Model name: model_name=EAM_Dynamo_MendelevFangYe_2015_AlSm__MO_338600200739_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.040926471352577
cohesive_energy=3.905455928316686
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.96918578166148e-19, 3.6131165926324195e-19, 4.0193484781831197e-19, 4.33433640442752e-19, 4.596692828245019e-19, 4.818321922026239e-19, 5.00662574182026e-19, 5.1677406241352995e-19, 5.307322252489379e-19, 5.4316191157551e-19, 5.5460465709553795e-19, 5.654401776712799e-19, 5.75812669199796e-19, 5.855138487186659e-19, 5.942473135506e-19, 6.01819200322884e-19, 6.081686263234259e-19, 6.133404524979779e-19, 6.17440422504384e-19, 6.20590301766828e-19, 6.229054470029579e-19, 6.244771822809119e-19, 6.25382412079122e-19, 6.256740082265099e-19, 6.2536158378288e-19, 6.243490081501919e-19, 6.225033006678239e-19, 6.1964982408267e-19, 6.1557228454914e-19, 6.10051183868376e-19, 6.02894260844298e-19, 5.93920469517264e-19, 5.82923129101488e-19, 5.69623460862654e-19, 5.5358407057967995e-19, 5.34091989650436e-19, 5.099455855994219e-19, 4.79092470158484e-19, 4.37951778550632e-19, 3.80162869538886e-19, 2.9442238697037597e-19, 1.64384924825034e-19, -4.05220912094646e-20, -3.78152137863216e-19, -9.60506494259634e-19, -2.0149774437500997e-18, -4.02237659202138e-18, -8.052619871315699e-18, -1.6665841346867998e-17, -3.65563836049878e-17, -8.72309874911202e-17, -2.34419269850442e-16, -7.497898255325879e-16, -3.1512731561155797e-15]
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: 0.012053898004724978
Energy: 0.23410366808560434
Energy: 0.01241499725867758
Energy: 0.013855823675411298
Energy: 0.23424216840606632
Energy: 0.012402018675944256
Energy: 0.23410366808513028
Energy: 0.06320651637884855
Energy: 0.06319983972431936
Energy: 0.06341085217880915
Energy: 0.06286460363031839
Energy: 0.06320734020346559
Energy: 0.012414997258928563
Energy: 0.06319983972431936
Energy: 0.06326479445791026
Energy: 0.012445758807034543
Energy: 0.06303305811689136
Energy: 0.06341888601011814
Energy: 0.013855823675411298
Energy: 0.06341085217635511
Energy: 0.01244575880753651
Energy: 0.012325756201797237
Energy: 0.06308311836020279
Energy: 0.012344142606121142
Energy: 0.2342421684058153
Energy: 0.06286460362934235
Energy: 0.0630330581163894
Energy: 0.06308311836020279
Energy: 0.06293208600013814
Energy: 0.06316468089372615
Energy: 0.0124020186783983
Energy: 0.06320734020321463
Energy: 0.06341888600939308
Energy: 0.012344142607097182
Energy: 0.06316468089473007
Energy: 0.012469348248558762

minimum gb energy = 0.012053898004724978 eV
minimum distance =  2.85195065557855 Angstroms
sigma value = 1


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

Energy: 0.6899962021254153
Energy: 0.7669451016271721
Energy: 0.5266382530339275
Energy: 0.6886697521027639
Energy: 0.7771384250442003
Energy: 0.5277882377895368
Energy: 0.6656348770489846
Energy: 0.5242666528024353
Energy: 0.5246647468815857
Energy: 0.5221588096219971
Energy: 0.5388880800596773
Energy: 0.5144850007216548
Energy: 0.6701595879240927
Energy: 0.5126722950027051
Energy: 0.5020709844114286
Energy: 0.5215825801941808
Energy: 0.5143600765426322
Energy: 0.493015247205483
Energy: 0.7522586052131834
Energy: 0.5023762650237827
Energy: 0.49919859373683845
Energy: 0.4996232016079192
Energy: 0.502273389315197
Energy: 0.4992698066748308
Energy: 0.6711950910166488
Energy: 0.5277975505124893
Energy: 0.5291532446870069
Energy: 0.5266584667782115
Energy: 0.5281144618615632
Energy: 0.5281907835232948
Energy: 0.6577392759072674
Energy: 0.5172781355233689
Energy: 0.5186709546629564
Energy: 0.5163944996749721
Energy: 0.5160502146109315
Energy: 0.5177918261114682
Energy: 0.6542429939181182
Energy: 0.5186477085183471
Energy: 0.5167745805401597
Energy: 0.5160272064657416
Energy: 0.5191112286190064
Energy: 0.5170029859241663
Energy: 0.6174765691484537
Energy: 0.524318838581257
Energy: 0.5237879949335084
Energy: 0.545585095871091
Energy: 0.5242488437924737
Energy: 0.5166402017643006
Energy: 0.536177219712914
Energy: 0.5171060838891183
Energy: 0.5172450788026709
Energy: 0.5375467046012117
Energy: 0.5217160899108119
Energy: 0.5181234509541794
Energy: 0.531904265274231
Energy: 0.5255895736996988
Energy: 0.5170193617434021
Energy: 0.5281333979809351
Energy: 0.524951769567916
Energy: 0.527268978363776
Energy: 0.582464617421902
Energy: 0.5044471603202819
Energy: 0.5049874267068278
Energy: 0.544997209046459
Energy: 0.5044581524060718
Energy: 0.4925773730169247
Energy: 0.5412588778697689
Energy: 0.49910461757810126
Energy: 0.4997673231281415
Energy: 0.5412681563451288
Energy: 0.5240457911615587
Energy: 0.5015587860674611
Energy: 0.5369048967998429
Energy: 0.5172650346969635
Energy: 0.5254997906821184
Energy: 0.5368336263722978
Energy: 0.521877000454405
Energy: 0.5252908843020289
Energy: 0.5444292587383178
Energy: 0.49928910133760596
Energy: 0.49938176881566765
Energy: 0.5321560216247578
Energy: 0.49885078515696746
Energy: 0.49216138114591923
Energy: 0.5322064911785253
Energy: 0.526366424533392
Energy: 0.5229309664265637
Energy: 0.5337850287086376
Energy: 0.5268101383264164
Energy: 0.5331919502209373
Energy: 0.5331610194482976
Energy: 0.5001050764846162
Energy: 0.5005354704261045
Energy: 0.5339178403103345
Energy: 0.5190437421348898
Energy: 0.5001667550428749
Energy: 0.5683049609128101
Energy: 0.5155802859875125
Energy: 0.5155401368015644
Energy: 0.5184785962984568
Energy: 0.5150510072723877
Energy: 0.4999440683597205
Energy: 0.5717081138879035
Energy: 0.5281475004129116
Energy: 0.5270997816780503
Energy: 0.540367293202642
Energy: 0.5292281151723781
Energy: 0.5271020444341366
Energy: 0.569026661203723
Energy: 0.5275356087313577
Energy: 0.5286644955794763
Energy: 0.5267764345675156
Energy: 0.5264109809727854
Energy: 0.5281380810316161
Energy: 0.6686738106687731
Energy: 0.5292023440978341
Energy: 0.527476175876953
Energy: 0.5288381054378835
Energy: 0.5274555091178758
Energy: 0.5267338747798558
Energy: 0.6923370036701711
Energy: 0.5004566032320918
Energy: 0.5049126085120776
Energy: 0.5046933219272975
Energy: 0.5283506902685495
Energy: 0.5047333244282354
Energy: 0.6933459424429574
Energy: 0.5123588245540086
Energy: 0.4999353147077927
Energy: 0.5173176457858631
Energy: 0.535905023097086
Energy: 0.5003051368608341
Energy: 0.7002038560107122
Energy: 0.53329556308648
Energy: 0.533440690438314
Energy: 0.5157283259799219
Energy: 0.5340839973891233
Energy: 0.5236761508862754

minimum gb energy = 0.49216138114591923 eV
minimum distance =  2.60550714173556 Angstroms
sigma value = 33


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

Energy: 0.8544993485504668
Energy: 0.5291233304132706
Energy: 0.5218081170594923
Energy: 0.5155474890527919
Energy: 0.7520695915877104
Energy: 0.531767499950279
Energy: 0.650444560429327
Energy: 0.5246386938905736
Energy: 0.5154753338404415
Energy: 0.5387949607753812
Energy: 0.5160227756366562
Energy: 0.5087406648583822
Energy: 0.6433544064299598
Energy: 0.5412596716982171
Energy: 0.5354059807798351
Energy: 0.5348164742332031
Energy: 0.5424798417408737
Energy: 0.5280642285375978
Energy: 0.6995900889817904
Energy: 0.5521889727736796
Energy: 0.5597851796401419
Energy: 0.5126550679374628
Energy: 0.5616993336682667
Energy: 0.5116253874300138
Energy: 0.6457709278220265
Energy: 0.5720641603220386
Energy: 0.5446546592767028
Energy: 0.532502297384942
Energy: 0.5704696270571253
Energy: 0.569374558066015
Energy: 0.6918974395804673
Energy: 0.5434601964525294
Energy: 0.5452704402238987
Energy: 0.5376750330783064
Energy: 0.5428703953920645
Energy: 0.5421624764148444
Energy: 0.6927947411398603
Energy: 0.5470222924039122
Energy: 0.5469732220816289
Energy: 0.5505696969798372
Energy: 0.5444866680256161
Energy: 0.5478553345663235
Energy: 0.6445988987704684
Energy: 0.533521109612976
Energy: 0.5340211433934554
Energy: 0.5651163633032968
Energy: 0.5339081132196184
Energy: 0.5384794486587364
Energy: 0.5621754600059604
Energy: 0.5344030594179383
Energy: 0.544057631758271
Energy: 0.5602848125816078
Energy: 0.5339437625432114
Energy: 0.5493331709662546
Energy: 0.5630226435026295
Energy: 0.5539279116249023
Energy: 0.5549707306615159
Energy: 0.5550953470928758
Energy: 0.5566275914822215
Energy: 0.5550319412459123
Energy: 0.6047588426071226
Energy: 0.48925118463170536
Energy: 0.489357972365215
Energy: 0.5562256132231166
Energy: 0.48976737629171446
Energy: 0.4897129296966125
Energy: 0.5676298751442308
Energy: 0.5147470731356704
Energy: 0.5225390316122731
Energy: 0.5670204433535367
Energy: 0.5329087120120056
Energy: 0.5301921667885642
Energy: 0.5685682524487923
Energy: 0.548650808453164
Energy: 0.5517327188719949
Energy: 0.5660340299566605
Energy: 0.5487208874953802
Energy: 0.5548135312652058
Energy: 0.6340826330964523
Energy: 0.512025871470803
Energy: 0.5114277158308682
Energy: 0.6130552044406719
Energy: 0.5120916611730381
Energy: 0.5378597990101249
Energy: 0.5846507108011397
Energy: 0.5585696236412446
Energy: 0.5726433852871085
Energy: 0.5748526865473371
Energy: 0.5599065932226001
Energy: 0.5719344744258228
Energy: 0.5857248664528215
Energy: 0.5424339218225678
Energy: 0.5425409639868118
Energy: 0.5457260785895821
Energy: 0.5425046336453808
Energy: 0.5455425945958755
Energy: 0.6048717337644224
Energy: 0.5428048093222749
Energy: 0.5427801052104714
Energy: 0.5408768676078768
Energy: 0.5425717219263074
Energy: 0.5384503487460979
Energy: 0.58977509072204
Energy: 0.5543479487225756
Energy: 0.5544274308112088
Energy: 0.5350977096229848
Energy: 0.5541652642985712
Energy: 0.5374772296309712
Energy: 0.5896940228938871
Energy: 0.5614547556508828
Energy: 0.5625715056474716
Energy: 0.5338823494179412
Energy: 0.5616974293613187
Energy: 0.554363457460429
Energy: 0.6092789246094131
Energy: 0.5567907556501934
Energy: 0.5572739412956821
Energy: 0.5537332286849697
Energy: 0.5572153277906947
Energy: 0.5477996198412008
Energy: 0.7603441927679416
Energy: 0.5286778866458307
Energy: 0.47148149725464106
Energy: 0.47141687978322083
Energy: 0.565609954871397
Energy: 0.47138687069242496
Energy: 0.543388907615462
Energy: 0.5272299533531818
Energy: 0.5275890856845034
Energy: 0.5144232828433886
Energy: 0.5290414256218845
Energy: 0.5224681133442696
Energy: 0.6129126655616921
Energy: 0.5604583448200949
Energy: 0.5606377274269267
Energy: 0.5406687842871256
Energy: 0.5599852235030374
Energy: 0.5572675971526564
Energy: 0.6990450889773691
Energy: 0.5904900264868671
Energy: 0.5969821252531197
Energy: 0.5114314772571716
Energy: 0.626940196631546
Energy: 0.5384508839836337
Energy: 0.6149338242567834
Energy: 0.5765939671562519
Energy: 0.5773687630996525
Energy: 0.5527072374423196
Energy: 0.5757687523984476
Energy: 0.5778336905803714
Energy: 0.6484238150419768
Energy: 0.5444187955124725
Energy: 0.5462909794915995
Energy: 0.5698006471334718
Energy: 0.5447433253027127
Energy: 0.5455870551531218
Energy: 0.7048504770683562
Energy: 0.5401879339394937
Energy: 0.5409410998790115
Energy: 0.545406702218469
Energy: 0.5455238128607537
Energy: 0.5488529548452663
Energy: 0.648548865701598
Energy: 0.5341684920420084
Energy: 0.5372865235064727
Energy: 0.5557502514711615
Energy: 0.5336315099233595
Energy: 0.5556605382628363
Energy: 0.5727728159588245
Energy: 0.5345769640753381
Energy: 0.534396761607198
Energy: 0.5599330060275313
Energy: 0.5338442014315199
Energy: 0.5530534888966938
Energy: 0.5729963981722281
Energy: 0.5570664469237171
Energy: 0.54833177346702
Energy: 0.5674382758174399
Energy: 0.5551202865244121
Energy: 0.5630078014957769
Energy: 0.609187001835939
Energy: 0.4889542500975049
Energy: 0.4888753141456612
Energy: 0.522113928503805
Energy: 0.4890177449458607
Energy: 0.4892507767650471
Energy: 0.5557445900702396
Energy: 0.5088585893976925
Energy: 0.48938927260141213
Energy: 0.5561261129871492
Energy: 0.5139648212015685
Energy: 0.5250100815866848
Energy: 0.5577540055604359
Energy: 0.558197406956509
Energy: 0.5541413049233141
Energy: 0.5579850592260157
Energy: 0.5478662571944624
Energy: 0.5562391844533981
Energy: 0.5604411930965626
Energy: 0.5117813131215465
Energy: 0.5117607058832241
Energy: 0.560399565019181
Energy: 0.5404178071960619
Energy: 0.5383593835401583
Energy: 0.5822271319405052
Energy: 0.5643555340887312
Energy: 0.5660773343632033
Energy: 0.5691156512623488
Energy: 0.5517338861676512
Energy: 0.5661631593982008
Energy: 0.5811076788424753
Energy: 0.5458169241833876
Energy: 0.5420905082623687
Energy: 0.5808301434662029
Energy: 0.5665080986702862
Energy: 0.5446727933945748
Energy: 0.5806298433229428
Energy: 0.5478316655472615
Energy: 0.5129781598424463
Energy: 0.5655490435060693
Energy: 0.5144407180937797
Energy: 0.5477980851537911
Energy: 0.5899004341831305
Energy: 0.5561411240528464
Energy: 0.523928845126882
Energy: 0.534501939969295
Energy: 0.529854781929259
Energy: 0.563619064960666
Energy: 0.5925856860091143
Energy: 0.5401858187189776
Energy: 0.53029514563302
Energy: 0.5345402386973556
Energy: 0.53507375573567
Energy: 0.537319351431956
Energy: 0.6459635620275684
Energy: 0.5453874563869079
Energy: 0.5355118278967546
Energy: 0.5398097863267233
Energy: 0.5478845550225026
Energy: 0.533783304677358
Energy: 0.5660535530122864
Energy: 0.5150788257886759
Energy: 0.48520058020348067
Energy: 0.4837142803734956
Energy: 0.5153768463605765
Energy: 0.4996681652740092

minimum gb energy = 0.47138687069242496 eV
minimum distance =  2.60063412049856 Angstroms
sigma value = 51


