Energy: 0.5785053194035836
Energy: 0.5868061908325222
Energy: 0.571327862534248
Energy: 0.5807243237984965
Energy: 0.6138180421879095
Energy: 0.5733390848678084
Energy: 0.5703680823643996
Energy: 0.5696248917385267
Energy: 0.5719228379809207
Energy: 0.5703986746532648
Energy: 0.5885949134944832
Energy: 0.5813382209055705
Energy: 0.5815693553262784
Energy: 0.5962425176179569
Energy: 0.5813401129015905
Energy: 0.5830735094177023
Energy: 0.607679105845442
Energy: 0.5745117598448409
Energy: 0.572107279127013
Energy: 0.5718678212206649
Energy: 0.576073736716498
Energy: 0.5728590417437865
Energy: 0.5821631801493581
Energy: 0.5409798547268375
Energy: 0.540975728261816
Energy: 0.5825994039710841
Energy: 0.541040280514185
Energy: 0.540862025936603
Energy: 0.5852262266503477
Energy: 0.5409510723581151
Energy: 0.541057016258776
Energy: 0.5710891230816636
Energy: 0.541040938695115
Energy: 0.5409551641291037
Energy: 0.5889274874261794
Energy: 0.5756171686635719
Energy: 0.5749462182738404
Energy: 0.5805139895050967
Energy: 0.5758596375442193
Energy: 0.5736374098856794
Energy: 0.5850008497859344
Energy: 0.5739920506998867
Energy: 0.5745866268562962
Energy: 0.5735435166395184
Energy: 0.5753324148577426
Energy: 0.5762927280447919
Energy: 0.5890034568867042
Energy: 0.5783676008656526
Energy: 0.5781066398271925
Energy: 0.5819885144269125
Energy: 0.5778760109907068
Energy: 0.5771303949999553
Energy: 0.5869221584810277
Energy: 0.5759375190804878
Energy: 0.5740242956311926
Energy: 0.574483036690716
Energy: 0.5778315640106668
Energy: 0.5734342130846165
Energy: 0.6101880678990333
Energy: 0.6002710978518974
Energy: 0.592136562322247
Energy: 0.5661251654924419
Energy: 0.5993362954320043
Energy: 0.56655500484871

minimum gb energy = 0.540862025936603 eV
minimum distance =  2.64288295411417 Angstroms
sigma value = 19


