Model name: model_name=EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.032073378562927
cohesive_energy=3.360270999181857
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010444490773062443
Energy: 0.01100779872973924
Energy: 0.3061322240306313
Energy: 0.01100779872973924
Energy: 0.01100779872973924
Energy: 0.4025241250720014
Energy: 0.01100779872973924
Energy: 0.4025241250720014
Energy: 0.30613222403012713
Energy: 0.01100779872973924
Energy: 0.010444490773062443
Energy: 0.01100779872973924
Energy: 0.01100779873024341
Energy: 0.4025241250720014
Energy: 0.01100779872973924
Energy: 0.4025241250720014

minimum gb energy = 0.010444490773062443 eV
minimum distance =  2.79494441124715 Angstroms
sigma value = 1


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

Energy: 0.5163846506493959
Energy: 0.5196981918386552
Energy: 0.5556075888768642
Energy: 0.5196981918386552
Energy: 0.5008695196240243
Energy: 0.516539254921376
Energy: 0.5034961993465676
Energy: 0.5165392549219874
Energy: 0.48371265840542343
Energy: 0.5091207509149345
Energy: 0.5106524561589577
Energy: 0.5091207509161573
Energy: 0.4997173161638852
Energy: 0.5340751894243175
Energy: 0.488955967985421
Energy: 0.5340751894243175
Energy: 0.4987388025915739
Energy: 0.5242374001796862
Energy: 0.5107380024787956
Energy: 0.5242374001790747
Energy: 0.4877056171677899
Energy: 0.5801005411949978
Energy: 0.4803108602430692
Energy: 0.5801005411949978
Energy: 0.5223641073752154
Energy: 0.5088872639659812
Energy: 0.48774602027876013
Energy: 0.5088872639641469
Energy: 0.47536239099946653
Energy: 0.5238283475561508
Energy: 0.475762182782819
Energy: 0.5238283475555394
Energy: 0.48841276599406835
Energy: 0.5910586858805028
Energy: 0.551676276870352
Energy: 0.5910586858805028
Energy: 0.48215453615176995
Energy: 0.5084538725195743
Energy: 0.46888234694331454
Energy: 0.5084538725195743
Energy: 0.5019197218242715
Energy: 0.5176745456210491
Energy: 0.48843280575483045
Energy: 0.5176745456210491
Energy: 0.5167828316982608
Energy: 0.5238375001137028
Energy: 0.4927851746717754
Energy: 0.5238375001124799
Energy: 0.5146194637583542
Energy: 0.5072785200751055
Energy: 0.522217175187652
Energy: 0.5072785200751055
Energy: 0.5096910406348114
Energy: 0.5181773720196912
Energy: 0.48786454503598703
Energy: 0.5181773720203026
Energy: 0.4898817121374231
Energy: 0.520291990256581
Energy: 0.48912935700788096
Energy: 0.520291990256581
Energy: 0.4941244706445618
Energy: 0.5203426043694438
Energy: 0.5048240873614245
Energy: 0.5203426043694438
Energy: 0.5107963951947015
Energy: 0.5090643051289676
Energy: 0.4743804372953962
Energy: 0.5090643051283561
Energy: 0.5034848427634918
Energy: 0.5096287357062022
Energy: 0.5649873589998601
Energy: 0.5096287357062022
Energy: 0.46761121741867884
Energy: 0.5223759836735744
Energy: 0.49921831120161675
Energy: 0.5223759836741858
Energy: 0.564278459164227
Energy: 0.5814293284371489
Energy: 0.4894034772937109
Energy: 0.5814293284389832
Energy: 0.47969226140021115
Energy: 0.5090591003656749
Energy: 0.46901952526818713
Energy: 0.5090591003644521
Energy: 0.4889110160757744
Energy: 0.5752212417998073
Energy: 0.5584321176174215
Energy: 0.5752212417991958
Energy: 0.5570849970387952
Energy: 0.5241142079680492
Energy: 0.4782122501237144
Energy: 0.5241142079674378
Energy: 0.5313894864696715
Energy: 0.5091330868125232
Energy: 0.48758326317406625
Energy: 0.5091330868119118
Energy: 0.4877570795463221
Energy: 0.5793755187135751
Energy: 0.5674007835492739
Energy: 0.5793755187141864
Energy: 0.49889244964065804
Energy: 0.524197736767764
Energy: 0.4896410162677006
Energy: 0.524197736768987
Energy: 0.49118641965973214
Energy: 0.5876117232671341
Energy: 0.48832676661084046
Energy: 0.5876117232671341
Energy: 0.4845769484922569
Energy: 0.5071484205548418
Energy: 0.5119460604363902
Energy: 0.5071484205542303
Energy: 0.5005354094209582
Energy: 0.5095726323319052
Energy: 0.4891389064557857
Energy: 0.5095726323312937
Energy: 0.5290619524829735
Energy: 0.5206041783009433
Energy: 0.5197324522617579
Energy: 0.5206041783003318
Energy: 0.5028258671960466
Energy: 0.5154002828026925
Energy: 0.5143755756804084
Energy: 0.5154002828026925
Energy: 0.4910873882604901
Energy: 0.5109634622831334
Energy: 0.5095441047581782
Energy: 0.5109634622825219
Energy: 0.49864013478097374
Energy: 0.5341146814655497
Energy: 0.4908333775644906
Energy: 0.5341146814655497

minimum gb energy = 0.46761121741867884 eV
minimum distance =  2.59416306542347 Angstroms
sigma value = 1


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

Energy: 0.564318482528134
Energy: 0.5572451561603246
Energy: 0.5825997921974371
Energy: 0.5572451561624161
Energy: 0.5082970042672547
Energy: 0.5371913915007438
Energy: 0.5101735751385874
Energy: 0.5371913915021382
Energy: 0.499980028077276
Energy: 0.5581519579098024
Energy: 0.5251696119115421
Energy: 0.5581519579104997
Energy: 0.5006604007223077
Energy: 0.5047269284321552
Energy: 0.49383321211422526
Energy: 0.5047269284314579
Energy: 0.5006268557384967
Energy: 0.5389717886184624
Energy: 0.551591730966399
Energy: 0.538971788612188
Energy: 0.5464870986837456
Energy: 0.5390402116920014
Energy: 0.49272293697161784
Energy: 0.5390402116933958
Energy: 0.5584899926560877
Energy: 0.5820002832672506
Energy: 0.5002049174049166
Energy: 0.5820002832679478
Energy: 0.4827938087097579
Energy: 0.5581545971067595
Energy: 0.4927314999614341
Energy: 0.5581545970990909
Energy: 0.4984921154821577
Energy: 0.5116835126935481
Energy: 0.5242915152715036
Energy: 0.5116835126893652
Energy: 0.4978458247470199
Energy: 0.5582087678388881
Energy: 0.5074952939647176
Energy: 0.558208767834008
Energy: 0.5120536266193874
Energy: 0.5252544219369275
Energy: 0.5102750418045311
Energy: 0.5252544219313503
Energy: 0.49083120111197437
Energy: 0.547299702826487
Energy: 0.524935008218419
Energy: 0.5472997028285785
Energy: 0.5103378435204358
Energy: 0.536443219963219
Energy: 0.5044693843427946
Energy: 0.5364432199674019
Energy: 0.5103085078932434
Energy: 0.5364877658095918
Energy: 0.509148417093178
Energy: 0.5364877658109861
Energy: 0.4907069616568234
Energy: 0.5473981772112436
Energy: 0.524991310381333
Energy: 0.5473981772112436
Energy: 0.512125608545426
Energy: 0.525277249479066
Energy: 0.5040786859790611
Energy: 0.5252772494755803
Energy: 0.497885921068722
Energy: 0.5581427573347761
Energy: 0.4815519135739359
Energy: 0.5581427573333818
Energy: 0.4983963849180426
Energy: 0.5118964368648955
Energy: 0.5239249078868445
Energy: 0.5118964368648955
Energy: 0.4829647703944531
Energy: 0.5581608710634147
Energy: 0.492818355820678
Energy: 0.5581608710668688
Energy: 0.5583783889222479
Energy: 0.5823306671597286
Energy: 0.4939324147241824
Energy: 0.5823306671624855
Energy: 0.5465992291179191
Energy: 0.5392406368752212
Energy: 0.5069500167952964
Energy: 0.5392406368752212
Energy: 0.5006534306965975
Energy: 0.5389820240551254
Energy: 0.5467587265846052
Energy: 0.5389820240551254
Energy: 0.500834190340952
Energy: 0.5046989475145619
Energy: 0.5041661599312135
Energy: 0.504698947511076
Energy: 0.49997450650912506
Energy: 0.5581223897659816
Energy: 0.5251778042216398
Energy: 0.5581223897673758
Energy: 0.5083069730681002
Energy: 0.5374098021635677
Energy: 0.510290897855466
Energy: 0.537409802164962
Energy: 0.564318482528134
Energy: 0.5572451561603246
Energy: 0.5293647017474151
Energy: 0.5572451561624161
Energy: 0.5082970042672547
Energy: 0.5371913915000468
Energy: 0.5101735751392844
Energy: 0.5371913915021382
Energy: 0.499980028077276
Energy: 0.5581519579098024
Energy: 0.5251696119115421
Energy: 0.5581519579104997
Energy: 0.5006604007216106
Energy: 0.5047269284321552
Energy: 0.49383321211492237
Energy: 0.5047269284314579

minimum gb energy = 0.4815519135739359 eV
minimum distance =  2.53329055431713 Angstroms
sigma value = 25