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

Energy: 0.7219691682656956
Energy: 0.5267644156126863
Energy: 0.5005595094277485
Energy: 0.5069448528216463
Energy: 0.7875066068806451
Energy: 0.5051729281018834
Energy: 0.5640612335467619
Energy: 0.5176409757763486
Energy: 0.49903470907271213
Energy: 0.5278638523147444
Energy: 0.5332631615735683
Energy: 0.498794495505867
Energy: 0.6683721084487662
Energy: 0.4987049804670201
Energy: 0.4965624477494235
Energy: 0.525211161154941
Energy: 0.518011387623407
Energy: 0.4852257380759925
Energy: 0.6601697702826185
Energy: 0.48518469253565627
Energy: 0.48482378529666675
Energy: 0.4895108857323389
Energy: 0.4846872500497554
Energy: 0.48945188933226474
Energy: 0.5632170773266284
Energy: 0.5280981916747635
Energy: 0.5286599040188464
Energy: 0.4892334855915813
Energy: 0.5273885836310191
Energy: 0.5276691503337217
Energy: 0.5639322207739628
Energy: 0.5131970787711927
Energy: 0.5136017522907754
Energy: 0.5327064630237582
Energy: 0.5291823758153372
Energy: 0.513121930115839
Energy: 0.5640434508916867
Energy: 0.5140631773296213
Energy: 0.5137170406527256
Energy: 0.5344143053741436
Energy: 0.488598699302519
Energy: 0.5286731155938166
Energy: 0.5995941131529463
Energy: 0.4742774517005922
Energy: 0.47376302424216915
Energy: 0.484314052199267
Energy: 0.4741177793188873
Energy: 0.47367778506295927
Energy: 0.5337069228507418
Energy: 0.47413420827060765
Energy: 0.4738221123289833
Energy: 0.5200432253308482
Energy: 0.47409062965948323
Energy: 0.4847207926355785
Energy: 0.5337750117154205
Energy: 0.5483679368844061
Energy: 0.49832500749269865
Energy: 0.517476154891892
Energy: 0.5216800281889598
Energy: 0.5189083259999178
Energy: 0.5460462069246119
Energy: 0.48373614540928667
Energy: 0.4840718009520427
Energy: 0.544313949295018
Energy: 0.48411065322912067
Energy: 0.4837101936477851
Energy: 0.5318954156906536
Energy: 0.5349687118909878
Energy: 0.5183316832421971
Energy: 0.5335664842331446
Energy: 0.51882241267154
Energy: 0.5180235017653215
Energy: 0.5314542871199119
Energy: 0.49020022933090895
Energy: 0.4904340054566186
Energy: 0.5170690396698548
Energy: 0.4907222996920595
Energy: 0.49072952865911934
Energy: 0.5322143116445379
Energy: 0.490957811673987
Energy: 0.49054244706003336
Energy: 0.5348356463478161
Energy: 0.4903845102631518
Energy: 0.4904436238957258
Energy: 0.5930267672516085
Energy: 0.49249881952882185
Energy: 0.4902103421901145
Energy: 0.5064614446493311
Energy: 0.51958642509238
Energy: 0.4900758656181722
Energy: 0.5953822023569973
Energy: 0.5034892406824681
Energy: 0.5034333041339066
Energy: 0.5032120630172882
Energy: 0.5186971948992497
Energy: 0.5051852127179475
Energy: 0.6286453189649699
Energy: 0.5189000381003371
Energy: 0.5195172526908872
Energy: 0.488804333586121
Energy: 0.534467934528387
Energy: 0.5025994256200066
Energy: 0.7302930907005094
Energy: 0.5142587827401225
Energy: 0.4909074688266601
Energy: 0.47401525891474366
Energy: 0.5137809933736365
Energy: 0.49081414556015784

minimum gb energy = 0.47367778506295927 eV
minimum distance =  2.67043582082406 Angstroms
sigma value = 19


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

Energy: 0.7322796207143072
Energy: 0.5608263887375128
Energy: 0.4847499197803163
Energy: 0.6249318484224873
Energy: 0.5603343917489945
Energy: 0.5147992521271986
Energy: 0.6230953629167272
Energy: 0.5359409644902345
Energy: 0.5358486841433916
Energy: 0.5155350246897297
Energy: 0.5356550252071532
Energy: 0.5355904557905696
Energy: 0.7457227210739523
Energy: 0.5238053512895964
Energy: 0.5318836615368842
Energy: 0.49830512381783854
Energy: 0.5249536885207792
Energy: 0.5242641820624878
Energy: 0.5778853349147058
Energy: 0.5553632339341095
Energy: 0.5577891207339409
Energy: 0.49764277208616253
Energy: 0.5573786952375173
Energy: 0.5466955971521358
Energy: 0.6208988316598003
Energy: 0.5613635252916079
Energy: 0.5794765959827644
Energy: 0.5083978305571156
Energy: 0.5801919301483791
Energy: 0.533362884691131
Energy: 0.6227593276864555
Energy: 0.48652041114008876
Energy: 0.5621378155422928
Energy: 0.544492145712366
Energy: 0.4855316604732085
Energy: 0.5443414359193548
Energy: 0.6247261822824942
Energy: 0.4856367098476115
Energy: 0.48195884878553785
Energy: 0.5466871658933272
Energy: 0.45837251862887446
Energy: 0.547274454670705
Energy: 0.6175498845007998
Energy: 0.4464480634635041
Energy: 0.4494343512724088
Energy: 0.5855498587259735
Energy: 0.4464062415673608
Energy: 0.4509811482622242
Energy: 0.5484074180821709
Energy: 0.44648587439084786
Energy: 0.4460286583527131
Energy: 0.5456428563222436
Energy: 0.4461680767310088
Energy: 0.4591570857164146
Energy: 0.5476563878461433
Energy: 0.51076973205501
Energy: 0.5477890751934726
Energy: 0.5481101683386804
Energy: 0.5109999509907112
Energy: 0.5476279966636223
Energy: 0.5482575887346034
Energy: 0.49737620154400736
Energy: 0.49346852967540533
Energy: 0.5490279652291605
Energy: 0.5525872301443391
Energy: 0.5595820077953562
Energy: 0.5314681132631826
Energy: 0.580131242971523
Energy: 0.5763177015261787
Energy: 0.5271437121270461
Energy: 0.5579812746183501
Energy: 0.5266640764035556
Energy: 0.5092391662699514
Energy: 0.5430024437871475
Energy: 0.5349630688625051
Energy: 0.506624608708523
Energy: 0.5423143233696519
Energy: 0.5635245386401719
Energy: 0.5288941786738983
Energy: 0.5352647823491978
Energy: 0.5354559635851041
Energy: 0.5204834116006017
Energy: 0.5355160957317842
Energy: 0.5354408474237784
Energy: 0.6021563583075767
Energy: 0.5035257218829136
Energy: 0.5034020440986586
Energy: 0.41533589026182327
Energy: 0.5034967330780343
Energy: 0.415364116897316
Energy: 0.6072810131170303
Energy: 0.5234325900659366
Energy: 0.41539152273266644
Energy: 0.41598897088896175
Energy: 0.5301751077542468
Energy: 0.4151465547540845
Energy: 0.656483970754024
Energy: 0.5515390773014694
Energy: 0.551521499257036
Energy: 0.5290039940807201
Energy: 0.5531386162945022
Energy: 0.5516042449630705
Energy: 0.5762488756615203
Energy: 0.5533748764650556
Energy: 0.5535058704848245
Energy: 0.4975842737704671
Energy: 0.5533839199284751
Energy: 0.5578830717913904
Energy: 0.5759762740010064
Energy: 0.5377964336276427
Energy: 0.5374077839860376
Energy: 0.49883529959723316
Energy: 0.5388984937195919
Energy: 0.537856574257454
Energy: 0.7015006076825786
Energy: 0.4861926326221439
Energy: 0.5476002999436518
Energy: 0.5463924145443378
Energy: 0.5066711832653741
Energy: 0.5697065060037835
Energy: 0.6090847977546721
Energy: 0.5480026112111005
Energy: 0.5486288103007797
Energy: 0.5968845827373053
Energy: 0.556892448812101
Energy: 0.549602550093786
Energy: 0.6092104276318405
Energy: 0.5166044764659572
Energy: 0.5160937330930384
Energy: 0.5410290741501542
Energy: 0.5162036522389392
Energy: 0.5274353720873574
Energy: 0.5992646926282085
Energy: 0.44901319272948464
Energy: 0.4491619008229124
Energy: 0.5979753195879791
Energy: 0.4489977173701012
Energy: 0.47791242179634547
Energy: 0.5647891945824782
Energy: 0.45896152217336955
Energy: 0.44654495863192006
Energy: 0.5599167567589839
Energy: 0.4512041999618019
Energy: 0.5596236757023324
Energy: 0.5629190867672619
Energy: 0.5107058503923984
Energy: 0.5560506069042237
Energy: 0.5625325005726208
Energy: 0.5356728213234775
Energy: 0.5557467405116314
Energy: 0.6520781845179173
Energy: 0.49751710506311253
Energy: 0.4950598660649064
Energy: 0.5914440453057226
Energy: 0.5089791800086317
Energy: 0.5084448873243511
Energy: 0.6253732078067668
Energy: 0.5559119162591446
Energy: 0.5817778695429258
Energy: 0.5325867860087103
Energy: 0.5552513178881802
Energy: 0.48261930176847245
Energy: 0.5093319790989699
Energy: 0.5283286179630793
Energy: 0.5166197560422968
Energy: 0.4852132135317872
Energy: 0.517168134481398
Energy: 0.5280573689499877
Energy: 0.6260554362125544
Energy: 0.5200291451083777
Energy: 0.5197726132119769
Energy: 0.5032794961408927
Energy: 0.5201653491187287
Energy: 0.5192586749487511
Energy: 0.6444611933964498
Energy: 0.5151626075195817
Energy: 0.44844608420113413
Energy: 0.4504966222944378
Energy: 0.5150983939158322
Energy: 0.48104030370306106

minimum gb energy = 0.4151465547540845 eV
minimum distance =  2.64441894531317 Angstroms
sigma value = 27


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

Energy: 0.5298059501697943
Energy: 0.45511794588881865
Energy: 0.549456945731571
Energy: 0.5271704084454275
Energy: 0.4550500699445613
Energy: 0.5488607297868585
Energy: 0.5489259067978729
Energy: 0.45714428996047834
Energy: 0.4570231422421426
Energy: 0.4395473036645329
Energy: 0.4568086926540404
Energy: 0.45689437040213843
Energy: 0.49067111085837406
Energy: 0.4569923508140276
Energy: 0.4584800851993394
Energy: 0.43986317080382287
Energy: 0.4557957406078076
Energy: 0.45564755408318197
Energy: 0.4925428364394452
Energy: 0.4553004425798675
Energy: 0.4552767878510532
Energy: 0.43728155235620214
Energy: 0.4820765729381767
Energy: 0.4559156111833644
Energy: 0.5487455775432123
Energy: 0.40060427161449774
Energy: 0.44196618420865397
Energy: 0.4558917803657551
Energy: 0.40103907426824426
Energy: 0.44142483772918606
Energy: 0.4783194393911609
Energy: 0.4002810461287058
Energy: 0.4015454531905843
Energy: 0.4556599076684447
Energy: 0.4004913402769039
Energy: 0.40065468348640054
Energy: 0.48132626353963237
Energy: 0.43918835564905473
Energy: 0.44042465745395915
Energy: 0.4818638549955552
Energy: 0.44003827320954253
Energy: 0.45656024627171554
Energy: 0.48068582143384964
Energy: 0.45453129236929185
Energy: 0.45408398615032075
Energy: 0.4806686493762446
Energy: 0.435423244799426
Energy: 0.4537164850702186
Energy: 0.4911560745475149
Energy: 0.45417980518615025
Energy: 0.43949013961936606
Energy: 0.45609063663623567
Energy: 0.43593386221531033
Energy: 0.4400549945236737
Energy: 0.4491128280809938
Energy: 0.423413155847767
Energy: 0.42226671154973966
Energy: 0.42292467485764795
Energy: 0.42280997276390775
Energy: 0.42303587289965
Energy: 0.49074097274319933
Energy: 0.449905450440729
Energy: 0.42375001961476155
Energy: 0.42480624690992214
Energy: 0.4831784186143305
Energy: 0.4235104686735517
Energy: 0.4496867895186486
Energy: 0.4232044654059988
Energy: 0.42311776419392505
Energy: 0.43988133587684214
Energy: 0.42342356070326864
Energy: 0.44005483128984424

minimum gb energy = 0.4002810461287058 eV
minimum distance =  2.66978380172198 Angstroms
sigma value = 9