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

Energy: 0.5984921330009392
Energy: 0.5492836869829598
Energy: 0.5521378917634694
Energy: 0.5672396683044634
Energy: 0.5518539548234288
Energy: 0.5519803466580341
Energy: 0.600565715340131
Energy: 0.5639434931790084
Energy: 0.5600140477349587
Energy: 0.5801100156517177
Energy: 0.566484606144594
Energy: 0.5602703278695118
Energy: 0.5778426191945676
Energy: 0.5594699350365248
Energy: 0.5612168829591954
Energy: 0.5700915786854749
Energy: 0.5595130931747887
Energy: 0.560410104073051
Energy: 0.5765358977001726
Energy: 0.5664313063341732
Energy: 0.5666512864441107
Energy: 0.5626613454014733
Energy: 0.5668614560885882
Energy: 0.566878976305738
Energy: 0.5820041368826108
Energy: 0.5629402680577484
Energy: 0.5615931843697263
Energy: 0.5644398097356299
Energy: 0.5757214997298232
Energy: 0.5609997794775945
Energy: 0.5844570364513345
Energy: 0.5794933702657247
Energy: 0.5799109034185262
Energy: 0.5769953843582296
Energy: 0.5674200471736923
Energy: 0.5796173410701304
Energy: 0.57860128029942
Energy: 0.5629085209750635
Energy: 0.5616963892160193
Energy: 0.5748907041136325
Energy: 0.5656623034885749
Energy: 0.5601726174667482
Energy: 0.5764311328853443
Energy: 0.565107398241974
Energy: 0.558863330991607
Energy: 0.5624320121955747
Energy: 0.5662286775461859
Energy: 0.5640936002850726
Energy: 0.5758395252802879
Energy: 0.5593984249484486
Energy: 0.5637453280614733
Energy: 0.5708499748469716
Energy: 0.5616512906484594
Energy: 0.5641953301961066
Energy: 0.5814175958737833
Energy: 0.5659654841489582
Energy: 0.5653763312627593
Energy: 0.572271954771704
Energy: 0.5672163684696345
Energy: 0.5656873917241579
Energy: 0.5779127677945607
Energy: 0.5538929816592131
Energy: 0.553123423708085
Energy: 0.5752583728460355
Energy: 0.5557517711003085
Energy: 0.5538455457414742
Energy: 0.5727697643919507
Energy: 0.5647627984262067
Energy: 0.552298580254753
Energy: 0.5527436846817912
Energy: 0.5587327276682995
Energy: 0.5526970051503244
Energy: 0.5904884998922304
Energy: 0.5588957891491287
Energy: 0.5613916939918606
Energy: 0.5595886893284682
Energy: 0.5596812983596059
Energy: 0.5626054654610134
Energy: 0.6017709159781833
Energy: 0.5710964717019075
Energy: 0.5702363261421001
Energy: 0.5514492254286314
Energy: 0.5719997985014189
Energy: 0.5647286214253545
Energy: 0.5726165044415293
Energy: 0.5530429731452637
Energy: 0.5574526099879988
Energy: 0.5579281333863642
Energy: 0.552728647822617
Energy: 0.5570506527343542
Energy: 0.5824142509028538
Energy: 0.5522555136502402
Energy: 0.5524340477935262
Energy: 0.5585703248842978
Energy: 0.5571540495418378
Energy: 0.5525338988422539
Energy: 0.5756741413183616
Energy: 0.5631439479077636
Energy: 0.5655151364702797
Energy: 0.5525411298991771
Energy: 0.5661418256435174
Energy: 0.5665024276395764
Energy: 0.5885374357379853
Energy: 0.5518765454826239
Energy: 0.5520298732544914
Energy: 0.5542839781227608
Energy: 0.549971275709914
Energy: 0.5520129112220293
Energy: 0.5836775632061176
Energy: 0.5668998134026512
Energy: 0.5669226584948835
Energy: 0.5719363068339833
Energy: 0.5586601525627897
Energy: 0.5569404289524627
Energy: 0.5690874190048811
Energy: 0.5540632058997759
Energy: 0.5538957815282343
Energy: 0.5540589526528712
Energy: 0.5542675710959605
Energy: 0.5586522860010948
Energy: 0.5618855428070059
Energy: 0.5519772556659479
Energy: 0.5529538712043243
Energy: 0.56010697244977
Energy: 0.5494939404954929
Energy: 0.5545317867792431
Energy: 0.5594351267710319
Energy: 0.5521693014809687
Energy: 0.5520404482536645
Energy: 0.5614037533687238
Energy: 0.5508111461395214
Energy: 0.5523928230026859
Energy: 0.5749758281362303
Energy: 0.5730509833784322
Energy: 0.5746237613240832
Energy: 0.5718994122331514
Energy: 0.5711286261237916
Energy: 0.5585141159227092
Energy: 0.5885017468611906
Energy: 0.5521493846220972
Energy: 0.5560612917619303
Energy: 0.5788943020487531
Energy: 0.5492796055484871
Energy: 0.5582631025353992
Energy: 0.5862396359190517
Energy: 0.5504396259831648
Energy: 0.5539715450053141
Energy: 0.5618958750951365
Energy: 0.5466005944518252
Energy: 0.5544029459772565
Energy: 0.581510759039073
Energy: 0.5596677144550949
Energy: 0.5597874256326382
Energy: 0.5596685572754813
Energy: 0.5626734914664218
Energy: 0.5591274442669919
Energy: 0.5775924779489149
Energy: 0.5597377547495413
Energy: 0.5636454369889391
Energy: 0.5684357062722181
Energy: 0.5593818550608448
Energy: 0.5633030080495542
Energy: 0.5779311529513033
Energy: 0.559920215761995
Energy: 0.5596567499002852
Energy: 0.5594855551196639
Energy: 0.5605306761877328
Energy: 0.5595340961050347
Energy: 0.5866630520181912
Energy: 0.5812342595810359
Energy: 0.5898794370889264
Energy: 0.5517121919456562
Energy: 0.5850714899067012
Energy: 0.5609800355270808

minimum gb energy = 0.5466005944518252 eV
minimum distance =  2.63591222275069 Angstroms
sigma value = 101