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

Energy: 0.57229900015129
Energy: 0.5780380156480042
Energy: 0.6082773153828178
Energy: 0.5780380156463832
Energy: 0.542316671604393
Energy: 0.5580088345702595
Energy: 0.5357572428966061
Energy: 0.55800883457107
Energy: 0.5122994398885251
Energy: 0.6012203900037596
Energy: 0.546096068338369
Energy: 0.6012203900045702
Energy: 0.520027117566299
Energy: 0.5698891119512802
Energy: 0.5199361875775991
Energy: 0.5698891119512802
Energy: 0.5264064332634638
Energy: 0.5708038473043437
Energy: 0.5814638247926405
Energy: 0.5708038473051542
Energy: 0.5724884579367643
Energy: 0.6033611620429263
Energy: 0.560521383182291
Energy: 0.6033611620429263
Energy: 0.5380404384105649
Energy: 0.5871965315127442
Energy: 0.5378044172966974
Energy: 0.5871965315135546
Energy: 0.5891315072213983
Energy: 0.5717384736586968
Energy: 0.5214629249652285
Energy: 0.571738473657076
Energy: 0.5379784997513611
Energy: 0.556893609581367
Energy: 0.5383331860912415
Energy: 0.5568936095797462
Energy: 0.5477765055522
Energy: 0.6027653886831097
Energy: 0.5400768825649861
Energy: 0.6027653886822991
Energy: 0.5620104596443208
Energy: 0.5694833092484368
Energy: 0.5208574378773007
Energy: 0.5694833092476265
Energy: 0.5294095882286373
Energy: 0.5780903553347422
Energy: 0.5212376724196411
Energy: 0.5780903553339317
Energy: 0.5346263522276236
Energy: 0.5925698865408441
Energy: 0.5128807712498138
Energy: 0.5925698865392232
Energy: 0.549551941265692
Energy: 0.5249843650803258
Energy: 0.5365281945514407
Energy: 0.5249843650779129
Energy: 0.5235868201882633
Energy: 0.5707944721383371
Energy: 0.5238778321778834
Energy: 0.5707944721391477
Energy: 0.5293577336761687
Energy: 0.5407737015739381
Energy: 0.5244564763777257
Energy: 0.5407737015747484
Energy: 0.5030391538213402
Energy: 0.6022790265311881
Energy: 0.49895494237403337
Energy: 0.602279026532809
Energy: 0.5149490455348437
Energy: 0.5561645753231602
Energy: 0.5166397503731883
Energy: 0.5561645753207288
Energy: 0.5330989577319393
Energy: 0.5808799529589379
Energy: 0.5166694392098232
Energy: 0.5808799529581277
Energy: 0.5703601193347212
Energy: 0.6031377734216871
Energy: 0.5340705435932961
Energy: 0.6031377734208765
Energy: 0.5364384173396836
Energy: 0.5499159130311254
Energy: 0.5352524043871036
Energy: 0.549915913030315
Energy: 0.5676262128545209
Energy: 0.5790157547128016
Energy: 0.587675181537142
Energy: 0.5790157547119911
Energy: 0.5420979234746564
Energy: 0.5705597042912669
Energy: 0.5359008178107602
Energy: 0.5705597042904564
Energy: 0.5139231295703222
Energy: 0.5999476756843655
Energy: 0.5476737038606854
Energy: 0.5999476756851757
Energy: 0.524027609077576
Energy: 0.54248492544864
Energy: 0.5196413268380232
Energy: 0.5424849254470192

minimum gb energy = 0.49895494237403337 eV
minimum distance =  2.53557978819894 Angstroms
sigma value = 9


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

Energy: 0.5596392639862228
Energy: 0.5611281425000755
Energy: 0.6481105822902928
Energy: 0.5611281425010423
Energy: 0.5538944753044099
Energy: 0.5777637233388472
Energy: 0.5404646349056681
Energy: 0.5777637233388472
Energy: 0.5256646703005728
Energy: 0.5629783358445127
Energy: 0.5401531151824772
Energy: 0.5629783358454796
Energy: 0.6480246875834381
Energy: 0.6200398458831458
Energy: 0.5286019734039397
Energy: 0.6200398458841125
Energy: 0.6062035739071385
Energy: 0.5776251386243607
Energy: 0.6332543814812482
Energy: 0.5776251386243607
Energy: 0.5018718225486498
Energy: 0.5635463971912527
Energy: 0.5560929526119811
Energy: 0.5635463971931862
Energy: 0.5750949866065634
Energy: 0.5282913428484193
Energy: 0.5281741855894836
Energy: 0.5282913428484193
Energy: 0.562363025840871
Energy: 0.5633685923702851
Energy: 0.5280734846889386
Energy: 0.5633685923673849
Energy: 0.5574287210254516
Energy: 0.5779411331032396
Energy: 0.5565035124758478
Energy: 0.5779411331042063
Energy: 0.5566271820756266
Energy: 0.5603170474196321
Energy: 0.5562987494974095
Energy: 0.5603170474176985
Energy: 0.5217022025826445
Energy: 0.5766115196820121
Energy: 0.5400266573123034
Energy: 0.5766115196810452
Energy: 0.5754647105884866
Energy: 0.5850429539920143
Energy: 0.5284304028184535
Energy: 0.5850429539920143
Energy: 0.4959974100149001
Energy: 0.5632511160955102
Energy: 0.5027105822719226
Energy: 0.5632511160955102
Energy: 0.5699135362234165
Energy: 0.5519132331241815
Energy: 0.5521560646792658
Energy: 0.5519132331241815
Energy: 0.49598559400429193
Energy: 0.5630726417308927
Energy: 0.52805688953679
Energy: 0.563072641728959
Energy: 0.5753967246677196
Energy: 0.5849747417155354
Energy: 0.5283684271662977
Energy: 0.5849747417155354
Energy: 0.5217264053006959
Energy: 0.5766482281772787
Energy: 0.5276373837407677
Energy: 0.5766482281753452
Energy: 0.5566365288004781
Energy: 0.5607008380547045
Energy: 0.5561754571184206
Energy: 0.5607008380556713
Energy: 0.5575866638918214
Energy: 0.5780563438381043
Energy: 0.5538276885739938
Energy: 0.5780563438400379
Energy: 0.5622817550964792
Energy: 0.5633760730937586
Energy: 0.5281532502678836
Energy: 0.5633760730937586
Energy: 0.5750827503503035
Energy: 0.5283996315313358
Energy: 0.5282100173106035
Energy: 0.5283996315323027

minimum gb energy = 0.49598559400429193 eV
minimum distance =  2.65051415048758 Angstroms
sigma value = 25


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

Energy: 0.5510388669460715
Energy: 0.6287197367252001
Energy: 0.6899535718428503
Energy: 0.6287197367252001
Energy: 0.5239577837610603
Energy: 0.6059678657290636
Energy: 0.49774462796311475
Energy: 0.6059678657290636
Energy: 0.5543680011378079
Energy: 0.6562005404692942
Energy: 0.49844030718472826
Energy: 0.6562005404692942
Energy: 0.5886855115622873
Energy: 0.620295457951553
Energy: 0.5891919066630148
Energy: 0.6202954579527488
Energy: 0.5887656904819454
Energy: 0.5155275439466862
Energy: 0.5566840726440719
Energy: 0.5155275439466862
Energy: 0.5002835498104085
Energy: 0.6545112189308406
Energy: 0.553246936625067
Energy: 0.6545112189308406
Energy: 0.49802698478029367
Energy: 0.5545611735414944
Energy: 0.5532915178107047
Energy: 0.55456117354269
Energy: 0.637133871908453
Energy: 0.6299375640887876
Energy: 0.5438286743192285
Energy: 0.6299375640899832
Energy: 0.49871141411703657
Energy: 0.5563252118699533
Energy: 0.523927868062082
Energy: 0.5563252118711489
Energy: 0.6288974472739395
Energy: 0.5845314385630336
Energy: 0.5532400414352139
Energy: 0.5845314385630336
Energy: 0.5461762971283932
Energy: 0.6150625150362155
Energy: 0.6700971408462727
Energy: 0.6150625150350199
Energy: 0.5548208140783675
Energy: 0.5475456357838844
Energy: 0.6287520136787779
Energy: 0.5475456357826888
Energy: 0.579030824880005
Energy: 0.6573731170081982
Energy: 0.49740418557844784
Energy: 0.6573731170070027
Energy: 0.5553042675281978
Energy: 0.5904282619012345
Energy: 0.5885515215339798
Energy: 0.5904282619012345
Energy: 0.5678576984175429
Energy: 0.5935174167978278
Energy: 0.6387473043382171
Energy: 0.5935174167990234
Energy: 0.5242254128477564
Energy: 0.6425237852113821
Energy: 0.5002103462933865
Energy: 0.6425237852113821
Energy: 0.5544441868602557
Energy: 0.5609586401748092
Energy: 0.6286993205552328
Energy: 0.5609586401748092

minimum gb energy = 0.49740418557844784 eV
minimum distance =  2.61516197397725 Angstroms
sigma value = 17


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

Energy: 0.5752866357794377
Energy: 0.5760160443748572
Energy: 0.7039500352797636
Energy: 0.57601604437418
Energy: 0.5819909837174652
Energy: 0.5763755444243878
Energy: 0.5116504457630401
Energy: 0.5763755444243878
Energy: 0.6206295273488966
Energy: 0.5721234571309214
Energy: 0.5119929680449757
Energy: 0.5721234571309214
Energy: 0.5566791126276298
Energy: 0.573426155143204
Energy: 0.5674942015603994
Energy: 0.5734261551445583
Energy: 0.6289488731924692
Energy: 0.5497634957761249
Energy: 0.5502919552131031
Energy: 0.5497634957761249
Energy: 0.5314437228822008
Energy: 0.582678453365055
Energy: 0.5729647027791439
Energy: 0.5826784533643777
Energy: 0.5509322333723274
Energy: 0.5756081785509606
Energy: 0.5491956107799402
Energy: 0.5756081785509606
Energy: 0.6199715067734252
Energy: 0.5832916421339294
Energy: 0.5359394271574245
Energy: 0.5832916421346065
Energy: 0.5726003869558818
Energy: 0.5946731795821233
Energy: 0.6214402142839371
Energy: 0.5946731795834775
Energy: 0.6537733828571667
Energy: 0.5788839350246794
Energy: 0.5586887280209186
Energy: 0.5788839350253565
Energy: 0.5135300221530411
Energy: 0.5773730113668628
Energy: 0.59915868328825
Energy: 0.5773730113661856
Energy: 0.5639205040982262
Energy: 0.5747776817183704
Energy: 0.5644998088650072
Energy: 0.5747776817183704
Energy: 0.6175200320033142
Energy: 0.5760225173687723
Energy: 0.5777817629048796
Energy: 0.5760225173674182
Energy: 0.5133322224608483
Energy: 0.5844498293829569
Energy: 0.5915738890253063
Energy: 0.5844498293829569
Energy: 0.5801886367750644
Energy: 0.5798939647788763
Energy: 0.5655042357196034
Energy: 0.5798939647788763
Energy: 0.5757710058772878
Energy: 0.5827700089501896
Energy: 0.5884552288947985
Energy: 0.5827700089495125
Energy: 0.5488652694757739
Energy: 0.5930929839972436
Energy: 0.6589045836855776
Energy: 0.5930929839979208
Energy: 0.641333067422656
Energy: 0.5640379661135595
Energy: 0.5314381215387018
Energy: 0.5640379661128823
Energy: 0.5554078350687346
Energy: 0.5962054246707582
Energy: 0.5391512226976484
Energy: 0.5962054246700811
Energy: 0.5543751221449056
Energy: 0.5746332189052846
Energy: 0.5667282822439664
Energy: 0.5746332189046075
Energy: 0.5492567854691682
Energy: 0.5615943174123377
Energy: 0.5930391929678196
Energy: 0.5615943174116604
Energy: 0.5616979400277303
Energy: 0.6197948122734324
Energy: 0.6651713272546809
Energy: 0.6197948122741096
Energy: 0.5490917492317193
Energy: 0.5744734924460889
Energy: 0.5109343638060374
Energy: 0.5744734924460889
Energy: 0.5665067149810626
Energy: 0.5979400244046316
Energy: 0.6177487584658607
Energy: 0.5979400244046316
Energy: 0.5673792342265497
Energy: 0.5609406039729575
Energy: 0.6191502487385796
Energy: 0.5609406039729575
Energy: 0.6513110544339266
Energy: 0.5737656762223907
Energy: 0.5117558065387462
Energy: 0.5737656762230678
Energy: 0.5491479032327417
Energy: 0.5933302751971695
Energy: 0.6965335559403689
Energy: 0.5933302751964924
Energy: 0.5738911281663726
Energy: 0.5838485415660811
Energy: 0.5941272712419101
Energy: 0.5838485415667581
Energy: 0.6407674969979706
Energy: 0.6056521969835127
Energy: 0.5668643638611632
Energy: 0.6056521969828355
Energy: 0.5360873968434196
Energy: 0.5957552513565035
Energy: 0.62096533951141
Energy: 0.5957552513558264