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

Energy: 0.8728172170057114
Energy: 0.4016813430257936
Energy: 0.5063721722957882
Energy: 0.47597361339820515
Energy: 0.4012670097179736
Energy: 0.5053867204137232
Energy: 0.4525536623095259
Energy: 0.403713148127129
Energy: 0.4031444908766505
Energy: 0.43012940811173417
Energy: 0.40315667168426483
Energy: 0.4022971142066155
Energy: 0.4214127476744327
Energy: 0.40238657817227375
Energy: 0.3990684889696831
Energy: 0.4107880108831488
Energy: 0.39938268170615193
Energy: 0.4003229813373906
Energy: 0.4236591997881882
Energy: 0.40035497560912126
Energy: 0.38827589698715487
Energy: 0.41019464743116446
Energy: 0.4342184263256925
Energy: 0.42749383063798646
Energy: 0.4517115729592241
Energy: 0.4293699226587272
Energy: 0.4078113554282595
Energy: 0.43556376102597416
Energy: 0.4332983832664428
Energy: 0.4000002173452926
Energy: 0.43464950226284743
Energy: 0.38934482307178936
Energy: 0.43997615439232884
Energy: 0.4352413551889332
Energy: 0.3930204226155197
Energy: 0.4342999254518846
Energy: 0.43584267710233077
Energy: 0.3976916312334598
Energy: 0.4458087965090047
Energy: 0.4365211116611324
Energy: 0.4400426690997954
Energy: 0.43488420773702774
Energy: 0.4338649895020522
Energy: 0.41007136823427365
Energy: 0.4362051079836118
Energy: 0.4338449237118045
Energy: 0.40907770708714986
Energy: 0.43423862321152024
Energy: 0.41558375173164264
Energy: 0.4146564162483539
Energy: 0.4035408262486621
Energy: 0.44618700530848293
Energy: 0.42778056954262256
Energy: 0.4607999329651728
Energy: 0.40296878412258597
Energy: 0.4376052900370135
Energy: 0.43035655532053735
Energy: 0.3917735667054614
Energy: 0.4562949091973803
Energy: 0.42595252526605465
Energy: 0.3974391150585762
Energy: 0.4338165143746103
Energy: 0.4338698706179828
Energy: 0.39304182585825453
Energy: 0.4339848169077471
Energy: 0.45570816732436426
Energy: 0.41540261271713674
Energy: 0.4352970001419804
Energy: 0.4352747212363261
Energy: 0.4322413707229055
Energy: 0.4365575752989376
Energy: 0.43526574431980963
Energy: 0.5467814696003214
Energy: 0.4280395666482352
Energy: 0.43933777528322204
Energy: 0.4064175695364518
Energy: 0.4272950786935692
Energy: 0.44677410148508595
Energy: 0.4647862786153157
Energy: 0.4357023702860696
Energy: 0.4594451356141743
Energy: 0.43226504631246887
Energy: 0.43616649874467395
Energy: 0.4089418601564053
Energy: 0.4142895782947378
Energy: 0.42993779819732114
Energy: 0.4239083346777551
Energy: 0.39915507987800075
Energy: 0.4344602775932007
Energy: 0.4310550371229042
Energy: 0.41881183086502566
Energy: 0.3946834076175836
Energy: 0.39735315323622433
Energy: 0.4021723245008468
Energy: 0.43069622994345236
Energy: 0.40037559519403915
Energy: 0.4185554527696217
Energy: 0.4145938561994006
Energy: 0.3983539441172159
Energy: 0.4018165490074566
Energy: 0.41446257195449654
Energy: 0.4030711793699936
Energy: 0.42152329767954816
Energy: 0.4045691247137849
Energy: 0.43565470343628687
Energy: 0.4025444120820077
Energy: 0.4166910487351096
Energy: 0.4352135576493343
Energy: 0.42183329624855737
Energy: 0.41220008303057143
Energy: 0.39224755154583085
Energy: 0.398385232895566
Energy: 0.43041113451734175
Energy: 0.3940225475534495
Energy: 0.4216259560571736
Energy: 0.39838548280704883
Energy: 0.3983966674777515
Energy: 0.3977010614758773
Energy: 0.3971143622459142
Energy: 0.40334494903128787
Energy: 0.4216596254529053
Energy: 0.39800491490861933
Energy: 0.4035023926755847
Energy: 0.4336479549179501
Energy: 0.3983263336101001
Energy: 0.38549170453261106
Energy: 0.4456054155827748
Energy: 0.4033494570778681
Energy: 0.4326692683898283
Energy: 0.440982260414097
Energy: 0.40289444888565407
Energy: 0.4396049675367016
Energy: 0.4427120373145675
Energy: 0.4030039274136872
Energy: 0.40406089770886594
Energy: 0.43273491434485356
Energy: 0.4025631497101746
Energy: 0.4254011495154774
Energy: 0.4215584136988453
Energy: 0.39951756894851753
Energy: 0.4031303515183233
Energy: 0.43123180418632684
Energy: 0.4000238769149039
Energy: 0.4001990184525063
Energy: 0.5460786571835642
Energy: 0.39944193692306457
Energy: 0.4479839845556729
Energy: 0.4276088910712056
Energy: 0.40579295576269586
Energy: 0.43002871194613984
Energy: 0.4213347108708094
Energy: 0.41376522481295713
Energy: 0.4129643007582486
Energy: 0.43638777491176206
Energy: 0.41389855178928703
Energy: 0.4226621409463907
Energy: 0.4695813017848674
Energy: 0.43559058249020605
Energy: 0.4435544395936145
Energy: 0.47136677112370784
Energy: 0.4142888629011351
Energy: 0.4213562152307209
Energy: 0.4371918568342734
Energy: 0.4020729727388486
Energy: 0.40119966719335665
Energy: 0.4366170723050832
Energy: 0.41424974013360727
Energy: 0.4353303172594576
Energy: 0.433861637567209
Energy: 0.41525647258512405
Energy: 0.4508003822874313
Energy: 0.4341872173517542
Energy: 0.4139423527622371
Energy: 0.4343434251356033
Energy: 0.41610342903410147
Energy: 0.410076109657423
Energy: 0.40387683160160576
Energy: 0.430552819042921
Energy: 0.4093131731786443
Energy: 0.4375430677504688
Energy: 0.39738871253132463
Energy: 0.43761584173552986
Energy: 0.45840870465672995
Energy: 0.39329363695330477
Energy: 0.43452294584459533
Energy: 0.42645295411548934
Energy: 0.4026365927169755
Energy: 0.4336989848180271
Energy: 0.43408570562956794
Energy: 0.39190804904784304
Energy: 0.433831904310464
Energy: 0.4247632178988776
Energy: 0.42068357980922993
Energy: 0.4353541408459595
Energy: 0.43479437022665407
Energy: 0.44172047140104126
Energy: 0.43538542542353303
Energy: 0.43448805521285677
Energy: 0.4239891885940444
Energy: 0.43526787294972824
Energy: 0.4353067420291522
Energy: 0.4170062220877496
Energy: 0.43529397947947024
Energy: 0.4357169119843479
Energy: 0.4210633307851058
Energy: 0.43517623261177646
Energy: 0.4626822361927777
Energy: 0.4140954803293244
Energy: 0.4351147176466416
Energy: 0.40120309549279737
Energy: 0.4215176541262231
Energy: 0.42638099968795257
Energy: 0.41184101464216016
Energy: 0.42414325506358597
Energy: 0.42677691802231876
Energy: 0.39996667088163973
Energy: 0.41423063977639485
Energy: 0.4115431674180624
Energy: 0.3972229208761653
Energy: 0.39924679952735803
Energy: 0.41096888597089687
Energy: 0.39960614331156913
Energy: 0.4174881779754618
Energy: 0.4088033817215401
Energy: 0.40864979905997634
Energy: 0.4020182142921379
Energy: 0.408884603199334
Energy: 0.4036588477918242
Energy: 0.4533666790078445
Energy: 0.4634473534002348
Energy: 0.45604074929832517
Energy: 0.4543480782924901
Energy: 0.40550697768180766
Energy: 0.43577136370368913
Energy: 0.42253110104445846
Energy: 0.40858140918679753
Energy: 0.4083723306595068
Energy: 0.4017881132827016
Energy: 0.4086340556762341
Energy: 0.3934583298199516
Energy: 0.4215681866622189
Energy: 0.39709033458996706
Energy: 0.399686314888658
Energy: 0.39953654131652616
Energy: 0.39914272259058126
Energy: 0.39775777334374957
Energy: 0.42219598138296094
Energy: 0.3982725013096788
Energy: 0.401238086847284
Energy: 0.40065502260264985
Energy: 0.3973750881541591
Energy: 0.3855249370512181
Energy: 0.44297862904399316
Energy: 0.403402495551792
Energy: 0.404895895443919
Energy: 0.4320882220338553
Energy: 0.40288513193903064
Energy: 0.4253530527324689

minimum gb energy = 0.38549170453261106 eV
minimum distance =  2.64808379198682 Angstroms
sigma value = 57


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

Energy: 0.18060239489708385
Energy: 0.2056978284757101
Energy: 0.18720716532644688
Energy: 0.18230066934259367
Energy: 0.20568260298683327
Energy: 0.18098982815002806
Energy: 0.23502057627478384
Energy: 0.1885804292557944
Energy: 0.18870201544022305
Energy: 0.20627333554420188
Energy: 0.2063114467697893
Energy: 0.18865814718570334
Energy: 0.23482635895055054
Energy: 0.20586951577444026
Energy: 0.20603662184623475
Energy: 0.20722643908517233
Energy: 0.20577455135506237
Energy: 0.2120522982202853
Energy: 0.2349196094027241
Energy: 0.20588713471655803
Energy: 0.20594580770304569
Energy: 0.20652223676872158
Energy: 0.23500675178302674
Energy: 0.20654364472368145
Energy: 0.23426563881866752
Energy: 0.1814256522923931
Energy: 0.20185668781950541
Energy: 0.23538826349258163
Energy: 0.18093402020448113
Energy: 0.2119377952816254
Energy: 0.20577432780999882
Energy: 0.18085957212091439
Energy: 0.18125760172127686
Energy: 0.18946142658271023
Energy: 0.18080810127580488
Energy: 0.19847646891818915
Energy: 0.20479180932930555
Energy: 0.18875475856067883
Energy: 0.1890468491306526
Energy: 0.20564548993511417
Energy: 0.20613045356931878
Energy: 0.21238985951458453
Energy: 0.2057058171155871
Energy: 0.20578037198018873
Energy: 0.23520119167609738
Energy: 0.20585566740197003
Energy: 0.2058299535589038
Energy: 0.20606850465483467
Energy: 0.2341711606110094
Energy: 0.2061573980508411
Energy: 0.21278518421078224
Energy: 0.20579863062922876
Energy: 0.20729630276303126
Energy: 0.20618789231554466
Energy: 0.18095404649601202
Energy: 0.20583630732664748
Energy: 0.1993121620646408
Energy: 0.18085790130898746
Energy: 0.20709767086297876
Energy: 0.19921537212368606
Energy: 0.180798649012988
Energy: 0.18847893750974562
Energy: 0.18856836526056334
Energy: 0.18087757822247133
Energy: 0.18975792003403616
Energy: 0.20086808587250887
Energy: 0.235300800447443
Energy: 0.20594499904260516
Energy: 0.21163530491199864
Energy: 0.23534810622010996
Energy: 0.20609881528956647
Energy: 0.18872398800974308
Energy: 0.23478290071552818
Energy: 0.23471805090610706
Energy: 0.2350565880888333
Energy: 0.20630591024100717
Energy: 0.2347453036235585
Energy: 0.2350565924805394
Energy: 0.2349351455349336
Energy: 0.2058852664856749
Energy: 0.20620549640810076
Energy: 0.23610021298273345
Energy: 0.2070222680307917
Energy: 0.18903313132155433
Energy: 0.23489803475891183
Energy: 0.18084835309793001
Energy: 0.1808608229051592
Energy: 0.2077380443122181
Energy: 0.1842272863209867
Energy: 0.18188539731459769
Energy: 0.2066484256157268
Energy: 0.2062936727645071
Energy: 0.21207955756077845
Energy: 0.20732343538307182
Energy: 0.18116460073988983
Energy: 0.18862743058587686
Energy: 0.2057179127417433
Energy: 0.21224382615628248
Energy: 0.18895194352225878
Energy: 0.2057587008135528
Energy: 0.20732455324608234
Energy: 0.20618605845282723
Energy: 0.23477594278422576
Energy: 0.20574166853990822
Energy: 0.2071945822008156
Energy: 0.2348552581369663
Energy: 0.20565459546318804
Energy: 0.2061824824392096
Energy: 0.18093970112409566
Energy: 0.18839347597319858
Energy: 0.18901744864406145
Energy: 0.18094374896286078
Energy: 0.2360972549993171
Energy: 0.21287067984108474

minimum gb energy = 0.18060239489708385 eV
minimum distance =  2.72534700093213 Angstroms
sigma value = 11


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

Energy: 0.625995548625498
Energy: 0.4567919830530157
Energy: 0.4711611664281628
Energy: 0.38411422106578597
Energy: 0.4559692498167704
Energy: 0.45072183944511157
Energy: 0.36200152362280036
Energy: 0.37315186565789427
Energy: 0.3675919385728064
Energy: 0.3626593715840867
Energy: 0.3613522135311925
Energy: 0.36671040783751035
Energy: 0.3603687908985641
Energy: 0.36599714333106875
Energy: 0.3578422227197711
Energy: 0.3613310056932604
Energy: 0.3635521279966337
Energy: 0.3579386044269991
Energy: 0.36028271304025633
Energy: 0.3808671955473316
Energy: 0.3761146665739474
Energy: 0.36104233980549866
Energy: 0.36269893777181805
Energy: 0.357923041004585
Energy: 0.3603093661846166
Energy: 0.3790301341346772
Energy: 0.3626480260329446
Energy: 0.3602617042344489
Energy: 0.3964293597836409
Energy: 0.37234045547819605
Energy: 0.47600411383907687
Energy: 0.386358147350727
Energy: 0.36370201051274065
Energy: 0.3791793571102605
Energy: 0.398989864134852
Energy: 0.35843716208026266
Energy: 0.4642419913451705
Energy: 0.3621490132011875
Energy: 0.3751203005425431
Energy: 0.3620675525779875
Energy: 0.3711710783735302
Energy: 0.3684624049842363
Energy: 0.37922766794641355
Energy: 0.36211896056361237
Energy: 0.36258452030502913
Energy: 0.37937483598231236
Energy: 0.3868234616366769
Energy: 0.3905633713901505
Energy: 0.47083490156798685
Energy: 0.3590457252447084
Energy: 0.3692492627418986
Energy: 0.3807047882470879
Energy: 0.3593731211663164
Energy: 0.3831088149619541
Energy: 0.5811598400382262
Energy: 0.3805476318228411
Energy: 0.37935080756289025
Energy: 0.3584131599171159
Energy: 0.358233355346064
Energy: 0.3636336742321457
Energy: 0.5875118855698231
Energy: 0.3727553698879519
Energy: 0.3631927793433154
Energy: 0.3955928228985323
Energy: 0.3955377404728553
Energy: 0.3631909353816022
Energy: 0.51095716737027
Energy: 0.3511302827887708
Energy: 0.3654653843793449
Energy: 0.4078639766374469
Energy: 0.3478313199379324
Energy: 0.3799071619864878
Energy: 0.4008408420817138
Energy: 0.35126238211182426
Energy: 0.3919888871111238
Energy: 0.4011908468705925
Energy: 0.3475700968919132
Energy: 0.3784668689212024
Energy: 0.3958460689058661
Energy: 0.3713551952642689
Energy: 0.3788394622117624
Energy: 0.39563104087309836
Energy: 0.36972360663645093
Energy: 0.3813939568118399
Energy: 0.394791413093088
Energy: 0.3739275281603031
Energy: 0.43032747228752594
Energy: 0.39481157362784003
Energy: 0.37383667399101844
Energy: 0.37250162751359017
Energy: 0.5849006213090654
Energy: 0.394261336733974
Energy: 0.38249453511779724
Energy: 0.39558920992194074
Energy: 0.39660102904526584
Energy: 0.37774825884550933
Energy: 0.5547786939536743
Energy: 0.45112249198463095
Energy: 0.36207096683253187
Energy: 0.4325855402215334
Energy: 0.4580457905126042
Energy: 0.3595232883722408
Energy: 0.6029377870100513
Energy: 0.3686945849672561
Energy: 0.3710942033382076
Energy: 0.3696881930676026
Energy: 0.39635024061118695
Energy: 0.3730178465116304
Energy: 0.5777316945074015
Energy: 0.3667720982158978
Energy: 0.3799139173806779
Energy: 0.3583518964371397
Energy: 0.3974876829155265
Energy: 0.37274424014461055
Energy: 0.46603950487615275
Energy: 0.3948819435863948
Energy: 0.36837506213694055
Energy: 0.362125923037015
Energy: 0.42432330542671876
Energy: 0.36181532129292154
Energy: 0.585401863671934
Energy: 0.3660616174244294
Energy: 0.36388944369882886
Energy: 0.36042884238217376
Energy: 0.39920188942226587
Energy: 0.3640437568072755
Energy: 0.5439106266962234
Energy: 0.35860190357559435
Energy: 0.4484322290175766
Energy: 0.5435872654548207
Energy: 0.3587174937613833
Energy: 0.40921078616394796
Energy: 0.3596512694688607
Energy: 0.36552099474650324
Energy: 0.3804084458936449
Energy: 0.35969325394814444
Energy: 0.3658942731208265
Energy: 0.3694445135264755
Energy: 0.35938410857876724
Energy: 0.3648870064871943
Energy: 0.3684782849665125
Energy: 0.3599562341756372
Energy: 0.36178170615478594
Energy: 0.36943221817813127
Energy: 0.40345329304812466
Energy: 0.36415540693131665
Energy: 0.36036786864658055
Energy: 0.3622510576698056
Energy: 0.3613592836231532
Energy: 0.3763105460660114
Energy: 0.5717534660635167
Energy: 0.385068576744362
Energy: 0.37193859329013923
Energy: 0.4228900056801415
Energy: 0.37387182833001703
Energy: 0.35783715035357083

minimum gb energy = 0.3475700968919132 eV
minimum distance =  2.61977823977909 Angstroms
sigma value = 41