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

Energy: 0.844997940541765
Energy: 0.5460829576944235
Energy: 0.548568141361172
Energy: 0.5351217737496087
Energy: 0.546230999399763
Energy: 0.5305240463228994
Energy: 0.5681940882412395
Energy: 0.5449158292674626
Energy: 0.5446786417661981
Energy: 0.5518225951801324
Energy: 0.5444798116569095
Energy: 0.5441155567809514
Energy: 0.5706730701503179
Energy: 0.5390852483067707
Energy: 0.5420283147720902
Energy: 0.5419639998080422
Energy: 0.5404438987154438
Energy: 0.5426063810972191
Energy: 0.5624746677432025
Energy: 0.5437392289531182
Energy: 0.5437760284736624
Energy: 0.5476573723089806
Energy: 0.5432426797877336
Energy: 0.5437266599753247
Energy: 0.5533105156232702
Energy: 0.5417969501675649
Energy: 0.5438127502951912
Energy: 0.5483040742335565
Energy: 0.5603480998908138
Energy: 0.5469408199045702
Energy: 0.5511519421315826
Energy: 0.5456391259055332
Energy: 0.543045028408037
Energy: 0.5565892240201161
Energy: 0.5516053266968696
Energy: 0.5459040004609453
Energy: 0.5615920344152324
Energy: 0.5375629432552257
Energy: 0.5391746471364001
Energy: 0.5572514744681437
Energy: 0.5383207390181307
Energy: 0.5422327575473526
Energy: 0.5620134951937967
Energy: 0.5415660379783388
Energy: 0.5418087520883552
Energy: 0.5549290991640867
Energy: 0.5479504349183099
Energy: 0.556588945015732
Energy: 0.5431040254894786
Energy: 0.5439582309156018
Energy: 0.5408727739857438
Energy: 0.5409466572388528
Energy: 0.5396074202501736
Energy: 0.5391132794007433
Energy: 0.5510880201177281
Energy: 0.5519431401877917
Energy: 0.5505476820871451
Energy: 0.5443681054973342
Energy: 0.542279283908301
Energy: 0.5505585584578737
Energy: 0.5685641975071429
Energy: 0.5312755839075053
Energy: 0.5388916408588843
Energy: 0.5587768164609676
Energy: 0.5315956785859565
Energy: 0.5358068799777472
Energy: 0.5686369584180707
Energy: 0.5397319929371064
Energy: 0.5467940446345094
Energy: 0.5412736143563514
Energy: 0.5414168810291246
Energy: 0.5473039034385327
Energy: 0.5532304787361693
Energy: 0.5392173620048436
Energy: 0.544235051736783
Energy: 0.5394820323128464
Energy: 0.5394354217091948
Energy: 0.5400688433851386
Energy: 0.5580900942802655
Energy: 0.5465450841096324
Energy: 0.5451721255479364
Energy: 0.5410464503866709
Energy: 0.5435300808948523
Energy: 0.5432288066667517
Energy: 0.5682336095697106
Energy: 0.5402626410237812
Energy: 0.5400120445443499
Energy: 0.5426623332191689
Energy: 0.5405321218660913
Energy: 0.5409978545237091
Energy: 0.5678813095857991
Energy: 0.5433532715976651
Energy: 0.544758223982651
Energy: 0.5449107068471717
Energy: 0.5448065902291882
Energy: 0.5446158858187037
Energy: 0.5493330368885488
Energy: 0.5659163161740106
Energy: 0.5474205047212841
Energy: 0.5299811233775443
Energy: 0.5514219211313527
Energy: 0.5313923256588877
Energy: 0.5939806171403034
Energy: 0.5457665447589232
Energy: 0.5442126110647779
Energy: 0.5482521816585558
Energy: 0.547728159976604
Energy: 0.5464690877485002
Energy: 0.5681012894182118
Energy: 0.5415951181913181
Energy: 0.5415908616138922
Energy: 0.5394927040023448
Energy: 0.5435221012897562
Energy: 0.5426604083786232
Energy: 0.56142843796629