minimum gb energy = 0.5109343638060374 eV
minimum distance =  2.52587455667845 Angstroms
sigma value = 53


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

Energy: 0.4786684430850016
Energy: 0.47890445122186864
Energy: 0.7281639272557007
Energy: 0.47890445122186864
Energy: 0.6121330764674021
Energy: 0.5610630300986139
Energy: 0.5431868510079877
Energy: 0.5610630300986139
Energy: 0.49168378982301747
Energy: 0.4789109814512805
Energy: 0.47708362667101634
Energy: 0.4789109814512805
Energy: 0.4917267142139352
Energy: 0.47899971505708244
Energy: 0.4770274137406695
Energy: 0.4789997150555235
Energy: 0.6120327275969473
Energy: 0.5613363981674894
Energy: 0.543131154285884
Energy: 0.5613363981674894
Energy: 0.4786684430850016
Energy: 0.47890445122342756
Energy: 0.7281639272557007
Energy: 0.47890445122186864
Energy: 0.6121330764674021
Energy: 0.5610630300986139
Energy: 0.5431868510095466
Energy: 0.5610630300986139
Energy: 0.4916837898245764
Energy: 0.4789109814512805
Energy: 0.47708362667101634
Energy: 0.4789109814512805
Energy: 0.4917267142139352
Energy: 0.47899971505708244
Energy: 0.5413142915246042
Energy: 0.4789997150555235
Energy: 0.6120327275969473
Energy: 0.5613363981674894
Energy: 0.543131154285884
Energy: 0.5613363981659304
Energy: 0.4786684430850016
Energy: 0.47890445122186864
Energy: 0.6062528967373745
Energy: 0.47890445122342756
Energy: 0.6121330764674021
Energy: 0.5610630300986139
Energy: 0.5431868510095466
Energy: 0.5610630300986139
Energy: 0.4916837898245764
Energy: 0.4789109814512805
Energy: 0.47708362667101634
Energy: 0.4789109814512805

minimum gb energy = 0.4770274137406695 eV
minimum distance =  2.60028214440638 Angstroms
sigma value = 9


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

Energy: 0.5268744644095638
Energy: 0.6005914270041188
Energy: 0.7378194417989017
Energy: 0.6005914270046957
Energy: 0.6601893625253449
Energy: 0.5622755442250783
Energy: 0.5409650254437869
Energy: 0.5622755442262322
Energy: 0.5428745440282741
Energy: 0.5163860378299954
Energy: 0.5313382930841302
Energy: 0.5163860378299954
Energy: 0.6189820189955751
Energy: 0.62322069088599
Energy: 0.5419613716030708
Energy: 0.6232206908854129
Energy: 0.6220830553464896
Energy: 0.5478084615335633
Energy: 0.5343515787947298
Energy: 0.5478084615341402
Energy: 0.5156753194930764
Energy: 0.5154452501830399
Energy: 0.6213097849711295
Energy: 0.5154452501836168
Energy: 0.7051865099807447
Energy: 0.543628233972769
Energy: 0.5416036303173825
Energy: 0.5436282339733459
Energy: 0.5440302556746369
Energy: 0.6404626125258832
Energy: 0.6261730462717154
Energy: 0.6404626125258832
Energy: 0.5565128247345925
Energy: 0.5874535553059057
Energy: 0.5218968823084069
Energy: 0.5874535553070597
Energy: 0.5379283504370168
Energy: 0.5624293767352757
Energy: 0.5427866817772828
Energy: 0.5624293767364297
Energy: 0.5537739955072795
Energy: 0.5821833694916769
Energy: 0.7102066075494728
Energy: 0.5821833694910998
Energy: 0.632238754603084
Energy: 0.6087263322093155
Energy: 0.5358407029242961
Energy: 0.6087263322133543
Energy: 0.5439537278578759
Energy: 0.5624832562524464
Energy: 0.6760622883315932
Energy: 0.5624832562524464
Energy: 0.616655961556013
Energy: 0.646536668096952
Energy: 0.5310624582068465
Energy: 0.6465366680975291
Energy: 0.5426572189690727
Energy: 0.6061700659998922
Energy: 0.6122744930934275
Energy: 0.6061700660004692
Energy: 0.5455844202736179
Energy: 0.6312361429163916
Energy: 0.6183132693688596
Energy: 0.6312361429163916
Energy: 0.5916147897081002
Energy: 0.6062120481644888
Energy: 0.5428472985731965
Energy: 0.6062120481650658
Energy: 0.5637686301382326
Energy: 0.5435397503507967
Energy: 0.6246699910751861
Energy: 0.5435397503507967
Energy: 0.6226361593662855
Energy: 0.5618285689733157
Energy: 0.517278360430155
Energy: 0.5618285689744696
Energy: 0.534613862819168
Energy: 0.57276296540751
Energy: 0.613001303586026
Energy: 0.572762965408087
Energy: 0.6214624931132726
Energy: 0.6231007867626146
Energy: 0.6178120524042722
Energy: 0.6231007867626146
Energy: 0.6011749009235907
Energy: 0.5974470398629033
Energy: 0.5369615613245723
Energy: 0.5974470398629033
Energy: 0.5222002378734518
Energy: 0.5909942669848238
Energy: 0.5490330836852741
Energy: 0.590994266984247
Energy: 0.710632563522241
Energy: 0.5792542004602343
Energy: 0.5522395455032892
Energy: 0.5792542004596573
Energy: 0.5412836096506193
Energy: 0.6139702518254505
Energy: 0.7002331400759593
Energy: 0.6139702518248736
Energy: 0.5808451595936989
Energy: 0.5548170921014685
Energy: 0.5424310216458482
Energy: 0.5548170921014685
Energy: 0.6143649819431874
Energy: 0.6096691070970686
Energy: 0.6142862341331193
Energy: 0.6096691070976454
Energy: 0.5354814484750037
Energy: 0.6230281692454123
Energy: 0.6148498915432788
Energy: 0.6230281692442583
Energy: 0.5662341787556912
Energy: 0.5549810985616334
Energy: 0.5419083231935233
Energy: 0.5549810985604794
Energy: 0.5408787653244583
Energy: 0.6778544428077867
Energy: 0.7010348885073149
Energy: 0.6778544428083637
Energy: 0.6392893309566707
Energy: 0.5792316702628757
Energy: 0.5515437089322784
Energy: 0.5792316702634527
Energy: 0.5240792419612235
Energy: 0.544563610362043
Energy: 0.5472350266106858
Energy: 0.544563610362043
Energy: 0.5162259719411444
Energy: 0.5888187218047721
Energy: 0.5378326816243069
Energy: 0.5888187218041953
Energy: 0.6245039129507232
Energy: 0.6226712800809853
Energy: 0.6180153802967976
Energy: 0.6226712800809853
Energy: 0.5537290874803861
Energy: 0.6348897166099592
Energy: 0.7058550434743847
Energy: 0.6348897166099592

minimum gb energy = 0.5154452501830399 eV
minimum distance =  2.55549807613645 Angstroms
sigma value = 73