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

Energy: 0.7260072881114557
Energy: 0.43406246420375605
Energy: 0.4390675590385071
Energy: 0.44563829513011644
Energy: 0.43463203840315945
Energy: 0.4458578141515921
Energy: 0.3990997241196192
Energy: 0.39826358650243043
Energy: 0.39794133443745405
Energy: 0.40975903690921245
Energy: 0.3981905205174028
Energy: 0.4066962733845235
Energy: 0.397753656881698
Energy: 0.40462657518569584
Energy: 0.4054635930620058
Energy: 0.39782517766253433
Energy: 0.3982223836706824
Energy: 0.40535418003274226
Energy: 0.3985957662592575
Energy: 0.4071913427154508
Energy: 0.4100398454967857
Energy: 0.39758436799702
Energy: 0.39752455053660046
Energy: 0.40695391383667556
Energy: 0.3988749832431011
Energy: 0.4152780489019029
Energy: 0.4156583981683777
Energy: 0.39897506312530673
Energy: 0.4060624068720076
Energy: 0.41067010549033306
Energy: 0.5403020523925892
Energy: 0.4034840245835861
Energy: 0.4199046183048875
Energy: 0.3985118516506844
Energy: 0.4034416717808876
Energy: 0.41076225922140946
Energy: 0.540365296809184
Energy: 0.4103025709563311
Energy: 0.4058715236621081
Energy: 0.39864839325343693
Energy: 0.40895510046077965
Energy: 0.4040448095074581
Energy: 0.4457781632902415
Energy: 0.40784272462089727
Energy: 0.4089237685121759
Energy: 0.41842670424698497
Energy: 0.40749314695186367
Energy: 0.40783056864209194
Energy: 0.5384325501455569
Energy: 0.4062365948033154
Energy: 0.4062225533394705
Energy: 0.4206573952136456
Energy: 0.4151298657223872
Energy: 0.416785641702466
Energy: 0.5394747071210793
Energy: 0.40265317933197187
Energy: 0.4129108624668571
Energy: 0.3970349928318738
Energy: 0.4024520608971845
Energy: 0.4198598263117301
Energy: 0.5419592878187969
Energy: 0.4237877710744382
Energy: 0.4234331840299023
Energy: 0.3988587963569006
Energy: 0.41244979058408926
Energy: 0.414578242020429
Energy: 0.6073727950300437
Energy: 0.38491297305902356
Energy: 0.39315035608674465
Energy: 0.4128681578722531
Energy: 0.37727034103501045
Energy: 0.42095366822978203
Energy: 0.4018361905990736
Energy: 0.38498463021701285
Energy: 0.4238324293237063
Energy: 0.40204408085891175
Energy: 0.3776748806173453
Energy: 0.42379078677382453
Energy: 0.41449165205487243
Energy: 0.42116151866292995
Energy: 0.422448060619994
Energy: 0.4150621640227799
Energy: 0.41210530791389904
Energy: 0.41448586526984504
Energy: 0.4091723135798306
Energy: 0.4217046184302519
Energy: 0.42124338504836284
Energy: 0.4092878467680168
Energy: 0.40749198821962707
Energy: 0.4095423597222456
Energy: 0.397965359662694
Energy: 0.3989555858771374
Energy: 0.39717828932737054
Energy: 0.4083128459916258
Energy: 0.3978440747260812
Energy: 0.4072970633023203
Energy: 0.6618614428232773
Energy: 0.4118473011858623
Energy: 0.37828994491712686
Energy: 0.37819013038173893
Energy: 0.4002000274936593
Energy: 0.4234300768061479
Energy: 0.41756178467261246
Energy: 0.41983170861004737
Energy: 0.42653104682293874
Energy: 0.4522044837633466
Energy: 0.3988322570377543
Energy: 0.4183490050855164
Energy: 0.39831281390373513
Energy: 0.3980086959933814
Energy: 0.4078728163357644
Energy: 0.39732054542927703
Energy: 0.39768721492644493
Energy: 0.39769213955097543
Energy: 0.39824122927201294
Energy: 0.4081915608244059
Energy: 0.40242850926304125
Energy: 0.3982187584456196
Energy: 0.397731752616783
Energy: 0.406170889352698
Energy: 0.398507702111937
Energy: 0.407926479515283
Energy: 0.4080366815327032
Energy: 0.39839194559479935
Energy: 0.40546297735312103
Energy: 0.4052983864590537
Energy: 0.46827299603739847
Energy: 0.41075106695189084
Energy: 0.4744893145762211
Energy: 0.4682997357101787
Energy: 0.4163887013691236
Energy: 0.444712412818325
Energy: 0.5384429720161561
Energy: 0.4094384627221177
Energy: 0.40631779118282546
Energy: 0.39821751480442696
Energy: 0.4087225846555932
Energy: 0.4066057300550403
Energy: 0.41720924004607535
Energy: 0.409375055563461
Energy: 0.46166724555088223
Energy: 0.41741606773512113
Energy: 0.4095052122358842
Energy: 0.3869685954098862
Energy: 0.5403269320478594
Energy: 0.4043753997161361
Energy: 0.4054086274427564
Energy: 0.4069530722176156
Energy: 0.40560949927350104
Energy: 0.39733267274215034
Energy: 0.5399352436759901
Energy: 0.4121735189594338
Energy: 0.4237271808366764
Energy: 0.3992530764913512
Energy: 0.4024833030082932
Energy: 0.42307701851882806
Energy: 0.539398912977404
Energy: 0.4260137210120744
Energy: 0.41889476213453763
Energy: 0.4008223820081971
Energy: 0.40196582337754994
Energy: 0.42010202504297994
Energy: 0.5383131457017151
Energy: 0.3781702041457304
Energy: 0.41839813510527146
Energy: 0.4118818705650977
Energy: 0.3781881533502142
Energy: 0.4234304448421889
Energy: 0.40230191382347136
Energy: 0.4265265859775929
Energy: 0.4289004755199746
Energy: 0.40252529168373835
Energy: 0.3927612721482687
Energy: 0.4239547595613603
Energy: 0.4157219755798688
Energy: 0.42269148613601515
Energy: 0.4185002843593301
Energy: 0.4163876121145412
Energy: 0.41130317939694006
Energy: 0.4096917826163794
Energy: 0.3994019794158602
Energy: 0.41620870481567146
Energy: 0.407131182688539
Energy: 0.39834510408798685
Energy: 0.39760445648764253
Energy: 0.40560849698248436
Energy: 0.3974952386775665
Energy: 0.3976011857634011
Energy: 0.4092420382888409
Energy: 0.4067189235370056
Energy: 0.39774142033123905
Energy: 0.40627895490563576
Energy: 0.6620273512700398
Energy: 0.43029764826574246
Energy: 0.4155874470976348
Energy: 0.3769174031145387
Energy: 0.3997039554344626
Energy: 0.38055121816675785

minimum gb energy = 0.3769174031145387 eV
minimum distance =  2.69184934421244 Angstroms
sigma value = 33


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

Energy: 0.5055289493825337
Energy: 0.459261609362093
Energy: 0.4097596622756268
Energy: 0.5057819833756917
Energy: 0.4854646061607953
Energy: 0.4084416162741237
Energy: 0.445677795401072
Energy: 0.44225650572605996
Energy: 0.42571782080201
Energy: 0.4149267234679637
Energy: 0.44237890268510704
Energy: 0.44572644985970056
Energy: 0.44317566533063946
Energy: 0.42305580299675843
Energy: 0.42268899412361993
Energy: 0.44087837989438683
Energy: 0.4415532494574012
Energy: 0.421242146145811
Energy: 0.44169909605975083
Energy: 0.4268865063330512
Energy: 0.4214949959769499
Energy: 0.4427418370566355
Energy: 0.4427078883187707
Energy: 0.4223702756145514
Energy: 0.4447250087492069
Energy: 0.42059315911522294
Energy: 0.414788789400223
Energy: 0.44204834781494645
Energy: 0.4414859098778669
Energy: 0.4536977868761436
Energy: 0.48301436492487987
Energy: 0.42055432781802954
Energy: 0.4231337443498181
Energy: 0.46568646668192026
Energy: 0.4446491681336423
Energy: 0.4442595771713167
Energy: 0.4689845982918147
Energy: 0.4415511404606004
Energy: 0.43857552159767943
Energy: 0.4406912748883297
Energy: 0.44229300464018495
Energy: 0.4253005041759739
Energy: 0.5054304734181687
Energy: 0.427828653553291
Energy: 0.4090860437488537
Energy: 0.5059317665714882
Energy: 0.4462819277570786
Energy: 0.40884413748516696
Energy: 0.46785877598123693
Energy: 0.41757779145997537
Energy: 0.4138074090735041
Energy: 0.47465073918814527
Energy: 0.41496586553695974
Energy: 0.4149726396940102
Energy: 0.4692634287542406
Energy: 0.4243159275439494
Energy: 0.4234695361992331
Energy: 0.4439376805939512
Energy: 0.4376741361423924
Energy: 0.4220770987674489
Energy: 0.4692238281194713
Energy: 0.43772948899635494
Energy: 0.4250420736020708
Energy: 0.44086667537038693
Energy: 0.44510995943811293
Energy: 0.42347282010920695
Energy: 0.4710133433274352
Energy: 0.4085305821077271
Energy: 0.4101854916439321
Energy: 0.47122555949252964
Energy: 0.4097218432945866
Energy: 0.4112304791991021
Energy: 0.4433548298383981
Energy: 0.4132112366568381
Energy: 0.4077916615940391
Energy: 0.4421380067803648
Energy: 0.4089135958480903
Energy: 0.4102864386825308
Energy: 0.4395623602998419
Energy: 0.4372365623191069
Energy: 0.4254874830942424
Energy: 0.4403330545237011
Energy: 0.4433833986098506
Energy: 0.42364535290970595
Energy: 0.4075372714628372
Energy: 0.42310664083952465
Energy: 0.423031437368434
Energy: 0.44833057370537327
Energy: 0.4583983830240467
Energy: 0.4217354668038372
Energy: 0.44169083904874074
Energy: 0.44422822049751953
Energy: 0.4248277121563462
Energy: 0.451371404909549
Energy: 0.4415756146310101
Energy: 0.42667957084870045
Energy: 0.4692870608563194
Energy: 0.46287163836446316
Energy: 0.42701903396968127
Energy: 0.44441380027094013
Energy: 0.45800413375750704
Energy: 0.435879062498664
Energy: 0.46883808715371894
Energy: 0.46680494785857846
Energy: 0.4554255269206579
Energy: 0.4405926068402249
Energy: 0.46852653425318014
Energy: 0.4143305650058327
Energy: 0.4396890055406822
Energy: 0.45482257273369714
Energy: 0.4101451591519818
Energy: 0.43839151270000315
Energy: 0.46629974757961706
Energy: 0.4252173023148562
Energy: 0.41541104593940364
Energy: 0.40838002086980507
Energy: 0.4066419225036051
Energy: 0.4149386749286212
Energy: 0.46635326043775416
Energy: 0.4228449345614241
Energy: 0.4149349763224744
Energy: 0.42348182996305694
Energy: 0.4256208400318037
Energy: 0.4152152805766653
Energy: 0.449474507931589
Energy: 0.4438634882522602
Energy: 0.424805255933371
Energy: 0.42218595613896714
Energy: 0.42287245579754357
Energy: 0.42428854467749094
Energy: 0.43997979996269965
Energy: 0.4282477425617582
Energy: 0.4422905308426484
Energy: 0.44154419209470386
Energy: 0.4266815550528882
Energy: 0.42395577836688936
Energy: 0.441994966818813
Energy: 0.44439975719854213
Energy: 0.505015361918484
Energy: 0.5009375826925738
Energy: 0.41032100048354486
Energy: 0.40903203350047673
Energy: 0.5009835640847543
Energy: 0.41026986486074196
Energy: 0.46983135579916335
Energy: 0.4495133778090953
Energy: 0.4270117246475289
Energy: 0.412644667396947
Energy: 0.4427557855337972
Energy: 0.4158061524720904
Energy: 0.4420807509967125
Energy: 0.4351003132669655
Energy: 0.42244903243436704
Energy: 0.4433674919091439
Energy: 0.44420211461687403
Energy: 0.4209319302613251
Energy: 0.4427014402323476
Energy: 0.4226455230873759
Energy: 0.4251582846060612
Energy: 0.4404316179007473
Energy: 0.44253594901287807
Energy: 0.42215828062836613
Energy: 0.44360574754394216
Energy: 0.4152733601433433
Energy: 0.41531710470021277
Energy: 0.4436557412494218
Energy: 0.4414981150993831
Energy: 0.4139137498974817
Energy: 0.4805510354009799
Energy: 0.42258186508608264
Energy: 0.4236147793877635
Energy: 0.48012473579631254
Energy: 0.44267039413024406
Energy: 0.43842456617074815
Energy: 0.4675741771008642
Energy: 0.4145194503314682
Energy: 0.44302656802697576
Energy: 0.4412556252063371
Energy: 0.42156941359381533
Energy: 0.42735216905828655
Energy: 0.5055038038816669
Energy: 0.42752016374560475
Energy: 0.4084119168211044
Energy: 0.5059982324447048
Energy: 0.45689640924989655
Energy: 0.4085335594613784
Energy: 0.4693161833483888
Energy: 0.41500810214529904
Energy: 0.4138339980948424
Energy: 0.44138928721115067
Energy: 0.41565036685060475
Energy: 0.4253105607086295
Energy: 0.4701636333439439
Energy: 0.4369344525425852
Energy: 0.4238711261903711
Energy: 0.4421265865077593
Energy: 0.42139163693731213
Energy: 0.42198362844338805
Energy: 0.4700986830573589
Energy: 0.4405241076685826
Energy: 0.42353887140099566
Energy: 0.44162676339968077
Energy: 0.42268587091074816
Energy: 0.42157538535448014
Energy: 0.4689962397061531
Energy: 0.41058539440323316
Energy: 0.41152251511748833
Energy: 0.4421221318612264
Energy: 0.41161361747822167
Energy: 0.41510687058373286
Energy: 0.44134405847756353
Energy: 0.4069754978034498
Energy: 0.4107549288811567
Energy: 0.44162351523028215
Energy: 0.4094714211869689
Energy: 0.4103816486940178
Energy: 0.4399055305437296
Energy: 0.43888396396700086
Energy: 0.43840579236177296
Energy: 0.4408870542923842
Energy: 0.43966939176138586
Energy: 0.4252499966828746
Energy: 0.41026453607960023
Energy: 0.4234209120950812
Energy: 0.42425979093944055
Energy: 0.41179373544660014
Energy: 0.4419096394187887
Energy: 0.4229633535547796
Energy: 0.44037225259017704
Energy: 0.4413177139729869
Energy: 0.42418103030447185
Energy: 0.4475340542346567
Energy: 0.4418002052281577
Energy: 0.42359753181774773
Energy: 0.47138150510247756
Energy: 0.47103619331690677
Energy: 0.4703240649998181
Energy: 0.44342459240910265
Energy: 0.462817549992964
Energy: 0.4146031790536286
Energy: 0.46918587799242606
Energy: 0.45544461201356434
Energy: 0.4552746270655865
Energy: 0.4409039133267008
Energy: 0.46839957632404816
Energy: 0.4140065948788649
Energy: 0.4395212601388899
Energy: 0.4523664308634568
Energy: 0.40802566819392355
Energy: 0.4393232674621791
Energy: 0.4739092922908328
Energy: 0.4230487524649541
Energy: 0.4143730067025423
Energy: 0.41006370174825374
Energy: 0.40746045854348445
Energy: 0.4395548749518909
Energy: 0.46656069153529417
Energy: 0.40678635806151836
Energy: 0.414170069794072
Energy: 0.4390574954738441
Energy: 0.41471236861449706
Energy: 0.41460516490147914
Energy: 0.4496386491261231
Energy: 0.41428084609189675
Energy: 0.4692219488965627
Energy: 0.42192116296747423
Energy: 0.42622352971111055
Energy: 0.45426845621191964
Energy: 0.44003837615341446
Energy: 0.4280385239808366
Energy: 0.44087670862656914
Energy: 0.4471505552540645
Energy: 0.42522091022377606
Energy: 0.42081796380869757
Energy: 0.44136765039927517
Energy: 0.4267207297947033
Energy: 0.47202695691254587
Energy: 0.469576617003063
Energy: 0.41108955462579144
Energy: 0.40814516108537524
Energy: 0.5014237691463151
Energy: 0.4103302715658998

minimum gb energy = 0.4066419225036051 eV
minimum distance =  2.67572287995401 Angstroms
sigma value = 67


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

Energy: 0.5840663204829041
Energy: 0.46415546486548787
Energy: 0.41152147953762774
Energy: 0.4116816386512709
Energy: 0.4634045295845653
Energy: 0.4116508454824732
Energy: 0.4524487358643957
Energy: 0.41444516899530914
Energy: 0.41320334314248447
Energy: 0.4133918420079423
Energy: 0.45591242508906815
Energy: 0.41287347934845264
Energy: 0.462828930218717
Energy: 0.4012311320618643
Energy: 0.4225931988254948
Energy: 0.42268171002102317
Energy: 0.40134693914674313
Energy: 0.42282938589183966
Energy: 0.46200089483550105
Energy: 0.4216456453755072
Energy: 0.4199619771636387
Energy: 0.46034394605383866
Energy: 0.41994784346282604
Energy: 0.4201274730895511
Energy: 0.45932276226856456
Energy: 0.4111200342014934
Energy: 0.4465463678222838
Energy: 0.46020268129512315
Energy: 0.44210971958842604
Energy: 0.4453230958237375
Energy: 0.4621522089630526
Energy: 0.41665277076837254
Energy: 0.4459160925302897
Energy: 0.46182474238924437
Energy: 0.4156776184938211
Energy: 0.4613162855855292
Energy: 0.5067065006398997
Energy: 0.43863265596030315
Energy: 0.4125564833441771
Energy: 0.46760341586298154
Energy: 0.45622698650735
Energy: 0.4125019985097009

minimum gb energy = 0.4012311320618643 eV
minimum distance =  2.7288650033113 Angstroms
sigma value = 3