Energy: 0.5428257939984386
Energy: 0.542604195626577
Energy: 0.5491303855110514
Energy: 0.5425562960627314
Energy: 0.5431295329934839
Energy: 0.5548701459422883
Energy: 0.5398467544738852
Energy: 0.5425303494813889
Energy: 0.5487247591705188
Energy: 0.5461410727573003
Energy: 0.5444179151192949
Energy: 0.5521812278360084
Energy: 0.5445750312316988
Energy: 0.5437861038778457
Energy: 0.544666076027392
Energy: 0.5423395034656465
Energy: 0.5428522227114813
Energy: 0.5570505786050389
Energy: 0.5405852009306923
Energy: 0.5413996442259562
Energy: 0.5522382488150747
Energy: 0.5405814210687625
Energy: 0.5430583625947918
Energy: 0.5683148335691048
Energy: 0.5409786186008784
Energy: 0.541568266058476
Energy: 0.5516302519572419
Energy: 0.542518653087821
Energy: 0.5471999975053252
Energy: 0.5492970820933952
Energy: 0.545187292350396
Energy: 0.5439251928311581
Energy: 0.5416574947770526
Energy: 0.5399218449796758
Energy: 0.5428287292604995
Energy: 0.543728792756659
Energy: 0.547754864449596
Energy: 0.5456233228084438
Energy: 0.5407384901965145
Energy: 0.541644255967004
Energy: 0.5446138092693164
Energy: 0.5660085056958886
Energy: 0.5318196096563945
Energy: 0.5320604788800388
Energy: 0.5494653829079866
Energy: 0.532459580893878
Energy: 0.5330282573875865
Energy: 0.5683580324196906
Energy: 0.5307632177194231
Energy: 0.5376885712236031
Energy: 0.5436279815619813
Energy: 0.5315258127916631
Energy: 0.5444285508022235
Energy: 0.5569815849660651
Energy: 0.5436795073999403
Energy: 0.543862467847851
Energy: 0.5386060355733724
Energy: 0.5434014846145128
Energy: 0.5427820329316958
Energy: 0.5547491137219566
Energy: 0.5460355317423984
Energy: 0.5445013488587477
Energy: 0.5392384269413889
Energy: 0.548364911934783
Energy: 0.5435681749345728
Energy: 0.5684185154448705
Energy: 0.5432118549523117
Energy: 0.5427194062211174
Energy: 0.5428057811542544
Energy: 0.5400781315770359
Energy: 0.5432646581334992
Energy: 0.568596884886133
Energy: 0.5458681259731394
Energy: 0.5447485639436354
Energy: 0.5394582080348612
Energy: 0.541443684774217
Energy: 0.5448501611321076
Energy: 0.5518792754137509
Energy: 0.5460013852183343
Energy: 0.5325026120111195
Energy: 0.5285141342815833
Energy: 0.5401440455141912
Energy: 0.5314461413497042

minimum gb energy = 0.5285141342815833 eV
minimum distance =  2.6253507767537 Angstroms
sigma value = 33


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

Energy: 0.013463672389532472
Energy: 0.553451527238607
Energy: 0.01402396176165765
Energy: 0.0148948036643284
Energy: 0.554816637145245
Energy: 0.014035936122039242
Energy: 0.25979385573507974
Energy: 0.07087055358139462
Energy: 0.06968102485958082
Energy: 0.07189698299249521
Energy: 0.07085600111644981
Energy: 0.0695636881793771
Energy: 0.748282854289936
Energy: 0.5536527594268411
Energy: 0.552956674244961
Energy: 0.5559088500215411
Energy: 0.555532704985284
Energy: 0.5527894349029611
Energy: 0.2597938557347509
Energy: 0.07087055358241978
Energy: 0.06968102485923264
Energy: 0.07189698299179888
Energy: 0.07085600111269734
Energy: 0.06956368817902893

minimum gb energy = 0.013463672389532472 eV
minimum distance =  2.84935028508508 Angstroms
sigma value = 1