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

Energy: 0.5529221385548143
Energy: 0.5542361784683438
Energy: 0.7412714961120506
Energy: 0.5542361784674283
Energy: 0.6172916434639226
Energy: 0.5657035601982479
Energy: 0.5572101957643857
Energy: 0.5657035601991632
Energy: 0.5515567228471223
Energy: 0.5425276214748062
Energy: 0.5215939965764878
Energy: 0.5425276214748062
Energy: 0.5529703212515725
Energy: 0.5986568063172999
Energy: 0.5865845935820134
Energy: 0.5986568063172999
Energy: 0.5751899322457237
Energy: 0.5722020672961355
Energy: 0.5890042319128254
Energy: 0.5722020672961355
Energy: 0.5689805654179424
Energy: 0.5288238763385575
Energy: 0.6644186103451035
Energy: 0.5288238763358112
Energy: 0.7040210615939185
Energy: 0.6342182959796615
Energy: 0.5520349553755219
Energy: 0.6342182959805769
Energy: 0.5435082226455141
Energy: 0.5092734687789836
Energy: 0.6679353046574027
Energy: 0.5092734687789836
Energy: 0.687185951918312
Energy: 0.5090935800048348
Energy: 0.5093614695163461
Energy: 0.5090935800039195
Energy: 0.5535090993354919
Energy: 0.5972035368146557
Energy: 0.5529161175941083
Energy: 0.597203536815571
Energy: 0.5433830127875674
Energy: 0.5427828273878321
Energy: 0.6675512861735138
Energy: 0.5427828273869167
Energy: 0.6124257856112872
Energy: 0.5333252758467582
Energy: 0.537274788306173
Energy: 0.5333252758504199
Energy: 0.5440660987070635
Energy: 0.5467835380533188
Energy: 0.6220580130093248
Energy: 0.5467835380533188
Energy: 0.6736003231788904
Energy: 0.586350875499068
Energy: 0.5678226300658107
Energy: 0.586350875499068
Energy: 0.5263833152568371
Energy: 0.6366217252625842
Energy: 0.6717426834802473
Energy: 0.6366217252616688
Energy: 0.6468090217637376
Energy: 0.5659293004979032
Energy: 0.5439248798636042
Energy: 0.565929300499734
Energy: 0.5709828737978461
Energy: 0.5535512299307483
Energy: 0.5516245295292463
Energy: 0.5535512299316638
Energy: 0.5542093955600093
Energy: 0.5534359050571159
Energy: 0.5759271370667031
Energy: 0.5534359050580314
Energy: 0.5266720949576111
Energy: 0.5428577550978808
Energy: 0.5421337730097869
Energy: 0.5428577550987962
Energy: 0.5510365560870224
Energy: 0.5926706796079833
Energy: 0.7289056683375162
Energy: 0.5926706796088986
Energy: 0.6617264377151404
Energy: 0.5752237148668197
Energy: 0.5671138324550226
Energy: 0.5752237148659043
Energy: 0.5866071225513048
Energy: 0.5813804726088535
Energy: 0.6112940379232303
Energy: 0.5813804726088535

minimum gb energy = 0.5090935800039195 eV
minimum distance =  2.58143434821481 Angstroms
sigma value = 7


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

Energy: 0.5193506064241151
Energy: 0.5197780354619914
Energy: 0.7456761008217925
Energy: 0.5197780354619914
Energy: 0.7044334942404683
Energy: 0.6168657853066148
Energy: 0.5538062714237773
Energy: 0.6168657853104692
Energy: 0.5553610069652982
Energy: 0.5239944314866553
Energy: 0.5246915233781388
Energy: 0.5239944314892444
Energy: 0.5919976314767411
Energy: 0.5575909155988574
Energy: 0.5613717313141976
Energy: 0.5575909155995046
Energy: 0.5439688204296005
Energy: 0.568474519127009
Energy: 0.522057577121305
Energy: 0.5684745191283036
Energy: 0.5371787763537423
Energy: 0.5630007390560191
Energy: 0.6820467542749882
Energy: 0.5630007390534301
Energy: 0.627149877222839
Energy: 0.6298206498033008
Energy: 0.5624928273816259
Energy: 0.6298206498078318
Energy: 0.5369823293122562
Energy: 0.5631085534206696
Energy: 0.7144981234156417
Energy: 0.5631085534226116
Energy: 0.6167522658551374
Energy: 0.5486541103740442
Energy: 0.5620354597249948
Energy: 0.5486541103766333
Energy: 0.5431019942111821
Energy: 0.5617890404109657
Energy: 0.6142512604156047
Energy: 0.5617890404122603
Energy: 0.5599195942553123
Energy: 0.5625774912918607
Energy: 0.5969315960794409
Energy: 0.5625774912918607
Energy: 0.5204637288168896
Energy: 0.5686542360387158
Energy: 0.5631634055184046
Energy: 0.5686542360387158
Energy: 0.5199339061849315
Energy: 0.5209968126611678
Energy: 0.6049249723162944
Energy: 0.5209968126644042
Energy: 0.5559319357638969
Energy: 0.5584866648168851
Energy: 0.5972203639598803
Energy: 0.5584866648162379
Energy: 0.5417650540682933
Energy: 0.6273009726458343
Energy: 0.6816009595580629
Energy: 0.6273009726425978
Energy: 0.7220617817359861
Energy: 0.5143333099926866
Energy: 0.5461321284591709
Energy: 0.5143333099998068
Energy: 0.556065859119398
Energy: 0.5749107032518179
Energy: 0.6337729245192296
Energy: 0.5749107032544072
Energy: 0.5286822094440249
Energy: 0.5716884624990318
Energy: 0.5633536624293681
Energy: 0.571688462501621
Energy: 0.5558972242881239
Energy: 0.5634733585934983
Energy: 0.5968121304163608
Energy: 0.5634733585960875
Energy: 0.5432531280516419
Energy: 0.5679670581134171
Energy: 0.5657467052226367
Energy: 0.5679670581114751
Energy: 0.6017259636721524
Energy: 0.6068232191046093
Energy: 0.5629105522455841
Energy: 0.6068232191084932
Energy: 0.5436807511508595
Energy: 0.6056744259795903
Energy: 0.614425298299998
Energy: 0.6056744259873579
Energy: 0.6796622360606138
Energy: 0.573859025863219
Energy: 0.5965536592614805
Energy: 0.5738590258619244
Energy: 0.5219154018371773
Energy: 0.520074286791309
Energy: 0.6878338576265444
Energy: 0.5200742867893671
Energy: 0.5987660624987543
Energy: 0.56782408962746
Energy: 0.5626913940498695
Energy: 0.5678240896235762
Energy: 0.5908678786129998
Energy: 0.6038170580592185
Energy: 0.5609285347343256
Energy: 0.6038170580631024
Energy: 0.5452938376770613
Energy: 0.5602461360563332
Energy: 0.5716732214156205
Energy: 0.5602461360582752
Energy: 0.5972123224091178
Energy: 0.5745396420693564
Energy: 0.5639898677564786
Energy: 0.5745396420706509
Energy: 0.5345999908637885
Energy: 0.5628062164994051
Energy: 0.6425112299706357
Energy: 0.5628062165006997
Energy: 0.6500344998533583
Energy: 0.633187752481277
Energy: 0.5530710079904521
Energy: 0.6331877524793351
Energy: 0.5346026702706055
Energy: 0.5627744688485685
Energy: 0.66019171785145
Energy: 0.5627744688440375

minimum gb energy = 0.5143333099926866 eV
minimum distance =  2.56731302624301 Angstroms
sigma value = 29


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

Energy: 0.4821404598467734
Energy: 0.4891713718202472
Energy: 0.7682696277676014
Energy: 0.4891713718220009
Energy: 0.6172003827451885
Energy: 0.4835038154046585
Energy: 0.5597481646911696
Energy: 0.4835053562313499
Energy: 0.5925353232371322
Energy: 0.49916378381918675
Energy: 0.5276540411314927
Energy: 0.4991637838185354
Energy: 0.48224762169981716
Energy: 0.46080965094146875
Energy: 0.559659740361386
Energy: 0.4608096509432475
Energy: 0.48240774554216
Energy: 0.4925139559516227
Energy: 0.5406436119300831
Energy: 0.49251395595249947
Energy: 0.5408687003093094
Energy: 0.4988783945650921
Energy: 0.5409106098771604
Energy: 0.4988783945650921
Energy: 0.5405769611359221
Energy: 0.49247728456403334
Energy: 0.4823988392653429
Energy: 0.49247728456403334
Energy: 0.5597319513157915
Energy: 0.46086800693639
Energy: 0.4822212722299085
Energy: 0.4608680069374923
Energy: 0.5274012467413748
Energy: 0.4992150551820915
Energy: 0.5925174522832564
Energy: 0.4992150551836197

minimum gb energy = 0.46080965094146875 eV
minimum distance =  2.60948444882472 Angstroms
sigma value = 5


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

Energy: 0.5068630221124851
Energy: 0.5025449506079227
Energy: 0.7791058905491571
Energy: 0.5025449506091456
Energy: 0.6501869933275126
Energy: 0.5291040072638677
Energy: 0.5048304438841815
Energy: 0.5291040072614218
Energy: 0.4909780396035132
Energy: 0.5481763316839123
Energy: 0.6079803861426122
Energy: 0.5481763316863583
Energy: 0.5381005155324617
Energy: 0.5255310638122785
Energy: 0.5004929843506299
Energy: 0.5255310638110557
Energy: 0.5058790595885797
Energy: 0.5293672815203336
Energy: 0.6197655707562527
Energy: 0.5293672815221679
Energy: 0.5383000217459578
Energy: 0.5496123865805842
Energy: 0.49522534175528105
Energy: 0.5496123865799728
Energy: 0.49661287543032134
Energy: 0.5315699540979356
Energy: 0.48998931114896715
Energy: 0.5315699540961012
Energy: 0.4939063982572664
Energy: 0.5263655954141642
Energy: 0.5061984522747038
Energy: 0.5263655954135528
Energy: 0.4987079316610895
Energy: 0.5044075125656462
Energy: 0.5215855782635355
Energy: 0.5044075125693148
Energy: 0.4954589686421925
Energy: 0.5287320966778778
Energy: 0.5082764287115499
Energy: 0.5287320966791008
Energy: 0.5000191121053623
Energy: 0.5510293507958545
Energy: 0.4976531811709754
Energy: 0.5510293507970774
Energy: 0.5105664805925797
Energy: 0.5200344703801028
Energy: 0.5467594447057277
Energy: 0.5200344703813258
Energy: 0.5428273781368014
Energy: 0.5019863254097936
Energy: 0.5035713937710259
Energy: 0.5019863254097936
Energy: 0.49856785827063416
Energy: 0.5262391380685494
Energy: 0.5694823457567706
Energy: 0.5262391380691609
Energy: 0.6539178789373293
Energy: 0.5451499852286787
Energy: 0.49778413449666953
Energy: 0.5451499852409077
Energy: 0.49609969154703915
Energy: 0.49864856265109253
Energy: 0.6088283114265342
Energy: 0.49864856265109253
Energy: 0.5911459875564345
Energy: 0.4922550241662138
Energy: 0.5106214715485216
Energy: 0.49225502416560235
Energy: 0.49543843190868025
Energy: 0.5496136002555977
Energy: 0.6036287821391163
Energy: 0.5496136002549863
Energy: 0.5093892608490546
Energy: 0.5324587535263868
Energy: 0.5098703195179445
Energy: 0.5324587535288327
Energy: 0.49055174530756424
Energy: 0.5746027268411307
Energy: 0.4988209219366576
Energy: 0.5746027268423536
Energy: 0.5104434692894955
Energy: 0.57359735707815
Energy: 0.4953943251257155
Energy: 0.573597357076927
Energy: 0.5079917947731659
Energy: 0.5280120713492481
Energy: 0.49458058393656373
Energy: 0.5280120713510825
Energy: 0.49888081546401236
Energy: 0.5024989820133834
Energy: 0.5113483547943836
Energy: 0.5024989820133834
Energy: 0.5465963548659143
Energy: 0.5063496042683682
Energy: 0.4908216894104396
Energy: 0.506349604269591
Energy: 0.5510152527537754
Energy: 0.5001343542525213
Energy: 0.525475088894279
Energy: 0.5001343542696419
Energy: 0.49971319105417294
Energy: 0.5267811723656455
Energy: 0.49268088116119213
Energy: 0.5267811723662568
Energy: 0.4989991576046576
Energy: 0.48564237239096414
Energy: 0.5650756782453684
Energy: 0.4856423723927985
Energy: 0.5641098133458561
Energy: 0.5242469856982235
Energy: 0.4950219851053314
Energy: 0.5242469856982235
Energy: 0.5092224921262458
Energy: 0.5215791243875306
Energy: 0.6776268301897899
Energy: 0.5215791243863077
Energy: 0.6397055226797573
Energy: 0.5495243580182242
Energy: 0.4951758561450373
Energy: 0.5495243580194472
Energy: 0.49341692056690567
Energy: 0.49880261094813577
Energy: 0.6183741180746374
Energy: 0.49880261094630146
Energy: 0.5929270148889497
Energy: 0.5451196852371084
Energy: 0.4983926951612126
Energy: 0.5451196852377198
Energy: 0.49836108053638534
Energy: 0.5260535816441828
Energy: 0.5265954795052311
Energy: 0.5260535816441828