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

Energy: 0.794186648365243
Energy: 0.5816865641997914
Energy: 0.5304876420897289
Energy: 0.4897571126020401
Energy: 0.575354385788043
Energy: 0.5452746463615573
Energy: 0.4837259581888152
Energy: 0.515827445913457
Energy: 0.5132548818160597
Energy: 0.46135177120168336
Energy: 0.4984317443418702
Energy: 0.510694079971478
Energy: 0.5549195063781439
Energy: 0.5019353605173771
Energy: 0.4926193766122534
Energy: 0.5326611263513156
Energy: 0.4702827275739552
Energy: 0.49346304615591463
Energy: 0.4895102948660019
Energy: 0.4611051888837845
Energy: 0.48652535516488016
Energy: 0.49221135223975043
Energy: 0.4714778959678274
Energy: 0.4609101921275298
Energy: 0.4881455090608459
Energy: 0.49552053045147637
Energy: 0.48604644731896857
Energy: 0.4904701704587848
Energy: 0.5065431165713289
Energy: 0.48433346185539755
Energy: 0.4861156276286484
Energy: 0.53225511129296
Energy: 0.535184995513571
Energy: 0.48689306186424414
Energy: 0.5072774421067505
Energy: 0.5321103189952735
Energy: 0.4831273850548139
Energy: 0.4966797014771274
Energy: 0.5413865330332017
Energy: 0.5081725863562624
Energy: 0.5353861306047679
Energy: 0.5032283209257593
Energy: 0.7359468512146414
Energy: 0.5837207499504734
Energy: 0.5216052161847275
Energy: 0.4851925261116178
Energy: 0.58289596839994
Energy: 0.5229631905234691
Energy: 0.49565634265868325
Energy: 0.5220669932866757
Energy: 0.5192950128066647
Energy: 0.5377163738495966
Energy: 0.5315504806772209
Energy: 0.5300779917225594
Energy: 0.5691725217586621
Energy: 0.4815941699489159
Energy: 0.48177320710721844
Energy: 0.563390052234661
Energy: 0.4816712309023361
Energy: 0.5235631414699963
Energy: 0.5377641081397966
Energy: 0.49424384228912804
Energy: 0.48518881921284857
Energy: 0.5377584516849241
Energy: 0.5216132485509785
Energy: 0.546138228510389
Energy: 0.5484139800070958
Energy: 0.5309289245572641
Energy: 0.514702467966664
Energy: 0.5397754103309184
Energy: 0.4961514801264194
Energy: 0.5088453437226851
Energy: 0.5255474937086998
Energy: 0.4842232142648282
Energy: 0.4847655879776864
Energy: 0.5260946411182225
Energy: 0.4838613562746746
Energy: 0.48500109019297627
Energy: 0.5409718235090654
Energy: 0.4891911898323074
Energy: 0.48375017090609057
Energy: 0.5137982802777921
Energy: 0.4875035939180171
Energy: 0.4837024730340465
Energy: 0.6345249436629791
Energy: 0.48509107251540196
Energy: 0.5314318818872363
Energy: 0.5128663825718485
Energy: 0.4842248978062225
Energy: 0.5220645835754817
Energy: 0.551466425898593
Energy: 0.5014857667960101
Energy: 0.5088252265993045
Energy: 0.5127563196401289
Energy: 0.5105736544693106
Energy: 0.48518404620168026
Energy: 0.6103655189379369
Energy: 0.5000024977390277
Energy: 0.5003675614921657
Energy: 0.6089698695493897
Energy: 0.5001323114487459
Energy: 0.49172522197253693
Energy: 0.5222938818556244
Energy: 0.5042079277044977
Energy: 0.5135003099291278
Energy: 0.5352790353409037
Energy: 0.49558533313434056
Energy: 0.5169565438501643
Energy: 0.5271132310096218
Energy: 0.5131962193483317
Energy: 0.49912619191121027
Energy: 0.4960620890408575
Energy: 0.5067520099910806
Energy: 0.4816614346822215
Energy: 0.5539851063356832
Energy: 0.5052970582789748
Energy: 0.5050721791264501
Energy: 0.48178608090615016
Energy: 0.5109561420922049
Energy: 0.48157056612383614
Energy: 0.5164322634945524
Energy: 0.5142894227554737
Energy: 0.5146602620598569
Energy: 0.5398151397243408
Energy: 0.5105443482446547
Energy: 0.5176949275364763
Energy: 0.51164184077286
Energy: 0.555171103809719
Energy: 0.5407637789694744
Energy: 0.5247003829703311
Energy: 0.5180958055584683
Energy: 0.5413528192670872
Energy: 0.5101514079139438
Energy: 0.5229352227237406
Energy: 0.48868753551175853
Energy: 0.5110250268999329
Energy: 0.5297973625164528
Energy: 0.48799644771547873
Energy: 0.5110926507257566
Energy: 0.4849938165076947
Energy: 0.5114684416554269
Energy: 0.5111230910219224
Energy: 0.4849894032453895
Energy: 0.5115915775823849
Energy: 0.4870129540233615
Energy: 0.49150737283155355
Energy: 0.49066989828476815
Energy: 0.5319397732281144
Energy: 0.5327487637858862
Energy: 0.49029201414260287
Energy: 0.6096525539936631
Energy: 0.5836948504130032
Energy: 0.5129482175704073
Energy: 0.48057191599048427
Energy: 0.5992924189820551
Energy: 0.5006793488700663
Energy: 0.4676917634614265
Energy: 0.5475521805939855
Energy: 0.5195943970153262
Energy: 0.47029411749510874
Energy: 0.5926634894188685
Energy: 0.5010306550367049
Energy: 0.48926231381101326
Energy: 0.4904300862291477
Energy: 0.4902204811883071
Energy: 0.513007935534292
Energy: 0.5344301711750351
Energy: 0.48577647168489246
Energy: 0.4859616961691766
Energy: 0.5031136572178156
Energy: 0.46931109524757536
Energy: 0.48619618890390814
Energy: 0.5025288937465073
Energy: 0.4871491167740411
Energy: 0.4859238479789096
Energy: 0.4872844887386636
Energy: 0.48686305569191385
Energy: 0.4871164884073733
Energy: 0.5379923462750309
Energy: 0.4865667438018888
Energy: 0.48692250183759883
Energy: 0.48729952595224657
Energy: 0.48667459052826484
Energy: 0.4865309846399971
Energy: 0.5375223932187067
Energy: 0.4873000470687059
Energy: 0.49100077192715186
Energy: 0.5020233679896489
Energy: 0.5121003688712285
Energy: 0.523428350905935
Energy: 0.529717726901537
Energy: 0.5109963865733194
Energy: 0.6005734491838188
Energy: 0.5581317359078947
Energy: 0.5508204336571781
Energy: 0.48529482198275004
Energy: 0.5556423733392282
Energy: 0.500260489442265
Energy: 0.5018072350270055
Energy: 0.5324611768109693
Energy: 0.5155031616225454
Energy: 0.507213926929491
Energy: 0.5284467714877487
Energy: 0.5332891482184174
Energy: 0.49332924156083974
Energy: 0.48580282484032755
Energy: 0.48534013493747186
Energy: 0.5171536349794533
Energy: 0.5057046320656201
Energy: 0.5107808122605179
Energy: 0.5630838301621567
Energy: 0.48166225117708744
Energy: 0.48170550755873104
Energy: 0.5632997369046641
Energy: 0.4817719651793016
Energy: 0.5224379419096293
Energy: 0.5458482481363801
Energy: 0.5229802104657766
Energy: 0.5309097654186915
Energy: 0.5521187098473217
Energy: 0.521749455276335
Energy: 0.5306971824861526
Energy: 0.5911131781696342
Energy: 0.48445336269523565
Energy: 0.48503757895606525
Energy: 0.5220497748013824
Energy: 0.4839908308988744
Energy: 0.5503363698843695
Energy: 0.5381550711960064
Energy: 0.4887814789488686
Energy: 0.48386399082365916
Energy: 0.5488544813186378
Energy: 0.4868888352472256
Energy: 0.4840630336976617
Energy: 0.5730428544204891
Energy: 0.4842627551269199
Energy: 0.4846993616379852
Energy: 0.5134047382015067
Energy: 0.4839652314748755
Energy: 0.484814054820827
Energy: 0.5864491910542323
Energy: 0.5088484279799712
Energy: 0.48580383209826616
Energy: 0.5577358464722597
Energy: 0.5266742180702778
Energy: 0.4861789487713225
Energy: 0.5608512307065625
Energy: 0.5188267135832813
Energy: 0.5191574854962366
Energy: 0.5610858654400908
Energy: 0.47751832548024564
Energy: 0.5288856191266808
Energy: 0.5789747536341198
Energy: 0.4998160449135029
Energy: 0.5002192363192304
Energy: 0.6020280568377702
Energy: 0.4995196736619972
Energy: 0.5504411342145168
Energy: 0.5248274121328295
Energy: 0.5123049077251346
Energy: 0.4935889339834297
Energy: 0.5081424642763783
Energy: 0.5099896410868447
Energy: 0.49137136486226324
Energy: 0.6833493768501974
Energy: 0.497351975796942
Energy: 0.5024508935487939
Energy: 0.5152763407392924
Energy: 0.48544135955862755
Energy: 0.5033430475382277
Energy: 0.5246140847150955
Energy: 0.5169281299993037
Energy: 0.49860127462424414
Energy: 0.5034454376505839
Energy: 0.5137587371071642
Energy: 0.47270632068872975
Energy: 0.5097504962619859
Energy: 0.5205076441595391
Energy: 0.5441038500065785
Energy: 0.5238555550722742
Energy: 0.5185536352925906
Energy: 0.5438836810137442
Energy: 0.5151848770529215
Energy: 0.5388259174714021
Energy: 0.541257979427832
Energy: 0.5141047836687187
Energy: 0.5363816304087582
Energy: 0.5217492148541281
Energy: 0.5140299925263742
Energy: 0.4740703263368122
Energy: 0.4881155373388756
Energy: 0.5167688272245012
Energy: 0.47386990717025385
Energy: 0.4840426103910923
Energy: 0.4834767901356852
Energy: 0.48522637159135956
Energy: 0.48514258390742004
Energy: 0.4600985058550004
Energy: 0.4742266721763084
Energy: 0.49444639300331694
Energy: 0.4766473542510525
Energy: 0.5157623816280561
Energy: 0.5137441080787707
Energy: 0.48896852292727444
Energy: 0.5162861660209077
Energy: 0.5115782023542242

minimum gb energy = 0.4600985058550004 eV
minimum distance =  2.62470296811328 Angstroms
sigma value = 81


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

Energy: 0.7859388347851355
Energy: 0.5242744631537365
Energy: 0.4748114608145489
Energy: 0.4742181549369219
Energy: 0.523651346845865
Energy: 0.47573893915621485
Energy: 0.44780128261377455
Energy: 0.44872771393016564
Energy: 0.48873166862827266
Energy: 0.4483499532773138
Energy: 0.449997082030307
Energy: 0.46306685998992414
Energy: 0.4475543264730647
Energy: 0.48757958552585795
Energy: 0.5122800760439157
Energy: 0.4475349598727906
Energy: 0.4451135972711148
Energy: 0.4885462283252746
Energy: 0.4501125091783303
Energy: 0.4457877692812741
Energy: 0.4880347342181157
Energy: 0.4462154703798706
Energy: 0.44514713899948805
Energy: 0.44708288386413253
Energy: 0.44665274521274995
Energy: 0.4642631340868056
Energy: 0.4920112294711841
Energy: 0.4465804418861958
Energy: 0.4638992171649914
Energy: 0.4479049384247268
Energy: 0.4929116359976619
Energy: 0.4648588182916851
Energy: 0.48751414215532113
Energy: 0.4930067044103932
Energy: 0.46324055716500373
Energy: 0.4897278570054493
Energy: 0.44689676783790044
Energy: 0.44965787996597084
Energy: 0.46512039106239766
Energy: 0.4487910966519958
Energy: 0.44941208003352734
Energy: 0.4645243590109551
Energy: 0.6468488555237625
Energy: 0.5336375364708216
Energy: 0.5076427922653222
Energy: 0.4635342012893321
Energy: 0.5316365413117665
Energy: 0.4855982605132678
Energy: 0.4478071261872383
Energy: 0.4498859816903279
Energy: 0.4633050990012636
Energy: 0.4484216586624935
Energy: 0.44964618021732244
Energy: 0.46288123699243816
Energy: 0.4910269684579687
Energy: 0.4460081220018266
Energy: 0.4455789858177348
Energy: 0.49136590051302304
Energy: 0.4460571211042222
Energy: 0.4456882468232725
Energy: 0.4484052251095047
Energy: 0.4446427208010718
Energy: 0.4449130513508337
Energy: 0.4485173167308986
Energy: 0.4613048111160316
Energy: 0.4899098021907176
Energy: 0.44482005524793355
Energy: 0.4865599060173721
Energy: 0.4880688721226501
Energy: 0.44478293106914135
Energy: 0.45000096765523034
Energy: 0.4648210495146367
Energy: 0.44477436112433255
Energy: 0.4475050956162144
Energy: 0.4476478498554963
Energy: 0.4448446549825461
Energy: 0.44698214530411184
Energy: 0.5109979654013959
Energy: 0.4487782774483967
Energy: 0.44690176350762434
Energy: 0.4465334458023845
Energy: 0.44911702257779273
Energy: 0.4493021262137077
Energy: 0.4476961900308058
Energy: 0.4486281245162653
Energy: 0.4486240929224761
Energy: 0.44761684520303174
Energy: 0.46494668905729847
Energy: 0.44856210775907135
Energy: 0.4882531387837359
Energy: 0.44767954436290364
Energy: 0.49303174288843404
Energy: 0.46392330222852984
Energy: 0.4483026579718376
Energy: 0.4491548154144072
Energy: 0.4623178456339514
Energy: 0.5228822484401239
Energy: 0.48656998482726316
Energy: 0.4879302690377727
Energy: 0.5229864226093827
Energy: 0.4617318493183722
Energy: 0.4878214513221123
Energy: 0.4470328334204417
Energy: 0.4658986755510052
Energy: 0.46635153722644307
Energy: 0.4486368504191727
Energy: 0.4497228417406686
Energy: 0.4659372485996744
Energy: 0.4465631225485042
Energy: 0.4490647419325858
Energy: 0.44521407663141627
Energy: 0.44498399076603345
Energy: 0.49253340913965077
Energy: 0.4454451532964332
Energy: 0.44750628562213157
Energy: 0.44925807950876423
Energy: 0.4452352558932608
Energy: 0.44502565916202813
Energy: 0.44911865146638885
Energy: 0.4452365549356724
Energy: 0.44661903254916563
Energy: 0.44962463606022424
Energy: 0.46419486226912277
Energy: 0.44867787136725784
Energy: 0.4491777508458599
Energy: 0.46493110959781214
Energy: 0.4476521511776167
Energy: 0.5105629115727219
Energy: 0.5092044631335664
Energy: 0.4476110021233583
Energy: 0.44598016100596266
Energy: 0.5085415749421504
Energy: 0.44528651580349043
Energy: 0.44768411918254564
Energy: 0.4470087769913945
Energy: 0.4461374123376646
Energy: 0.4485561568422687
Energy: 0.4461116365102544
Energy: 0.44678657494308555
Energy: 0.4889042013707264
Energy: 0.48951876984554765
Energy: 0.4467102192673246
Energy: 0.48825281115426594
Energy: 0.48897125173934347
Energy: 0.44636419848522463
Energy: 0.46536257913974854
Energy: 0.46424487647533413
Energy: 0.4499910428265418
Energy: 0.44862931050218446
Energy: 0.46470959931748324
Energy: 0.44725564268983625
Energy: 0.5090648989228055
Energy: 0.4639194598889427
Energy: 0.4613880931699769
Energy: 0.522402081208417
Energy: 0.4631483537629274
Energy: 0.44789967061290376
Energy: 0.48554519611983
Energy: 0.46375757986465715
Energy: 0.46082711351833544
Energy: 0.44949872544816605
Energy: 0.46299934140026283
Energy: 0.4464904925323282
Energy: 0.444457830654749
Energy: 0.46543645586623517
Energy: 0.4484760834659136
Energy: 0.446198189502769
Energy: 0.48935976599346764
Energy: 0.4484641955403245
Energy: 0.4463061111439467
Energy: 0.44599906092521674
Energy: 0.44900088750225436
Energy: 0.44647167917990216
Energy: 0.4739122670010237
Energy: 0.4476830667800131
Energy: 0.4499829471822077
Energy: 0.4632925020319433
Energy: 0.44857668203024936
Energy: 0.44923230262947256
Energy: 0.4624458061133917
Energy: 0.4450835198858822
Energy: 0.4898069373474923
Energy: 0.48890898343970957
Energy: 0.4451187883074046
Energy: 0.44720130903572225
Energy: 0.5092700875973962
Energy: 0.44935400635762335
Energy: 0.4461765986593944
Energy: 0.44606596014534183
Energy: 0.4498926823887591
Energy: 0.44831849568428883
Energy: 0.44635681776580843
Energy: 0.4482972374723151
Energy: 0.4475266902539555
Energy: 0.44726014449799806
Energy: 0.4639752533084348
Energy: 0.44642781723786085
Energy: 0.4468193343679912
Energy: 0.44953145718012955
Energy: 0.486737773741646
Energy: 0.49115761346542536
Energy: 0.4632531833253756
Energy: 0.4492763784219056
Energy: 0.464203799386152
Energy: 0.44932510356442534
Energy: 0.46292600079526225
Energy: 0.46660187660666186
Energy: 0.44932849974495326
Energy: 0.4611074675747425
Energy: 0.463398618516148
Energy: 0.5326041498627864
Energy: 0.48430493028984584
Energy: 0.4848181963924978
Energy: 0.5318251222969924
Energy: 0.462260145807561
Energy: 0.5102076010951626
Energy: 0.44876424894823097
Energy: 0.4485637338470052
Energy: 0.46530664105207215
Energy: 0.4484045419055222
Energy: 0.4503461408653697
Energy: 0.46355468863234445
Energy: 0.7854358884227065
Energy: 0.44733281696366645
Energy: 0.47505741649112865
Energy: 0.447125306162458
Energy: 0.49270943605263745
Energy: 0.47312469933877077

minimum gb energy = 0.444457830654749 eV
minimum distance =  2.71676428953685 Angstroms
sigma value = 43


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

Energy: 0.8350216447552313
Energy: 0.5810221236035377
Energy: 0.5307265547992694
Energy: 0.4978031596912493
Energy: 0.5810392882634201
Energy: 0.4983423122475006
Energy: 0.462493346147106
Energy: 0.4558419445110361
Energy: 0.5155307148440432
Energy: 0.48364940217296404
Energy: 0.45558888687463606
Energy: 0.46305324122913805
Energy: 0.46382244525524824
Energy: 0.44667494517886286
Energy: 0.44664245012732184
Energy: 0.46396731295711846
Energy: 0.4464152753590084
Energy: 0.4645318182237651
Energy: 0.4633638666674408
Energy: 0.44650680645082347
Energy: 0.46227812992910083
Energy: 0.46271370065214673
Energy: 0.49299377167651875
Energy: 0.46204988557313026
Energy: 0.4615436040754737
Energy: 0.4669979277506807
Energy: 0.48528906104405656
Energy: 0.46161939349245196
Energy: 0.463632728831024
Energy: 0.47538866716668354
Energy: 0.4627018006446636
Energy: 0.463380149160825
Energy: 0.46792979830605563
Energy: 0.46367878554068825
Energy: 0.4621120679660785
Energy: 0.5018544162375795
Energy: 0.45563571167058614
Energy: 0.4629645940232982
Energy: 0.46273181771152627
Energy: 0.4556790154181628
Energy: 0.4632127245296509
Energy: 0.46261101018013223
Energy: 0.5003475059839818
Energy: 0.4629054996565848
Energy: 0.46291469641129973
Energy: 0.4734787168752148
Energy: 0.46277960993334866
Energy: 0.48346990732897965
Energy: 0.45591516667411325
Energy: 0.4926492736264594
Energy: 0.462432873835421
Energy: 0.4559633270550469
Energy: 0.4912181367377411
Energy: 0.46317888880389674
Energy: 0.5519095281508425
Energy: 0.46138240883584086
Energy: 0.46243243574553283
Energy: 0.5521688867365931
Energy: 0.4611870157909
Energy: 0.48926748835198525
Energy: 0.4445398247433666
Energy: 0.4675472376065022
Energy: 0.4871877753510584
Energy: 0.45500011708224664
Energy: 0.5146299426189025
Energy: 0.4834369634661829
Energy: 0.4882880400172038
Energy: 0.49109386153762286
Energy: 0.4630901147787337
Energy: 0.4471801847380902
Energy: 0.49140205984334207
Energy: 0.46296638257326733
Energy: 0.4620503420044086
Energy: 0.46427622890458076
Energy: 0.47722023000391617
Energy: 0.4461735650423861
Energy: 0.49105436932928154
Energy: 0.4771190619747007
Energy: 0.44445631211474124
Energy: 0.46287742090824024
Energy: 0.5095623055978553
Energy: 0.455385980735209
Energy: 0.4830571923147127
Energy: 0.515657759843447
Energy: 0.4448271092547486
Energy: 0.5321174964622429
Energy: 0.44473763994060656
Energy: 0.4448614225400502
Energy: 0.5324862840011485
Energy: 0.4449045298174745
Energy: 0.44443277432342604
Energy: 0.44504235969208483
Energy: 0.4441432381807291
Energy: 0.4452643871776509
Energy: 0.4882790434319104
Energy: 0.4443947850318033
Energy: 0.4446864497459172
Energy: 0.4456018274890289
Energy: 0.4454848966475138
Energy: 0.44462852738182734
Energy: 0.5188588836656273
Energy: 0.4451962045588325
Energy: 0.44475873929243714
Energy: 0.48996829633583544
Energy: 0.4884044089335075
Energy: 0.4784579367968167
Energy: 0.47895045453113444
Energy: 0.44460855845424196
Energy: 0.4675995654100127
Energy: 0.514674121301848
Energy: 0.47347218141151315
Energy: 0.4739402720911368
Energy: 0.4884853807609635
Energy: 0.4618217833276783
Energy: 0.4674241984115888
Energy: 0.5142628246649584
Energy: 0.5148719936644269
Energy: 0.461154062154041
Energy: 0.4672588584022127
Energy: 0.46197004752517734
Energy: 0.44461427713901436
Energy: 0.5164913442435218
Energy: 0.4885875149079147
Energy: 0.4787086836915961
Energy: 0.46218423498831634
Energy: 0.4884496580158501
Energy: 0.5479666804445557
Energy: 0.4760822462436117
Energy: 0.5309915103750322
Energy: 0.5475792281050419
Energy: 0.4666300921389046
Energy: 0.5310311345585388
Energy: 0.4783598433958513
Energy: 0.4896875218975869
Energy: 0.48844927232111307
Energy: 0.47894853693103506
Energy: 0.4888061253425166
Energy: 0.48887670447140963
Energy: 0.4883457374085092
Energy: 0.5135375724136747
Energy: 0.47376693533316755
Energy: 0.5231821544136345
Energy: 0.44534784019282486
Energy: 0.4735831402888946
Energy: 0.4789857702891761
Energy: 0.44465021637243207
Energy: 0.44428607420868116
Energy: 0.47887240898315697
Energy: 0.4446791858051449
Energy: 0.4446384511540101
Energy: 0.4829325189229168
Energy: 0.44462060185453367
Energy: 0.44531794483269543
Energy: 0.5169832172161047
Energy: 0.44438735096107124
Energy: 0.44526299676469866
Energy: 0.48315163282398543
Energy: 0.45630424958182286
Energy: 0.44623470717266395
Energy: 0.48292475464245177
Energy: 0.4549921061880753
Energy: 0.4460855732444693
Energy: 0.48321523855810944
Energy: 0.5152411084679505
Energy: 0.46382069372793333
Energy: 0.4834272958920235
Energy: 0.4554296746611181
Energy: 0.46307200697282375
Energy: 0.49228802607341515
Energy: 0.4627582426292371
Energy: 0.46305215558461826
Energy: 0.4922260007147678
Energy: 0.49957237838819224
Energy: 0.511850407596963
Energy: 0.46314244990804776
Energy: 0.49218301720114394
Energy: 0.5151018240957529
Energy: 0.482977055962745
Energy: 0.4555267090383521
Energy: 0.46342513828342086
Energy: 0.4490925212868097
Energy: 0.5231523594969891
Energy: 0.4842000601744178
Energy: 0.47611845889376786
Energy: 0.5293660889851383
Energy: 0.44635147256677443

minimum gb energy = 0.4441432381807291 eV
minimum distance =  2.70186430256749 Angstroms
sigma value = 57


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

Energy: 0.5826567911649848
Energy: 0.5282032730846283
Energy: 0.53773568437861
Energy: 0.4648571907911309
Energy: 0.528113983343359
Energy: 0.5367687396120906
Energy: 0.4720572595680282
Energy: 0.48669221816571256
Energy: 0.5170564066404583
Energy: 0.47948935797995157
Energy: 0.486198550436095
Energy: 0.5168555440949374
Energy: 0.4688556461501278
Energy: 0.43310209660314203
Energy: 0.4330236702263702
Energy: 0.5060807675528565
Energy: 0.4332720370824771
Energy: 0.4329637569447918
Energy: 0.4700560593319544
Energy: 0.43278488499288
Energy: 0.43251925175224026
Energy: 0.46984127401633097
Energy: 0.4329029740588582
Energy: 0.4693449688562814
Energy: 0.4713127202804793
Energy: 0.4595370552952764
Energy: 0.45962878001332236
Energy: 0.47128356335899907
Energy: 0.4736507653033015
Energy: 0.47608155649221573
Energy: 0.43303159867288193
Energy: 0.4591282367872898
Energy: 0.4589488004234853
Energy: 0.46034121963805297
Energy: 0.4820297891780724
Energy: 0.4590886327848439
Energy: 0.468793845502909
Energy: 0.4809488958081298
Energy: 0.48123228862629436
Energy: 0.45858760065648463
Energy: 0.4861475699668998
Energy: 0.48138161056348244
Energy: 0.4715011465947894
Energy: 0.4877778477551037
Energy: 0.4873443671099139
Energy: 0.5123892704468098
Energy: 0.4869974630881407
Energy: 0.513874262171335
Energy: 0.449134000920915
Energy: 0.5108990839757783
Energy: 0.5137331371499834
Energy: 0.45703326202044836
Energy: 0.5105879550687753
Energy: 0.4674842774066447
Energy: 0.528329167712218
Energy: 0.473701923615733
Energy: 0.4733974564299719
Energy: 0.49397543534880684
Energy: 0.47278725280474615
Energy: 0.4728774305545227
Energy: 0.40926833457774
Energy: 0.4716136984750266
Energy: 0.46789986602536165
Energy: 0.40943152604907473
Energy: 0.44190195105809255
Energy: 0.41266133228262897
Energy: 0.4096372251933981
Energy: 0.48908653263860125
Energy: 0.48870448418782564
Energy: 0.41070850805154374
Energy: 0.4908359722147585
Energy: 0.4887808104173234
Energy: 0.40894348181088896
Energy: 0.4909953948802835
Energy: 0.4914723427227631
Energy: 0.494466636655545
Energy: 0.49013906766227605
Energy: 0.49252279563383655
Energy: 0.4091413300540703
Energy: 0.49030358237710947
Energy: 0.48997942192466337
Energy: 0.40921312826181994
Energy: 0.4898023759911459
Energy: 0.4100621428785412
Energy: 0.40988904719163277
Energy: 0.4629258770510672
Energy: 0.4620679790534179
Energy: 0.4098591368422499
Energy: 0.46491211453276127
Energy: 0.46330294677871575
Energy: 0.44605335427981385
Energy: 0.4095479628337125
Energy: 0.4093245962116237
Energy: 0.4516541322255017
Energy: 0.49118839096488326
Energy: 0.40995176894203794
Energy: 0.446609675005143
Energy: 0.47853427770500423
Energy: 0.47851772719940594
Energy: 0.4095748892792645
Energy: 0.4786761580520585
Energy: 0.4779908086460242
Energy: 0.44715645352245587
Energy: 0.48160439373894637
Energy: 0.45933058117893044
Energy: 0.40960962895681574
Energy: 0.48121616173673526
Energy: 0.4605777165851951
Energy: 0.4464170182458905
Energy: 0.4814016122061278
Energy: 0.482003021802774
Energy: 0.44811036580772673
Energy: 0.48237671196149234
Energy: 0.4829196757272609
Energy: 0.44666195747591253
Energy: 0.48374074100709513
Energy: 0.48383962001109476
Energy: 0.4768188073135547
Energy: 0.48403724366271467
Energy: 0.48351527670193956
Energy: 0.4801584739804165
Energy: 0.516507463815743
Energy: 0.5172472595739532
Energy: 0.47989279381833155
Energy: 0.48659976613658934
Energy: 0.4700807002438989
Energy: 0.5428709122609411
Energy: 0.47888566974787644
Energy: 0.4925834361313154
Energy: 0.5431292072095192
Energy: 0.4718219048686275
Energy: 0.4946253305779314
Energy: 0.4705676051483001
Energy: 0.5153987468875606
Energy: 0.5175829059903724
Energy: 0.4799537873262951
Energy: 0.48621067750122654
Energy: 0.5340138588894375
Energy: 0.4335910230219217
Energy: 0.5084564075840635
Energy: 0.5176669469285166
Energy: 0.49463058564824947
Energy: 0.5047252030083909
Energy: 0.4774357063875267

minimum gb energy = 0.40894348181088896 eV
minimum distance =  2.67489213616804 Angstroms
sigma value = 17


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

Energy: 0.5764008067892944
Energy: 0.5981519373000087
Energy: 0.5540818788843267
Energy: 0.4491483572810195
Energy: 0.5323502651008312
Energy: 0.4467530240653453
Energy: 0.45556861636196133
Energy: 0.470628355960706
Energy: 0.47019742952929966
Energy: 0.4772788417956209
Energy: 0.4756045526633902
Energy: 0.44021262342024053
Energy: 0.5933084041558137
Energy: 0.4193533960519959
Energy: 0.4196973903464762
Energy: 0.47303397752192217
Energy: 0.4196513912574847
Energy: 0.4195567633698862
Energy: 0.47524719845859953
Energy: 0.41960641870649407
Energy: 0.41954106041940586
Energy: 0.47261674407021775
Energy: 0.38810682345456776
Energy: 0.47241027812877046
Energy: 0.41158488943667976
Energy: 0.46396084560646284
Energy: 0.46542525211823566
Energy: 0.4121993911117669
Energy: 0.4636280886317114
Energy: 0.4657162338280575
Energy: 0.41961487037881434
Energy: 0.4047071703421778
Energy: 0.40438455645538984
Energy: 0.3882526946715096
Energy: 0.4044350696329942
Energy: 0.38925676802543496
Energy: 0.41158764532789927
Energy: 0.40495656953673936
Energy: 0.4039850475583798
Energy: 0.4048055426792967
Energy: 0.40657490333878477
Energy: 0.40455098396565736
Energy: 0.4045952950608294
Energy: 0.4232728238368338
Energy: 0.4234232188827734
Energy: 0.45203756241476856
Energy: 0.42200514994935995
Energy: 0.42338218442450737
Energy: 0.40538985529613586
Energy: 0.40809616593684667
Energy: 0.45145510867292815
Energy: 0.40540019745569683
Energy: 0.4131093783139634
Energy: 0.40460202031626796
Energy: 0.4038743407972481
Energy: 0.4049332012379565
Energy: 0.40426767680941234
Energy: 0.40386781617833617
Energy: 0.4048033696343469
Energy: 0.4045669343135597
Energy: 0.48771464824571636
Energy: 0.44061600908519916
Energy: 0.4045436554206992
Energy: 0.46441082424436486
Energy: 0.46982657522490623
Energy: 0.4063168633897278
Energy: 0.4684802649168213
Energy: 0.4732652745291063
Energy: 0.47287633073005025
Energy: 0.4681620141078049
Energy: 0.4732348684042973
Energy: 0.4730634065418123
Energy: 0.4682003594525074
Energy: 0.47322301608838246
Energy: 0.4733200785397513
Energy: 0.4383311571550217
Energy: 0.4728496731976038
Energy: 0.4729267507114602
Energy: 0.4774591270206101
Energy: 0.47045940872375397
Energy: 0.4711087535860847
Energy: 0.47620990832421467
Energy: 0.4704301814081249
Energy: 0.4403358165753395
Energy: 0.5382390442113216
Energy: 0.4723296566120718
Energy: 0.4680442025410905
Energy: 0.4803484864313424
Energy: 0.4721433237221261
Energy: 0.4991819779600766
Energy: 0.5463610690695181
Energy: 0.4776989237197023
Energy: 0.540455816458244
Energy: 0.4736673921136394
Energy: 0.4769572342433622
Energy: 0.4726557826933751
Energy: 0.46017194864140587
Energy: 0.47307190805526245
Energy: 0.5249908020103361
Energy: 0.4867753113424891
Energy: 0.48045161606291037
Energy: 0.5249279228881492

minimum gb energy = 0.38810682345456776 eV
minimum distance =  2.64273090184735 Angstroms
sigma value = 17