minimum gb energy = 0.48564237239096414 eV
minimum distance =  2.5701417592284 Angstroms
sigma value = 1


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

Energy: 0.4821736855809291
Energy: 0.4827942206079708
Energy: 0.7934243133752332
Energy: 0.4827942206062799
Energy: 0.6611979754972913
Energy: 0.5149521456575467
Energy: 0.4767328002543718
Energy: 0.5149521456567013
Energy: 0.46583952543662666
Energy: 0.5563206534834173
Energy: 0.5577098849290247
Energy: 0.5563206534834173
Energy: 0.5241479460257265
Energy: 0.5161416998286467
Energy: 0.46885267153837623
Energy: 0.5161416998269559
Energy: 0.46646663015566386
Energy: 0.48109242489466836
Energy: 0.5825275758390108
Energy: 0.4810924248955138
Energy: 0.4660600932102659
Energy: 0.5147235326049892
Energy: 0.4680363656289444
Energy: 0.5147235326058346
Energy: 0.46432833620508374
Energy: 0.5277851593544742
Energy: 0.48370528857876627
Energy: 0.5277851593544742
Energy: 0.465307800970722
Energy: 0.5567344008187051
Energy: 0.49739423674166605
Energy: 0.5567344008178596
Energy: 0.48246833740935025
Energy: 0.48118906231
Energy: 0.4980124109578675
Energy: 0.4811890623083091
Energy: 0.48251008896696074
Energy: 0.4811105946885066
Energy: 0.49814774977474224
Energy: 0.4811105946893521
Energy: 0.464398203107346
Energy: 0.5566795357671028
Energy: 0.4974926098569322
Energy: 0.556679535765412
Energy: 0.46394011629760096
Energy: 0.5277703064616939
Energy: 0.48128615114604084
Energy: 0.5277703064608483
Energy: 0.4660465331384592
Energy: 0.5148945401980493
Energy: 0.46765265352897295
Energy: 0.514894540195513
Energy: 0.4664559807246955
Energy: 0.4811007003742143
Energy: 0.582547940554452
Energy: 0.4811007003733689
Energy: 0.5242802468688973
Energy: 0.516136111407821
Energy: 0.4675084606157837
Energy: 0.5161361114061302
Energy: 0.4661344681279384
Energy: 0.5561491098305177
Energy: 0.5576679896030553
Energy: 0.5561491098305177
Energy: 0.6615755540736629
Energy: 0.514823414370827
Energy: 0.47680295744317175
Energy: 0.5148234143691361
Energy: 0.4821736855809291
Energy: 0.4827942206079708
Energy: 0.6452343414069953
Energy: 0.4827942206062799
Energy: 0.6611979754981366
Energy: 0.5149521456575467
Energy: 0.4767328002543718
Energy: 0.5149521456575467
Energy: 0.46583952543662666
Energy: 0.5563206534834173
Energy: 0.5858954590853604
Energy: 0.5563206534834173
Energy: 0.5241479460274173
Energy: 0.5161416998286467
Energy: 0.46885267153837623
Energy: 0.5161416998269559
Energy: 0.4664666301548185
Energy: 0.48109242489466836
Energy: 0.5734824853616244
Energy: 0.4810924248955138
Energy: 0.46606009321111136
Energy: 0.5147235326032983
Energy: 0.4680363656289444
Energy: 0.5147235326049892
Energy: 0.46432833620508374
Energy: 0.5277851593544742
Energy: 0.47198177082598486
Energy: 0.5277851593544742

minimum gb energy = 0.46394011629760096 eV
minimum distance =  2.58683052048781 Angstroms
sigma value = 17


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

Energy: 0.4864942791319681
Energy: 0.4870411559150534
Energy: 0.7946724239286108
Energy: 0.487041155915576
Energy: 0.5538825467941212
Energy: 0.4825642460459634
Energy: 0.47675284185348155
Energy: 0.4825642460459634
Energy: 0.47376728808806806
Energy: 0.5268197737787805
Energy: 0.5802837549185302
Energy: 0.5268197737777354
Energy: 0.5419827175109454
Energy: 0.568434774768788
Energy: 0.4734479787147895
Energy: 0.5684347747703558
Energy: 0.4764013094038943
Energy: 0.5175930147929719
Energy: 0.6075915317767969
Energy: 0.5175930147950623
Energy: 0.51391772855015
Energy: 0.578688153818233
Energy: 0.4793388686754741
Energy: 0.5786881538171879
Energy: 0.49083195730650425
Energy: 0.5096628187169545
Energy: 0.4824864935276333
Energy: 0.509662818717477
Energy: 0.49230269737146776
Energy: 0.5820583577382172
Energy: 0.4739534211211222
Energy: 0.5820583577361745
Energy: 0.4894677165972238
Energy: 0.5788583783290798
Energy: 0.5156468790184436
Energy: 0.5788583783296023
Energy: 0.4811985511142144
Energy: 0.5832790684871515
Energy: 0.4811173730745571
Energy: 0.5832790684866289
Energy: 0.4777870898829487
Energy: 0.5735882535667475
Energy: 0.4756506194595689
Energy: 0.573588253566225
Energy: 0.47108485613264045
Energy: 0.5060078649304787
Energy: 0.4685334829609321
Energy: 0.5060078649304787
Energy: 0.49037822434785705
Energy: 0.5788143030776518
Energy: 0.4772792744034513
Energy: 0.578814303079742
Energy: 0.4900032241033507
Energy: 0.5172453607084605
Energy: 0.48707548263971134
Energy: 0.5172453607074153
Energy: 0.4788091323194833
Energy: 0.5705688188973947
Energy: 0.4922863338485481
Energy: 0.5705688188963496
Energy: 0.4789405648032028
Energy: 0.48181285424618187
Energy: 0.6066882377814423
Energy: 0.48181285424983966
Energy: 0.5053128616628306
Energy: 0.5703374795280113
Energy: 0.4771166238492114
Energy: 0.5703374795285338
Energy: 0.4703653915113568
Energy: 0.5324745580320605
Energy: 0.6048398808059696
Energy: 0.5324745580331054
Energy: 0.5485618351223335
Energy: 0.5080536597206254
Energy: 0.4762544905023646
Energy: 0.5080536597295088
Energy: 0.4762818470889516
Energy: 0.4817461985117629
Energy: 0.6241978010997978
Energy: 0.4817461985102428
Energy: 0.6746008316602933
Energy: 0.47829165663068723
Energy: 0.4879113787215669
Energy: 0.4782916566301647
Energy: 0.4890615018680795
Energy: 0.5331087650968372
Energy: 0.6408114206707188
Energy: 0.5331087650947471
Energy: 0.5373304537577163
Energy: 0.5742260255026177
Energy: 0.4775333186509716
Energy: 0.5742260255020952
Energy: 0.4763160836296607
Energy: 0.5101963418585492
Energy: 0.5524078343877511
Energy: 0.5101963418585492
Energy: 0.5296866393441372
Energy: 0.5326766808601492
Energy: 0.4714550628774656
Energy: 0.5326766808596266
Energy: 0.4788082692529482
Energy: 0.5172889573557512
Energy: 0.5050884574039657
Energy: 0.5172889573552286
Energy: 0.5452381251869683
Energy: 0.5786953645006717
Energy: 0.48022718428245315
Energy: 0.5786953645027618
Energy: 0.4952149412451101
Energy: 0.5707210325512639
Energy: 0.49362259538589415
Energy: 0.5707210325517865
Energy: 0.4871824179965737
Energy: 0.5168295214522691
Energy: 0.4843415662230459
Energy: 0.516829521451224
Energy: 0.4789341027835143
Energy: 0.5789498206595062
Energy: 0.5176098556261641
Energy: 0.5789498206605511
Energy: 0.47698176525644587
Energy: 0.5155174864459453
Energy: 0.4706735361256747
Energy: 0.5155174864443777
Energy: 0.47819785355455857
Energy: 0.5731564683219443
Energy: 0.47689524159178803
Energy: 0.5731564683261247
Energy: 0.4801785938185418
Energy: 0.5838012631230886
Energy: 0.5593167247403209
Energy: 0.5838012631236111
Energy: 0.5130451566097497
Energy: 0.5786172831998339
Energy: 0.4831553579580726
Energy: 0.5786172832003564
Energy: 0.47315109622331647
Energy: 0.5331831013327387
Energy: 0.5036756016241607
Energy: 0.5331831013348288
Energy: 0.5132083323853103
Energy: 0.5102892506546344
Energy: 0.4898351162048206
Energy: 0.5102892506556792
Energy: 0.47748585467785554
Energy: 0.5808461446322497
Energy: 0.5137638043234586
Energy: 0.5808461446306821
Energy: 0.6101680331026349
Energy: 0.5184501934970843
Energy: 0.4778845564685856
Energy: 0.5184501934976068

minimum gb energy = 0.4685334829609321 eV
minimum distance =  2.58028207455408 Angstroms
sigma value = 89