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

Energy: 0.3845162013262911
Energy: 0.5729723108799495
Energy: 0.452223112771306
Energy: 0.4490522866718072
Energy: 0.5709556073017865
Energy: 0.4541640693042368
Energy: 0.4643012236621913
Energy: 0.47580898480447353
Energy: 0.4720600832763094
Energy: 0.4743887379842758
Energy: 0.47388659167439406
Energy: 0.4438654642593814
Energy: 0.5775755907290517
Energy: 0.38113579682491266
Energy: 0.4283088614040207
Energy: 0.47597610984738997
Energy: 0.3812333647007689
Energy: 0.42819459001406945
Energy: 0.47805142398319056
Energy: 0.4283821161987465
Energy: 0.42783296424470624
Energy: 0.47834690902666455
Energy: 0.3847541184854341
Energy: 0.4280438070308262
Energy: 0.4115514654820289
Energy: 0.4066935653434498
Energy: 0.4064433175811559
Energy: 0.41218975584077794
Energy: 0.4063806493351985
Energy: 0.40717588320958775
Energy: 0.4278469918167234
Energy: 0.4059015454100496
Energy: 0.3817752311565256
Energy: 0.3813152157822972
Energy: 0.4059387643861556
Energy: 0.3812868571073366
Energy: 0.4122805946592204
Energy: 0.40545932072397295
Energy: 0.4056453291631543
Energy: 0.3839103389434163
Energy: 0.40665761670864337
Energy: 0.3986006877711821
Energy: 0.374572292416589
Energy: 0.3673116033529454
Energy: 0.37593222482961985
Energy: 0.43058371717981475
Energy: 0.36734311155777616
Energy: 0.37793023839297707
Energy: 0.3772398803126289
Energy: 0.37469513683511824
Energy: 0.37480864469989367
Energy: 0.3772211158706773
Energy: 0.3834274598251661
Energy: 0.3752928031474977
Energy: 0.3752461607726999
Energy: 0.42065052253025925
Energy: 0.4202235341973593
Energy: 0.37530642707689765
Energy: 0.41950415668753105
Energy: 0.4191214409458015
Energy: 0.38282607937783636
Energy: 0.3748595172253657
Energy: 0.4198947873096561
Energy: 0.41935395239904893
Energy: 0.3749855580974081
Energy: 0.42009563470985445
Energy: 0.37632204163081007
Energy: 0.3751044658661851
Energy: 0.3752262855502835
Energy: 0.37693205594002555
Energy: 0.3775972545989023
Energy: 0.374941110654854
Energy: 0.38203983141386866
Energy: 0.3767008337597921
Energy: 0.3761248395438937
Energy: 0.4019050081135638
Energy: 0.396214363856929
Energy: 0.37592944913000326
Energy: 0.4056833890141004
Energy: 0.4271515893279929
Energy: 0.3985798730341019
Energy: 0.4066749272115734
Energy: 0.3834552858640906
Energy: 0.4052782546700348
Energy: 0.4056275353195443
Energy: 0.37527611031054386
Energy: 0.3747714477484329
Energy: 0.40566980659222
Energy: 0.3782158112265845
Energy: 0.4053372740161229
Energy: 0.47741573536873766
Energy: 0.4071128756600011
Energy: 0.4438390442186481
Energy: 0.4605156527876288
Energy: 0.4133259141875057
Energy: 0.40786865878118783
Energy: 0.37512833601715434
Energy: 0.4758850204709186
Energy: 0.4760097677084796
Energy: 0.37583315972505443
Energy: 0.4759234228446314
Energy: 0.4049034794303647
Energy: 0.41305976743650397
Energy: 0.4764240600763991
Energy: 0.47594378541864774
Energy: 0.41320908603871104
Energy: 0.4761027856608361
Energy: 0.40589395198565636
Energy: 0.47658106316632554
Energy: 0.4725500966648288
Energy: 0.44453047857322603
Energy: 0.41565252523024815
Energy: 0.41247773171045676
Energy: 0.4067918396271001
Energy: 0.5760710480213634
Energy: 0.40640938589822795
Energy: 0.40730351674467746
Energy: 0.5262963878148716
Energy: 0.4623691512675965
Energy: 0.4762484031796066
Energy: 0.5660826441438043
Energy: 0.47213588701231496
Energy: 0.47211834207363845
Energy: 0.47683745817091877
Energy: 0.4773221297426079
Energy: 0.4729154912841975
Energy: 0.38121720510103846
Energy: 0.4766132259558296
Energy: 0.5224907536463558
Energy: 0.4280258445322439
Energy: 0.47588182594670125
Energy: 0.4280111129275142
Energy: 0.3836992495016813
Energy: 0.4769492098415522
Energy: 0.4765977080321017
Energy: 0.3847942308592855
Energy: 0.4796894115353955
Energy: 0.5221499347544304
Energy: 0.5762011531892315
Energy: 0.42116589973110663
Energy: 0.4722236113841087
Energy: 0.47707005449498147
Energy: 0.38098089117670986
Energy: 0.4765126632423102
Energy: 0.4770106855715643
Energy: 0.3813536500589812
Energy: 0.4283145532764115
Energy: 0.4770394650098183
Energy: 0.3811849703526402
Energy: 0.4282601409429553
Energy: 0.4148314121864685
Energy: 0.4068244478324512
Energy: 0.4063125317127333
Energy: 0.41426889545181655
Energy: 0.40641239371887916
Energy: 0.4429140950252964
Energy: 0.4072014425900481
Energy: 0.407155221028128
Energy: 0.4067626714907218
Energy: 0.3812514409224035
Energy: 0.4058236732708381
Energy: 0.3817028764711054
Energy: 0.37143205533903334
Energy: 0.4055762748302269
Energy: 0.40556863259854903
Energy: 0.37262066250011694
Energy: 0.40752698286093564
Energy: 0.40550495943550724
Energy: 0.46254959363585396
Energy: 0.45976188960862563
Energy: 0.46315677953897516
Energy: 0.3766392328669105
Energy: 0.4050004887980288
Energy: 0.42671713527702493
Energy: 0.37493293762379776
Energy: 0.36733407317671257
Energy: 0.37514982481430587
Energy: 0.37516584321889246
Energy: 0.36726146293724704
Energy: 0.37513024266880374
Energy: 0.3777409344660598
Energy: 0.4196581706031302
Energy: 0.41981859377314745
Energy: 0.37838218334596685
Energy: 0.41894463270108745
Energy: 0.3748701821907766
Energy: 0.37604713563227826
Energy: 0.41836421039044375
Energy: 0.41856876042443003
Energy: 0.41785470645241013
Energy: 0.37480969992245894
Energy: 0.4194825676966585
Energy: 0.3819364041329742
Energy: 0.37789093681934893
Energy: 0.3749364608046143
Energy: 0.3818836660985819
Energy: 0.37712155275622344
Energy: 0.3750848324115782
Energy: 0.40472479700784175
Energy: 0.3745844269611425
Energy: 0.37722182268717247
Energy: 0.42492025535781075
Energy: 0.37432741503386463
Energy: 0.4767957292368141
Energy: 0.4083839837072187
Energy: 0.4252919856527035
Energy: 0.4260009059246634
Energy: 0.4053514443531677
Energy: 0.47868049243788524
Energy: 0.4616108089381378
Energy: 0.4054471307654859
Energy: 0.3756121531087591
Energy: 0.4064410379346804
Energy: 0.4056212088897475
Energy: 0.3756322152539408
Energy: 0.40565569535152585
Energy: 0.5260328645484257
Energy: 0.4047125873726348
Energy: 0.4064720020954827
Energy: 0.40921282349059257
Energy: 0.3784791380413342
Energy: 0.4056860258107681
Energy: 0.37963272785276003
Energy: 0.473405784954372
Energy: 0.472908822623082
Energy: 0.40538382292319974
Energy: 0.47812872618828106
Energy: 0.472241389324074
Energy: 0.4127521425327626
Energy: 0.47599195555600254
Energy: 0.4050164219645277
Energy: 0.40533017922357895
Energy: 0.4767996820802999
Energy: 0.40625043750070217
Energy: 0.4745277710575125
Energy: 0.47628096256535074
Energy: 0.4728820844736996
Energy: 0.41468630669611195
Energy: 0.4740934753889693
Energy: 0.44231609833661745
Energy: 0.5331516945201719
Energy: 0.4050864416742279
Energy: 0.4753285306663582
Energy: 0.47675344673424186
Energy: 0.405131671644148
Energy: 0.4757480010759629
Energy: 0.5729999015447788
Energy: 0.44675261063695315
Energy: 0.4756298483455875
Energy: 0.4783955792358521
Energy: 0.4148402600960915
Energy: 0.4766919601197092
Energy: 0.38502350852299294
Energy: 0.4764314797448728
Energy: 0.47657853221454033
Energy: 0.3858598666611163
Energy: 0.47882389378823964
Energy: 0.5220517769597376

minimum gb energy = 0.36726146293724704 eV
minimum distance =  2.63784987677978 Angstroms
sigma value = 57


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

Energy: 0.46779487940278347
Energy: 0.6244072405822794
Energy: 0.4461860643641902
Energy: 0.3812998097556318
Energy: 0.6244595398638958
Energy: 0.44815102903908993
Energy: 0.4914918219095941
Energy: 0.4716931455719137
Energy: 0.40621274572127497
Energy: 0.46952808925343403
Energy: 0.46855958418921145
Energy: 0.40729080227576553
Energy: 0.5528141399734574
Energy: 0.3800895235521541
Energy: 0.3799165576965122
Energy: 0.47307302047035604
Energy: 0.43764376051515497
Energy: 0.42605694475351
Energy: 0.47056908509589646
Energy: 0.396220901867797
Energy: 0.42597096883729735
Energy: 0.4712213022181651
Energy: 0.3985486489669531
Energy: 0.4262141988950494
Energy: 0.39754587043395423
Energy: 0.4078394705126627
Energy: 0.4109653924822264
Energy: 0.3979524239800777
Energy: 0.4056085068843399
Energy: 0.40881090272480564
Energy: 0.37906396435829365
Energy: 0.40373477555623155
Energy: 0.3800813099080615
Energy: 0.35620678849876064
Energy: 0.40380861325958206
Energy: 0.3798659950956163
Energy: 0.5176994127958696
Energy: 0.4081819339644048
Energy: 0.40358927808676365
Energy: 0.4173303776315208
Energy: 0.40595232512227847
Energy: 0.3928808084580175
Energy: 0.4853348881621527
Energy: 0.3562207566465173
Energy: 0.35595610617824924
Energy: 0.38704849887769655
Energy: 0.4283662568475565
Energy: 0.369104625664107
Energy: 0.3700367517238433
Energy: 0.36903752437937015
Energy: 0.36842956988566306
Energy: 0.37116320436172945
Energy: 0.3725889893644481
Energy: 0.3683570681926939
Energy: 0.3683965919692223
Energy: 0.4428720568501765
Energy: 0.4432350465228451
Energy: 0.36838330995240504
Energy: 0.4104442665384131
Energy: 0.44351716378699274
Energy: 0.3657695379004122
Energy: 0.35300381465670455
Energy: 0.35470035486757306
Energy: 0.3534074277181739
Energy: 0.35280908733335015
Energy: 0.3541609948550027
Energy: 0.37034056957528916
Energy: 0.3571570899507439
Energy: 0.3527007604734927
Energy: 0.3711309422511841
Energy: 0.3576587532372053
Energy: 0.3968805241531395
Energy: 0.35235013360546746
Energy: 0.39621388647385297
Energy: 0.4253776555260738
Energy: 0.40595431909893787
Energy: 0.39522620077480514
Energy: 0.42874519160063673
Energy: 0.3527263979167384
Energy: 0.43190133238909356
Energy: 0.35247132938124576
Energy: 0.35373287416094684
Energy: 0.37424749068707586
Energy: 0.35256355173824394
Energy: 0.35266580460539315
Energy: 0.35489464298724177
Energy: 0.3554084086064588
Energy: 0.35272074226967615
Energy: 0.3983089488473664
Energy: 0.3536338218164004
Energy: 0.4274613616447279
Energy: 0.3686267317991954
Energy: 0.40990125500241625
Energy: 0.4020416576961341
Energy: 0.3741443916540497
Energy: 0.4405412414230774
Energy: 0.37766710019844446
Energy: 0.37464501847265164
Energy: 0.3682815478776998
Energy: 0.36841734558441924
Energy: 0.37400563128506525
Energy: 0.36835698571934855
Energy: 0.3548398930835183
Energy: 0.37503894376520003
Energy: 0.36822511632571686
Energy: 0.3554601381355131
Energy: 0.3734053441710734
Energy: 0.3688870750250619
Energy: 0.403563983112087
Energy: 0.4193695353287387
Energy: 0.40293720201225275
Energy: 0.4047443554947778
Energy: 0.3778306054227481
Energy: 0.403618175551244
Energy: 0.5103960418883225
Energy: 0.38324638399633815
Energy: 0.41970423631326037
Energy: 0.45371403297222246
Energy: 0.3698898210319727
Energy: 0.40340593052680546
Energy: 0.5116340038242019
Energy: 0.4050662997921744
Energy: 0.43820864476329824
Energy: 0.42406062322692545
Energy: 0.45599804046617043
Energy: 0.4076533571853227
Energy: 0.396689286731238
Energy: 0.4673712131617936
Energy: 0.40356073619433014
Energy: 0.4339401802537709
Energy: 0.47578936970258406
Energy: 0.4032577734878212
Energy: 0.3711304895222543
Energy: 0.47389909171070743
Energy: 0.46767393968040316
Energy: 0.37344710195828773
Energy: 0.4711318157083566
Energy: 0.4679634476537826
Energy: 0.5066812552313164
Energy: 0.40306320109683125
Energy: 0.4233164738773257
Energy: 0.40732009907080613
Energy: 0.4250739036248497
Energy: 0.4221025302806246
Energy: 0.5572391213599355
Energy: 0.4036970129354724
Energy: 0.40386535401901014
Energy: 0.4785200980882501
Energy: 0.4032090911012553
Energy: 0.46713266861650055
Energy: 0.5000578291121746
Energy: 0.47015615176421344
Energy: 0.4636067489865822
Energy: 0.4680737013245769
Energy: 0.4682379941379393
Energy: 0.46444556483372235
Energy: 0.40113882152473934
Energy: 0.46777663353775456
Energy: 0.4263802156036873
Energy: 0.37947503917856606
Energy: 0.4669420829787249
Energy: 0.42609029944501375

minimum gb energy = 0.35235013360546746 eV
minimum distance =  2.64315116282282 Angstroms
sigma value = 43