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

Energy: 0.5229077570981537
Energy: 0.4465477602515516
Energy: 0.8151924134080241
Energy: 0.4465477602515516
Energy: 0.534445682514333
Energy: 0.44628393954384954
Energy: 0.4521498821927808
Energy: 0.44628393954384954
Energy: 0.4510509367391662
Energy: 0.6449847446241048
Energy: 0.6131381111130234
Energy: 0.6449847446241048
Energy: 0.49919847723828287
Energy: 0.4660916567447769
Energy: 0.4507829460581328
Energy: 0.4660916567447769
Energy: 0.43510107293666794
Energy: 0.4699895721668296
Energy: 0.6485662335241325
Energy: 0.4699895721668296
Energy: 0.43491091167150464
Energy: 0.425454131453711
Energy: 0.42545365926193657
Energy: 0.425454131453711
Energy: 0.45305030415407427
Energy: 0.5083531656976958
Energy: 0.4254619392009663
Energy: 0.5083531656976958
Energy: 0.4488099352168094
Energy: 0.5066927956790593
Energy: 0.45072626660708826
Energy: 0.506692795677692
Energy: 0.45065510313755863
Energy: 0.4691739440177043
Energy: 0.4691914755620208
Energy: 0.46917394401633705
Energy: 0.466326738178003
Energy: 0.4681773120059547
Energy: 0.4351390642013095
Energy: 0.468177312217784
Energy: 0.5229073199879025
Energy: 0.4412913866656045
Energy: 0.4348456864584846
Energy: 0.4412913866656045
Energy: 0.5229892082777835
Energy: 0.5063940120991497
Energy: 0.45227913488011995
Energy: 0.5063940120991497
Energy: 0.45064559632450574
Energy: 0.42575867888552665
Energy: 0.45885082766875257
Energy: 0.42575867888552665
Energy: 0.450981468902443
Energy: 0.4687206035136059
Energy: 0.4509409918667539
Energy: 0.4687206035149732
Energy: 0.45261290557031314
Energy: 0.42615618173429903
Energy: 0.4511381586229964
Energy: 0.4261561817356662

minimum gb energy = 0.42545365926193657 eV
minimum distance =  2.58659746789118 Angstroms
sigma value = 13


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

Energy: 0.4443614115927537
Energy: 0.42956075581171477
Energy: 0.5747954708123023
Energy: 0.4295607558145801
Energy: 0.6141462846182187
Energy: 0.44020969087879547
Energy: 0.4287609414866702
Energy: 0.44020969088853745
Energy: 0.4294281277534918
Energy: 0.4945457436602531
Energy: 0.5219230574306071
Energy: 0.4945457436573878
Energy: 0.4282835953622037
Energy: 0.44124261297911843
Energy: 0.42584030119063054
Energy: 0.44124261298141065
Energy: 0.4354318961519666
Energy: 0.4950301957589093
Energy: 0.47100674217338534
Energy: 0.49503019575776314
Energy: 0.4278253422472135
Energy: 0.44062229810570713
Energy: 0.4341636323830561
Energy: 0.4406222981068532
Energy: 0.4351969081592752
Energy: 0.49901494562888205
Energy: 0.6377035699618595
Energy: 0.49901494562658977
Energy: 0.42900196524611606
Energy: 0.5047632114964644
Energy: 0.43431288668839446
Energy: 0.5047632114999028
Energy: 0.4351251468486404
Energy: 0.4608274813334967
Energy: 0.5388083220274571
Energy: 0.4608274813317775
Energy: 0.5078397270756134
Energy: 0.5048156080911052
Energy: 0.4254556272307048
Energy: 0.504815608090532
Energy: 0.4357720600219222
Energy: 0.47134445834791794
Energy: 0.42758112900464396
Energy: 0.47134445835250244
Energy: 0.5664923269998868
Energy: 0.4700866668260665
Energy: 0.4314581089050629
Energy: 0.47008666678881755
Energy: 0.4511970266848416
Energy: 0.4383188797296875
Energy: 0.44521501808136
Energy: 0.4383188805694314
Energy: 0.5704456972823884
Energy: 0.4699949804013715
Energy: 0.4316986988071869
Energy: 0.46999498040480997
Energy: 0.43587119493864285
Energy: 0.5382531373025335
Energy: 0.43479796975470697
Energy: 0.5382531373025335
Energy: 0.42721916431847323
Energy: 0.47004344160315426
Energy: 0.4245318875551905
Energy: 0.4700434416025812
Energy: 0.4353874963198411
Energy: 0.45722016231434853
Energy: 0.4238697143783191
Energy: 0.45722016231835994
Energy: 0.44503329174001416
Energy: 0.4596005446333034
Energy: 0.4329265798657828
Energy: 0.4596005446373148
Energy: 0.4347681367625292
Energy: 0.4991379394366167
Energy: 0.4326737215004079
Energy: 0.49913793943890894
Energy: 0.4352348180475692
Energy: 0.4987152032604451
Energy: 0.4327925180884824
Energy: 0.4987152032587259
Energy: 0.4450049624403375
Energy: 0.4595950835651897
Energy: 0.4327120475104644
Energy: 0.4595950835669089
Energy: 0.4352153051073447
Energy: 0.4572598497105548
Energy: 0.42407507075826933
Energy: 0.45725984970998174
Energy: 0.4270791517685472
Energy: 0.47010606225942314
Energy: 0.42403052855555734
Energy: 0.4701060622611423
Energy: 0.43548449680005435
Energy: 0.5385580317255665
Energy: 0.43236880411656015
Energy: 0.5385580317290047
Energy: 0.5705346897017827
Energy: 0.4700993298241548
Energy: 0.4300006945936462
Energy: 0.4700993298218626
Energy: 0.4511267919797503
Energy: 0.43859172558614345
Energy: 0.42838189404529997
Energy: 0.4385917255844243
Energy: 0.5661218317401806
Energy: 0.46948507614685464
Energy: 0.43005355640750925
Energy: 0.4694850761508661
Energy: 0.43522852171816084
Energy: 0.47120400847963745
Energy: 0.4255641027529756
Energy: 0.47120400847791827
Energy: 0.5078696442872447
Energy: 0.5052050942641717
Energy: 0.42543360512956935
Energy: 0.5052050942641717
Energy: 0.4354414541635121
Energy: 0.460696446190136
Energy: 0.5030766040772222
Energy: 0.460696446190136
Energy: 0.4286567017546347
Energy: 0.5061788620205185
Energy: 0.4341563793764224
Energy: 0.5061788620193725
Energy: 0.43507424929378624
Energy: 0.49914201973710975
Energy: 0.5786441737681526
Energy: 0.4991420197451326
Energy: 0.42770460195530957
Energy: 0.4402472000775944
Energy: 0.43425455755306314
Energy: 0.4402472000770213
Energy: 0.435454994071255
Energy: 0.4953433560288265
Energy: 0.5553781050983833
Energy: 0.49534335599733414
Energy: 0.4280281192110128
Energy: 0.44128183368679774
Energy: 0.4255451674968094
Energy: 0.4412818336879439

minimum gb energy = 0.4238697143783191 eV
minimum distance =  2.59523091934406 Angstroms
sigma value = 37


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

Energy: 0.4095558267930772
Energy: 0.40981933438521995
Energy: 0.473646111831536
Energy: 0.40981933438423407
Energy: 0.6491281992823317
Energy: 0.5360529963310646
Energy: 0.3946260784271866
Energy: 0.5360529963310646
Energy: 0.38841613394286256
Energy: 0.645893208977957
Energy: 0.7303366627107951
Energy: 0.645893208977957
Energy: 0.3888330244632374
Energy: 0.536364148466363
Energy: 0.3945255053824479
Energy: 0.536364148466363
Energy: 0.39355589201816177
Energy: 0.40963349266838395
Energy: 0.4655186666565661
Energy: 0.4096334926693699
Energy: 0.39173696888598836
Energy: 0.5359743093419507
Energy: 0.3903927762281991
Energy: 0.5359743093419507
Energy: 0.394468581184213
Energy: 0.6645523735318127
Energy: 0.5157850652377156
Energy: 0.6645523735318127
Energy: 0.39360268650678226
Energy: 0.4099109634434061
Energy: 0.4114012346106309
Energy: 0.4099109634434061
Energy: 0.39346096415026477
Energy: 0.535918236699177
Energy: 0.5810263199705042
Energy: 0.535918236699177
Energy: 0.5528692053096967
Energy: 0.6406836574013808
Energy: 0.3903680090383217
Energy: 0.6406836574013808
Energy: 0.39419008444674547
Energy: 0.6594225170506118
Energy: 0.3886637628887357
Energy: 0.6594225170506118
Energy: 0.5121979451293424
Energy: 0.40944705597958303
Energy: 0.39455904096433764
Energy: 0.40944705598056896
Energy: 0.38852798078108686
Energy: 0.5359432866295494
Energy: 0.39141796666463446
Energy: 0.5359432866295494
Energy: 0.515908422246319
Energy: 0.6601233672120694
Energy: 0.3935949694901484
Energy: 0.6601233672120694
Energy: 0.40967462578845737
Energy: 0.43214351611005725
Energy: 0.3935888449477874
Energy: 0.43214351611005725
Energy: 0.40975897791661653
Energy: 0.5358451017389102
Energy: 0.39458751966067007
Energy: 0.5358451017379467
Energy: 0.3885705228289639
Energy: 0.45400321883298117
Energy: 0.40433058282039724
Energy: 0.45400321883298117
Energy: 0.38876830222689934
Energy: 0.6602322160462122
Energy: 0.39361536035859773
Energy: 0.6602322160462122
Energy: 0.39452741203253977
Energy: 0.4095221621142684
Energy: 0.39356706748188136
Energy: 0.4095221621142684
Energy: 0.39378077830327013
Energy: 0.535924793315088
Energy: 0.38852976014662816
Energy: 0.535924793315088

minimum gb energy = 0.38841613394286256 eV
minimum distance =  2.57840648131469 Angstroms
sigma value = 25


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

Energy: 0.3936774216370086
Energy: 0.5805333007978845
Energy: 0.5495982015224744
Energy: 0.5805333007986545
Energy: 0.6253435819667998
Energy: 0.586181943025069
Energy: 0.37326172261653495
Energy: 0.586181943025069
Energy: 0.36891810733994607
Energy: 0.3691803589464115
Energy: 0.6978986723972103
Energy: 0.36918035894487167
Energy: 0.4472464707399002
Energy: 0.58513574574817
Energy: 0.37326810598422355
Energy: 0.58513574574817
Energy: 0.37321549958017053
Energy: 0.4885658002473039
Energy: 0.41780425052673403
Energy: 0.4885658002473039
Energy: 0.35940199586423155
Energy: 0.5672446485488633
Energy: 0.37360247822057735
Energy: 0.5672446485496332
Energy: 0.37349955534123047
Energy: 0.36931244478679776
Energy: 0.5257885118070704
Energy: 0.36931244478679776
Energy: 0.36127792444265
Energy: 0.5002002117207092
Energy: 0.3699772737664572
Energy: 0.5002002117199393
Energy: 0.37274725452526275
Energy: 0.5869846100095537
Energy: 0.5673226157272098
Energy: 0.5869846100095537
Energy: 0.36317663343109136
Energy: 0.580551110354288
Energy: 0.3945362153193108
Energy: 0.580551110354288
Energy: 0.3738343258996581
Energy: 0.47736244084106827
Energy: 0.5337385075810916
Energy: 0.47736244084183815
Energy: 0.49347820429830885
Energy: 0.5805930796046236
Energy: 0.3700161824435392
Energy: 0.5805930796053934
Energy: 0.3729479620734774
Energy: 0.584637924554884
Energy: 0.49410463659236753
Energy: 0.584637924554884
Energy: 0.4698901862853647
Energy: 0.5605897655230454
Energy: 0.37356991096957454
Energy: 0.560589765526125
Energy: 0.3734539482573755
Energy: 0.47736704632197635
Energy: 0.35921947434644147
Energy: 0.47736704632351606
Energy: 0.46835053032463525
Energy: 0.6014773519796794
Energy: 0.3722482719809628
Energy: 0.6014773519789094
Energy: 0.3724976765010604
Energy: 0.500862809162984
Energy: 0.36166495436224133
Energy: 0.500862809162984
Energy: 0.45963136451881986
Energy: 0.4880408644053861
Energy: 0.37370432920360586
Energy: 0.4880408644038463
Energy: 0.397217958991962
Energy: 0.4775020709199595
Energy: 0.36297010277280717
Energy: 0.47750207091918967
Energy: 0.5336914079344264
Energy: 0.5084216074456384
Energy: 0.373005496035734
Energy: 0.5084216074464083
Energy: 0.37273090880001236
Energy: 0.469787695874869
Energy: 0.3687865255186105
Energy: 0.4697876958756389
Energy: 0.36896951396740146
Energy: 0.5850326908153867
Energy: 0.37367828075050996
Energy: 0.5850326908153867
Energy: 0.3739033963930175
Energy: 0.49657736450929524
Energy: 0.4687731239069667
Energy: 0.49657736450929524
Energy: 0.35931541960516045
Energy: 0.5996638164497283
Energy: 0.37264499648820437
Energy: 0.5996638164497283
Energy: 0.3725564033909551
Energy: 0.6233071931613174
Energy: 0.46846134101155396
Energy: 0.6233071931613174
Energy: 0.36254418600186
Energy: 0.5011021631767226
Energy: 0.36905139299769874
Energy: 0.5011021631767226

minimum gb energy = 0.35921947434644147 eV
minimum distance =  2.56443503053299 Angstroms
sigma value = 41


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

Energy: 0.48295058345826497
Energy: 0.5339439116458173
Energy: 0.7910215395484239
Energy: 0.5339439116458173
Energy: 0.6131019076263229
Energy: 0.5261051268521656
Energy: 0.34239909439065985
Energy: 0.5261051268515343
Energy: 0.35296155890808784
Energy: 0.5205692357862216
Energy: 0.6692682348820129
Energy: 0.5205692357868529
Energy: 0.4741768985398514
Energy: 0.34896432117128945
Energy: 0.3423369108301819
Energy: 0.3489643213359697
Energy: 0.33914046212876886
Energy: 0.5181938306960328
Energy: 0.3816452893704665
Energy: 0.5181938306954017
Energy: 0.4053890079913922
Energy: 0.413014768501825
Energy: 0.3423262360555125
Energy: 0.4130147684993003
Energy: 0.34155644090677334
Energy: 0.43899386510721733
Energy: 0.37906492395697655
Energy: 0.4389938651091109
Energy: 0.33403641384494337
Energy: 0.4447857470142306
Energy: 0.33981160211959544
Energy: 0.44478574701359946
Energy: 0.3438933423061257
Energy: 0.5508070267595406
Energy: 0.5202270570483372
Energy: 0.5508070267601719
Energy: 0.33605183785116927
Energy: 0.34403825444265285
Energy: 0.3535777380014347
Energy: 0.3440382544451775
Energy: 0.34155922060987853
Energy: 0.5262578758289352
Energy: 0.5405905671872642
Energy: 0.5262578758289352
Energy: 0.3364518193563313
Energy: 0.41991087064808413
Energy: 0.48089135232785846
Energy: 0.41991087064303473
Energy: 0.34389243757866383
Energy: 0.5460820237373949
Energy: 0.571881046754647
Energy: 0.5460820237373949
Energy: 0.44232610360774405
Energy: 0.5556052539295275
Energy: 0.353534138487451
Energy: 0.5556052539282651
Energy: 0.34160902251225134
Energy: 0.5252240172466339
Energy: 0.4733667875332055
Energy: 0.5252240172460027
Energy: 0.430825290488641
Energy: 0.48387826200912737
Energy: 0.3397483540149192
Energy: 0.48387826200786505
Energy: 0.34388525895171884
Energy: 0.5457106131384029
Energy: 0.441367463537256
Energy: 0.5457106131377717
Energy: 0.4283733989997581
Energy: 0.5596744563225379
Energy: 0.34229872427570296
Energy: 0.5596744563238002
Energy: 0.3415820309960202
Energy: 0.4462587066431162
Energy: 0.3341033273680487
Energy: 0.4462587066437474
Energy: 0.42435385639683443
Energy: 0.4651288136899217
Energy: 0.34526591142815954
Energy: 0.4651288136886593
Energy: 0.35531635566129977
Energy: 0.5460155894038221
Energy: 0.33801864603410264
Energy: 0.5460155894038221
Energy: 0.5404784994337613
Energy: 0.5685497185849867
Energy: 0.3422750313110525
Energy: 0.5685497185856179
Energy: 0.4814381819274765
Energy: 0.4467028581392978
Energy: 0.33633386687252337
Energy: 0.44670285813992894
Energy: 0.48130312424670085
Energy: 0.4599671888891886
Energy: 0.3449882182562887
Energy: 0.4599671888898197
Energy: 0.3553341164526896
Energy: 0.5672606734691632
Energy: 0.3397914241520782
Energy: 0.5672606734697944
Energy: 0.4734026087025598
Energy: 0.5598547459361812
Energy: 0.3423281913274837
Energy: 0.5598547459368124
Energy: 0.3415963103433972
Energy: 0.4180718041320726
Energy: 0.43083703647419136
Energy: 0.4180718041320726
Energy: 0.3397929412460475
Energy: 0.5438659442128798
Energy: 0.3450360311058293
Energy: 0.5438659442128798
Energy: 0.3441155520993491
Energy: 0.5673347035217783
Energy: 0.42821897932471725
Energy: 0.5673347035217783
Energy: 0.33420234317851005
Energy: 0.5647910764046693
Energy: 0.3445090253359489
Energy: 0.5647910764053006
Energy: 0.3437055256635952
Energy: 0.4650561179802277
Energy: 0.4244458324499273
Energy: 0.46505611797959656
Energy: 0.3365450522451963
Energy: 0.544009530193047
Energy: 0.358001665562355
Energy: 0.5440095301924157

minimum gb energy = 0.33403641384494337 eV
minimum distance =  2.5471929757849 Angstroms
sigma value = 15


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

Energy: 0.4444780918390625
Energy: 0.5097589696031969
Energy: 0.46677244181649197
Energy: 0.5097589696015928
Energy: 0.5992140254716025
Energy: 0.4997522252155087
Energy: 0.3264119591145832
Energy: 0.49975222521497403
Energy: 0.3380260131941879
Energy: 0.4896837916453486
Energy: 0.43654352317072737
Energy: 0.4896837916469527
Energy: 0.5991764804133941
Energy: 0.4981547097352458
Energy: 0.3266349539252633
Energy: 0.498154709734711
Energy: 0.3244567485572655
Energy: 0.5185280762891656
Energy: 0.3529880230133632
Energy: 0.5185280762875615
Energy: 0.42946606200465304
Energy: 0.5004925308290996
Energy: 0.32638965373461004
Energy: 0.5004925308285648
Energy: 0.32599829164329386
Energy: 0.3855568966236925
Energy: 0.35093667318467303
Energy: 0.38555689662422726
Energy: 0.37308948232777833
Energy: 0.38828185481540667
Energy: 0.3265286398309677
Energy: 0.3882818547897412
Energy: 0.32764247943846897
Energy: 0.5215576115718459
Energy: 0.47870543170880814
Energy: 0.5215576115691724
Energy: 0.3134535765970907
Energy: 0.5006100415421778
Energy: 0.32476698708262913
Energy: 0.5006100415427125
Energy: 0.32599171176304087
Energy: 0.503257462454738
Energy: 0.5010465147275774
Energy: 0.5032574624558075
Energy: 0.31476032126848963
Energy: 0.32608442892743733
Energy: 0.33857540705657063
Energy: 0.3260844289285067
Energy: 0.32773554074574945
Energy: 0.5162181384822622
Energy: 0.5620980594633823
Energy: 0.5162181384822622
Energy: 0.31473909142333306
Energy: 0.50869521761575
Energy: 0.44365645075476945
Energy: 0.5086952176146806
Energy: 0.3260173879671883
Energy: 0.49877470826859677
Energy: 0.5455471447277922
Energy: 0.4987747082669926
Energy: 0.4037666254072936
Energy: 0.3817786900263734
Energy: 0.33838797065869375
Energy: 0.38177869001300596
Energy: 0.3277046413387492
Energy: 0.5164905607477772
Energy: 0.515240762556857
Energy: 0.5164905607472424
Energy: 0.3972194060539616
Energy: 0.5149687638990176
Energy: 0.3250253153017206
Energy: 0.514968763900087
Energy: 0.3261433496891306
Energy: 0.49921522033770754
Energy: 0.429618648573813
Energy: 0.4992152203382422
Energy: 0.3949975844498443
Energy: 0.3833307561687393
Energy: 0.32644426043353436
Energy: 0.383330756169274
Energy: 0.3276852782264585
Energy: 0.4887308205300564
Energy: 0.3730336167330247
Energy: 0.4887308205284523
Energy: 0.3920340061211469
Energy: 0.5238876022394476
Energy: 0.3293869877552893
Energy: 0.523887602238913
Energy: 0.3261491274351252
Energy: 0.49944076259566145
Energy: 0.3133501573008442
Energy: 0.49944076259512676
Energy: 0.5004859996131877
Energy: 0.42469737269381874
Energy: 0.32638352930387854
Energy: 0.4246973726948881
Energy: 0.33971865768513093
Energy: 0.5120221258858273
Energy: 0.31491341407357926
Energy: 0.512022125886362
Energy: 0.4957470700193396
Energy: 0.5190344220662237
Energy: 0.3294551283958675
Energy: 0.5190344220667583
Energy: 0.44393376084053654
Energy: 0.5122071313569966
Energy: 0.3149046218296601
Energy: 0.5122071313564619
Energy: 0.5454715212441846
Energy: 0.4221307771528928
Energy: 0.3264049824043841
Energy: 0.42213077715235814
Energy: 0.33969705798768574
Energy: 0.533125392764189
Energy: 0.317114136371018
Energy: 0.5331253927647237
Energy: 0.4344217689003179
Energy: 0.5141925049382273
Energy: 0.3292722119480278
Energy: 0.514192504938762
Energy: 0.32599970430163633
Energy: 0.5183828197449918
Energy: 0.3975690089001828
Energy: 0.5183828197465957
Energy: 0.4297643562003939
Energy: 0.4980583885805202
Energy: 0.32641150946239383
Energy: 0.49805838857945084
Energy: 0.3276282100358374
Energy: 0.5328947976944898
Energy: 0.3952565242212909
Energy: 0.5328947976955591
Energy: 0.31689848757130973
Energy: 0.5103149678574185
Energy: 0.32935702331400113
Energy: 0.5103149678568837
Energy: 0.32381408750427143
Energy: 0.518401205072295
Energy: 0.39201286576134625
Energy: 0.518401205072295
Energy: 0.31351096249249627
Energy: 0.49822398550681574
Energy: 0.32795223753739317
Energy: 0.49822398550521163
Energy: 0.3274820013682011
Energy: 0.5330400027739193
Energy: 0.4975050827520327
Energy: 0.5330400027717804

minimum gb energy = 0.3133501573008442 eV
minimum distance =  2.58446643878857 Angstroms
sigma value = 85


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

Energy: 0.4506904479527835
Energy: 0.4937442509221767
Energy: 0.7683431083813154
Energy: 0.4937442509193942
Energy: 0.608459836857572
Energy: 0.47217915669983246
Energy: 0.29990371551659956
Energy: 0.47217915670075994
Energy: 0.43216037672576063
Energy: 0.36937556936818744
Energy: 0.3904652732836201
Energy: 0.36937556936865124
Energy: 0.5714088002552579
Energy: 0.42499392553348453
Energy: 0.2997690004756995
Energy: 0.42499392553070214
Energy: 0.3410490746686823
Energy: 0.35096116052715715
Energy: 0.37114061507539736
Energy: 0.3509611605313309
Energy: 0.540584662173252
Energy: 0.38958635358837224
Energy: 0.2998026212131413
Energy: 0.38958635358698107
Energy: 0.3240098426307214
Energy: 0.36819757410707527
Energy: 0.3695101646966463
Energy: 0.3681975741066115
Energy: 0.4109504036847566
Energy: 0.4235635166177688
Energy: 0.3041165030215716
Energy: 0.42356351661823255
Energy: 0.303177951807406
Energy: 0.35017717088500133
Energy: 0.4525689529639815
Energy: 0.350177170885465
Energy: 0.35886828590317116
Energy: 0.3640141837890656
Energy: 0.3242555158707126
Energy: 0.36401418378813816
Energy: 0.3007005235039013
Energy: 0.4066362784742296
Energy: 0.4736996077267458
Energy: 0.4066362784779185
Energy: 0.30883359330979576
Energy: 0.48085019023226827
Energy: 0.3412890123467839
Energy: 0.4808501902313408
Energy: 0.29948620626899963
Energy: 0.3062579297929664
Energy: 0.5351974653556139
Energy: 0.3062579297943576
Energy: 0.28616920305267624
Energy: 0.3908096426518741
Energy: 0.4297607655027471
Energy: 0.39080964265141044
Energy: 0.30076427431046016
Energy: 0.4038035727678506
Energy: 0.5502930750701513
Energy: 0.4038035727673868
Energy: 0.2853603786961375
Energy: 0.48689647892313404
Energy: 0.4194466081097884
Energy: 0.48689647892359783
Energy: 0.29959205683917656
Energy: 0.30713023942704437
Energy: 0.5479931436857708
Energy: 0.3071302394251894
Energy: 0.36118578974180615
Energy: 0.39088928284784696
Energy: 0.42974751790196586
Energy: 0.3908892828469195
Energy: 0.30082743522983574
Energy: 0.40411459312254044
Energy: 0.5085426042150404
Energy: 0.40411459312161296
Energy: 0.35852928917094934
Energy: 0.4864823166114294
Energy: 0.3411221650150074
Energy: 0.4864823166114294
Energy: 0.3001530051192298
Energy: 0.3114874576375101
Energy: 0.4868281756058233
Energy: 0.3114874576412201
Energy: 0.3809671181051183
Energy: 0.4034293834226831
Energy: 0.32411579647296934
Energy: 0.40342938342314677
Energy: 0.30516410254243104
Energy: 0.40257549652936037
Energy: 0.4114135253795865
Energy: 0.40257549652936037
Energy: 0.3812716724378555
Energy: 0.4918492996963406
Energy: 0.3041335002118332
Energy: 0.49184929969680435
Energy: 0.32517464986345124
Energy: 0.3372161087829503
Energy: 0.38520252933511034
Energy: 0.3372161087801677
Energy: 0.4762699875783883
Energy: 0.4483437424978223
Energy: 0.30037693387169884
Energy: 0.44834374249967723
Energy: 0.3419784754090789
Energy: 0.4724630863546244
Energy: 0.3088877455099014
Energy: 0.47246308635230566
Energy: 0.47965381711449545
Energy: 0.49191022206517543
Energy: 0.3000547437308362
Energy: 0.49191022206517543
Energy: 0.4297410873725376
Energy: 0.45529823612983306
Energy: 0.2850193025367646
Energy: 0.45529823613215176
Energy: 0.5502777717256767
Energy: 0.4448759185338902
Energy: 0.3002540260070949
Energy: 0.444875918534354
Energy: 0.4483074631337805
Energy: 0.4900481576115318
Energy: 0.28515851848035334
Energy: 0.49004815761060433
Energy: 0.520978845233594
Energy: 0.4893497915981175
Energy: 0.2999169721531121
Energy: 0.48934979159997244
Energy: 0.42972992278168637
Energy: 0.3675570597633796
Energy: 0.2864876959263927
Energy: 0.3675570597962843
Energy: 0.5086347780531052
Energy: 0.402277339488186
Energy: 0.3002058049151263
Energy: 0.40227733948679484
Energy: 0.3419434466136429
Energy: 0.4908016599887946
Energy: 0.3583754451253574
Energy: 0.4908016599887946
Energy: 0.418334933360252
Energy: 0.48028292260164696
Energy: 0.3012465227863727
Energy: 0.4802829226035019
Energy: 0.3250859103117431
Energy: 0.3587160369680797
Energy: 0.3806679655866869
Energy: 0.35871603696900717
Energy: 0.41065050583958523
Energy: 0.4025500484005549
Energy: 0.3034296000067029
Energy: 0.4025500483991637
Energy: 0.30525773587218563
Energy: 0.4908828153946184
Energy: 0.3809573732456407
Energy: 0.4908828153932272
Energy: 0.3132913984344042
Energy: 0.4764166176466192
Energy: 0.32669050843565395
Energy: 0.4764166176461555
Energy: 0.2997181716656156
Energy: 0.4046144594534128
Energy: 0.4763360184879419
Energy: 0.40461445945294905
Energy: 0.30877940500007023
Energy: 0.47237535097661276
Energy: 0.3435326328009819
Energy: 0.47237535097568534
Energy: 0.30080852475868547
Energy: 0.4904927391747297
Energy: 0.47982233975143534
Energy: 0.4904927391770484

minimum gb energy = 0.2850193025367646 eV
minimum distance =  2.58047966892643 Angstroms
sigma value = 113


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

Energy: 0.011810738519548418
Energy: 0.012391243239115068
Energy: 0.7969494838355671
Energy: 0.012391243238065366
Energy: 0.6289015868902468
Energy: 0.18412394784939576
Energy: 0.18452908271451943
Energy: 0.18412394784975228
Energy: 0.011810738519548418
Energy: 0.012391243238758565
Energy: 0.7969494838376665
Energy: 0.012391243237708864
Energy: 0.6289015868902468
Energy: 0.18412394784975228
Energy: 0.18452908271523244
Energy: 0.18412394785008895
Energy: 0.011810738519548418
Energy: 0.012391243239115068
Energy: 0.7969494838366168
Energy: 0.012391243238402063
Energy: 0.62890158688991
Energy: 0.18412394784939576
Energy: 0.1845290827148759
Energy: 0.18412394785044547

minimum gb energy = 0.011810738519548418 eV
minimum distance =  2.832341436596 Angstroms
sigma value = 1