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

Energy: 0.4213503031615601
Energy: 0.4609391888668164
Energy: 0.41549162398923745
Energy: 0.4061157416358872
Energy: 0.4852225772739923
Energy: 0.3764545833110897
Energy: 0.4401966714670352
Energy: 0.3860020824644211
Energy: 0.3854322686483285
Energy: 0.4213450082748651
Energy: 0.3759019844181574
Energy: 0.3940250497654649
Energy: 0.48652218745629267
Energy: 0.35513484622341296
Energy: 0.36208709161509395
Energy: 0.4238615958330935
Energy: 0.37927644945879435
Energy: 0.3538455329118904
Energy: 0.4172330641808985
Energy: 0.39572015153568135
Energy: 0.3620165128654507
Energy: 0.375525531481312
Energy: 0.3537236404666403
Energy: 0.3925454951396945
Energy: 0.4186530995902586
Energy: 0.3732580958419749
Energy: 0.3735413084317773
Energy: 0.4188380594955378
Energy: 0.37551823601974726
Energy: 0.3951829372977456
Energy: 0.32949188585186723
Energy: 0.37319107202277296
Energy: 0.3539694521745296
Energy: 0.38216193177828645
Energy: 0.37317507874205735
Energy: 0.32899122961227223
Energy: 0.46100235418725394
Energy: 0.37241213471059686
Energy: 0.37231666189262214
Energy: 0.36196208302241667
Energy: 0.3758712048467191
Energy: 0.3840408660530225
Energy: 0.4360661853275681
Energy: 0.3720802906608389
Energy: 0.3812812908666479
Energy: 0.3522699648317767
Energy: 0.3712697180579412
Energy: 0.329199284861403
Energy: 0.3430807829457968
Energy: 0.3797660673158298
Energy: 0.3414888462571987
Energy: 0.3440306894388752
Energy: 0.3137928945968797
Energy: 0.34206321068789697
Energy: 0.33038046055431525
Energy: 0.36298017737652516
Energy: 0.38646753613385926
Energy: 0.341732997733068
Energy: 0.32366573261788817
Energy: 0.38607743255502097
Energy: 0.3037972455361986
Energy: 0.32190962222789576
Energy: 0.32194044441948
Energy: 0.3693510700884052
Energy: 0.3220839769024125
Energy: 0.31647232520830226
Energy: 0.3442882166873757
Energy: 0.32216371824710605
Energy: 0.32183683781459177
Energy: 0.35719845857520965
Energy: 0.3227180986885266
Energy: 0.3858223417512178
Energy: 0.41358240844022426
Energy: 0.37280411354220044
Energy: 0.3733481977530705
Energy: 0.39645277845860977
Energy: 0.36886530570478976
Energy: 0.34815883919577956
Energy: 0.3102279065327563
Energy: 0.36395479050473667
Energy: 0.3098276837645019
Energy: 0.3113293906538024
Energy: 0.3235668313728229
Energy: 0.30999321312909556
Energy: 0.30956522977726053
Energy: 0.36958743939337163
Energy: 0.3703936338669585
Energy: 0.30965559726115305
Energy: 0.3043600535965839
Energy: 0.36920426670031326
Energy: 0.3049474053647147
Energy: 0.3044989293662775
Energy: 0.30422424886982463
Energy: 0.3675621288269115
Energy: 0.3046072120356198
Energy: 0.3709482696202913
Energy: 0.3115214736587487
Energy: 0.3045009816626662
Energy: 0.3043080268758578
Energy: 0.3063354033464556
Energy: 0.3047023686229471
Energy: 0.3712758963246632
Energy: 0.3056464398070137
Energy: 0.37142964774234527
Energy: 0.3719673799402701
Energy: 0.30570377547675454
Energy: 0.37115334976835285
Energy: 0.3722399172759768
Energy: 0.30450923989693235
Energy: 0.39905366526764047
Energy: 0.3043123654146306
Energy: 0.3055701177189423
Energy: 0.4146061082607919
Energy: 0.3045433743730857
Energy: 0.40610235540819634
Energy: 0.3766656196619615
Energy: 0.37671538048486486
Energy: 0.4072758067226139
Energy: 0.3705473343489013
Energy: 0.3737205764412067
Energy: 0.3233383858892368
Energy: 0.310214528453617
Energy: 0.30987670187159105
Energy: 0.39173325146325993
Energy: 0.310278045550762
Energy: 0.37549916659552285
Energy: 0.3049245096193972
Energy: 0.31023983355692963
Energy: 0.309763042923006
Energy: 0.36895291741638747
Energy: 0.31023293346779085
Energy: 0.311295531203115
Energy: 0.32170205399940005
Energy: 0.3109360188174074
Energy: 0.31095905351049175
Energy: 0.3216058580076708
Energy: 0.3111292930695484
Energy: 0.37062881424817035
Energy: 0.32206525643271405
Energy: 0.36051681241539435
Energy: 0.3217278678004917
Energy: 0.3231041763823028
Energy: 0.3429562337024589
Energy: 0.32195542952485023
Energy: 0.42267506407905286
Energy: 0.3730305478715837
Energy: 0.35203899875863087
Energy: 0.3406706877147356
Energy: 0.3704766964332868
Energy: 0.32225909441214023
Energy: 0.39811519875794305
Energy: 0.34204699116126674
Energy: 0.34174188786356163
Energy: 0.33064457445127204
Energy: 0.3422864142863761
Energy: 0.39947762307670015
Energy: 0.32928528634857784
Energy: 0.34164557372922716
Energy: 0.3415184787965652
Energy: 0.37060956511533216
Energy: 0.34190014597481116
Energy: 0.3220339302069876
Energy: 0.3876401583935865
Energy: 0.3419889535557692
Energy: 0.3678583420742961
Energy: 0.4000280549012355
Energy: 0.3443717110381778
Energy: 0.3868895825373097
Energy: 0.37475026802694555
Energy: 0.38712199025453914
Energy: 0.3732740334718171
Energy: 0.37572674938368605
Energy: 0.3218565050067876
Energy: 0.373530503818671
Energy: 0.4548569160692045
Energy: 0.37643865309274727
Energy: 0.3772825690911099
Energy: 0.3733097211033654
Energy: 0.3769189253481924
Energy: 0.3420282130084298
Energy: 0.4540824434340789
Energy: 0.37526197404537776
Energy: 0.39456957122452824
Energy: 0.37506928742386086
Energy: 0.3859206815304238
Energy: 0.39586559106213787
Energy: 0.34196391355276906
Energy: 0.4239066833983698
Energy: 0.3730198137485461
Energy: 0.3883475687352944
Energy: 0.4239484078176915
Energy: 0.3419390442606352
Energy: 0.4294852284558318
Energy: 0.42437717390489416
Energy: 0.42371649143256157
Energy: 0.37323661558407406
Energy: 0.4257379409100412
Energy: 0.42228812424833045
Energy: 0.45171882008081543
Energy: 0.394424032646391
Energy: 0.3731197413631842
Energy: 0.3757428645400127
Energy: 0.37277414376632945
Energy: 0.4233118356173537
Energy: 0.4867505253156443
Energy: 0.36815630204426375
Energy: 0.3808317817045089
Energy: 0.42405129343852677
Energy: 0.38728237956105327
Energy: 0.373558978934217
Energy: 0.4401461005587918
Energy: 0.4220824747917215
Energy: 0.4216133873846727
Energy: 0.42112474740522315
Energy: 0.4260530758665935
Energy: 0.43190464040681004

minimum gb energy = 0.3037972455361986 eV
minimum distance =  2.62216961144795 Angstroms
sigma value = 81


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

Energy: 0.05849691948434219
Energy: 0.060778650858959296
Energy: 0.05885241191270322
Energy: 0.059990827746934705
Energy: 0.061706667410432334
Energy: 0.058770315686973926
Energy: 0.08480020061044567
Energy: 0.060677894407519445
Energy: 0.06083172401258751
Energy: 0.08500402679784823
Energy: 0.06230736316237168
Energy: 0.06119816156217751
Energy: 0.08409480733358828
Energy: 0.05871963998344742
Energy: 0.05891136836503606
Energy: 0.08390832332302234
Energy: 0.05880803528978674
Energy: 0.08340491923824978
Energy: 0.062106851431905245
Energy: 0.05894029377075361
Energy: 0.05877716879180175
Energy: 0.06222990704754905
Energy: 0.05897340715975295
Energy: 0.08378888192109667
Energy: 0.0833990751856705
Energy: 0.08405245432423987
Energy: 0.0843696947880332
Energy: 0.08412492197453719
Energy: 0.08415344606969129
Energy: 0.08410308488596518
Energy: 0.05930713515082626
Energy: 0.061117746195180525
Energy: 0.058749440920826144
Energy: 0.060588595540762985
Energy: 0.06136204631709273
Energy: 0.05886373426084168
Energy: 0.08414128620252657
Energy: 0.0607007565421117
Energy: 0.060875240207805055
Energy: 0.0841964136392805
Energy: 0.06118419459639717
Energy: 0.061150659073786404
Energy: 0.08424598606562154
Energy: 0.058818395313601106
Energy: 0.05884917975050173
Energy: 0.08418553978765654
Energy: 0.058694874273520915
Energy: 0.08397412957990545
Energy: 0.06133937430775865
Energy: 0.058882049933099
Energy: 0.08489197700893009
Energy: 0.062193231553956965
Energy: 0.05876207308817188
Energy: 0.08476295319546469
Energy: 0.058583529765187776
Energy: 0.08374907541177443
Energy: 0.08379045448103892
Energy: 0.05870006775573846
Energy: 0.08367587586601641
Energy: 0.0839554473467308

minimum gb energy = 0.05849691948434219 eV
minimum distance =  2.82679515823952 Angstroms
sigma value = 3


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

Energy: 0.41311051649190783
Energy: 0.43554123801574207
Energy: 0.45119744244102555
Energy: 0.38823082925605285
Energy: 0.43534032112450627
Energy: 0.3888130303322487
Energy: 0.40819848137885345
Energy: 0.4256767365271019
Energy: 0.42528995509286005
Energy: 0.42526377186961745
Energy: 0.42753357265902986
Energy: 0.3935453873741275
Energy: 0.43944319188988346
Energy: 0.4121019838011184
Energy: 0.3931849837449945
Energy: 0.42543667153488013
Energy: 0.4109524619058602
Energy: 0.42661108764352973
Energy: 0.406149233995088
Energy: 0.4110155305451342
Energy: 0.41215592108718135
Energy: 0.4070861997972692
Energy: 0.3549972564832578
Energy: 0.4263672210075901
Energy: 0.3564859564847781
Energy: 0.42554810833093554
Energy: 0.4302783101906152
Energy: 0.3564343503113547
Energy: 0.4268330325339832
Energy: 0.39293789260556927
Energy: 0.3303515767320931
Energy: 0.3927136576399074
Energy: 0.3947996398289617
Energy: 0.3336736874933417
Energy: 0.39280610338562927
Energy: 0.3613067995552356
Energy: 0.39335546017208955
Energy: 0.35819397247362633
Energy: 0.35828312502823084
Energy: 0.3933751150893889
Energy: 0.3595642405294839
Energy: 0.39390308474128305
Energy: 0.4091247722504149
Energy: 0.35843412357782833
Energy: 0.3783158185503282
Energy: 0.4102358369703433
Energy: 0.33331004394356323
Energy: 0.3779493709586196
Energy: 0.33411599804405745
Energy: 0.40032692024971683
Energy: 0.37845506766126064
Energy: 0.41548128416354246
Energy: 0.3306377662007165
Energy: 0.377210168208096
Energy: 0.33147088165303723
Energy: 0.3594480316923516
Energy: 0.3590528069966165
Energy: 0.3315291839472105
Energy: 0.36392540291233433
Energy: 0.3591093314024911
Energy: 0.35771136447998936
Energy: 0.40202091928549766
Energy: 0.37701868667157046
Energy: 0.3326982681188945
Energy: 0.3160715879617776
Energy: 0.3334895507178994
Energy: 0.3313360720848422
Energy: 0.40307427035390714
Energy: 0.40242042766903646
Energy: 0.3313880529027037
Energy: 0.35994960857692276
Energy: 0.33147800772063135
Energy: 0.33316966435411866
Energy: 0.31583357746293256
Energy: 0.33406682375801255
Energy: 0.3332776867531572
Energy: 0.34001728073530085
Energy: 0.33313057660646567
Energy: 0.3893600693079226
Energy: 0.3149888599068719
Energy: 0.3905213603086994
Energy: 0.3587252779611609
Energy: 0.3143215624203175
Energy: 0.39064033642515555
Energy: 0.3887148639706851
Energy: 0.315260788723151
Energy: 0.3150749311996381
Energy: 0.38645252855427836
Energy: 0.3169133181030598
Energy: 0.3146712716680987
Energy: 0.3497974646153045
Energy: 0.39292769532075117
Energy: 0.3918583761048279
Energy: 0.3896100919201827
Energy: 0.3896985013349828
Energy: 0.3901831814425385
Energy: 0.308326156959371
Energy: 0.3860155741438109
Energy: 0.3830241389569563
Energy: 0.3063386768374271
Energy: 0.384752415769644
Energy: 0.30628523686132114
Energy: 0.30638165934577855
Energy: 0.3844030025041293
Energy: 0.3826659222008106
Energy: 0.3064075418507398
Energy: 0.35224029192864625
Energy: 0.34743226500737684
Energy: 0.3853793734659356
Energy: 0.30759083360368905
Energy: 0.3844873564454806
Energy: 0.3654745078419714
Energy: 0.30714366500190615
Energy: 0.38308050020691053
Energy: 0.3816673056821251
Energy: 0.3063065230966096
Energy: 0.30617521136609444
Energy: 0.3826112537935971
Energy: 0.3082054668082135
Energy: 0.30619213795228895
Energy: 0.39003073485425166
Energy: 0.38790459174107184
Energy: 0.3925342933646504
Energy: 0.3865438728953458
Energy: 0.3638043050560641
Energy: 0.39070695725049015
Energy: 0.31601450072635995
Energy: 0.38972063115849337
Energy: 0.3154346893946817
Energy: 0.31670402833898864
Energy: 0.3946053636716177
Energy: 0.31513244505971294
Energy: 0.3142692426789477
Energy: 0.38922319830918956
Energy: 0.3894078965586656
Energy: 0.314299633566415
Energy: 0.39068515053619957
Energy: 0.39043160252914455
Energy: 0.38972094124569645
Energy: 0.3331976842907637
Energy: 0.33331064940217286
Energy: 0.32148525495599384
Energy: 0.33318238849530235
Energy: 0.3222812420574676
Energy: 0.35935760972498315
Energy: 0.3315496517420642
Energy: 0.3314829818145442
Energy: 0.3579808916316946
Energy: 0.3326517616773717
Energy: 0.3315492259124731
Energy: 0.4081565100307364
Energy: 0.34223305001820564
Energy: 0.36060259351833357
Energy: 0.31656206618012933
Energy: 0.3211512802649713
Energy: 0.4030941328386648
Energy: 0.3624855755477949
Energy: 0.39531506397484845
Energy: 0.3709333411714753
Energy: 0.363480814549439
Energy: 0.32013571562296106
Energy: 0.3620844209096466
Energy: 0.3418173874889714
Energy: 0.4159153707497519
Energy: 0.3777900593360917
Energy: 0.341837442743136
Energy: 0.3777922591223222
Energy: 0.37811779055065664
Energy: 0.32263689903444837
Energy: 0.39560998278403847
Energy: 0.3809073871178569
Energy: 0.3226031011220661
Energy: 0.39526510885410665
Energy: 0.3437439300539354
Energy: 0.3580011099053305
Energy: 0.3602112093752582
Energy: 0.3607753460785914
Energy: 0.35798696684541503
Energy: 0.39386442007142186
Energy: 0.39620839715145756
Energy: 0.36274017240538986
Energy: 0.3750903544739394
Energy: 0.37491083228306
Energy: 0.40421689803433575
Energy: 0.3675578162412189
Energy: 0.3947935730653679
Energy: 0.43936990497842743
Energy: 0.40718214105475464
Energy: 0.3430644066909121
Energy: 0.4269125163541558
Energy: 0.3408785108316491
Energy: 0.40098203366269697
Energy: 0.37034413423862483
Energy: 0.3954691850667026
Energy: 0.39415489435875706
Energy: 0.3703579992682636
Energy: 0.3951784897124747
Energy: 0.40613514308182863

minimum gb energy = 0.30617521136609444 eV
minimum distance =  2.62303559688618 Angstroms
sigma value = 67


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

Energy: 0.4329896309087355
Energy: 0.5094787852011283
Energy: 0.4869366735039019
Energy: 0.41770751925061306
Energy: 0.5838835663973133
Energy: 0.41031235725957893
Energy: 0.5020748387504039
Energy: 0.4891693102958102
Energy: 0.4854798787057138
Energy: 0.4868390446199517
Energy: 0.4876641352452102
Energy: 0.4847349026289755
Energy: 0.5049392578675552
Energy: 0.4676116942533951
Energy: 0.4875033706527573
Energy: 0.4934262768744208
Energy: 0.4675496507447611
Energy: 0.48777719916373646
Energy: 0.4434969656094049
Energy: 0.4877856746506795
Energy: 0.4873767674219213
Energy: 0.44449045596291964
Energy: 0.3892457909817681
Energy: 0.4871355628050799
Energy: 0.4375367907694742
Energy: 0.4888532319658771
Energy: 0.4404774875324738
Energy: 0.43766336595749394
Energy: 0.4893687801289023
Energy: 0.48849629324892313
Energy: 0.37116463138460026
Energy: 0.44134737351264697
Energy: 0.47526876960141995
Energy: 0.3918872540068832
Energy: 0.44088294172838427
Energy: 0.4414691136638337
Energy: 0.4435880806236286
Energy: 0.44567957658197654
Energy: 0.44125541125795753
Energy: 0.4440148544357123
Energy: 0.39262035240505583
Energy: 0.44275833833894485
Energy: 0.4455152804199623
Energy: 0.46814216388276275
Energy: 0.3905253406431022
Energy: 0.4463639302522464
Energy: 0.3671734587465928
Energy: 0.44314051456356734
Energy: 0.4627922581963192
Energy: 0.46797474564950425
Energy: 0.4677273510214568
Energy: 0.46979254523629793
Energy: 0.39011025229613433
Energy: 0.476927738628102
Energy: 0.41663778736943635
Energy: 0.3933144998135976
Energy: 0.39059965028302346
Energy: 0.4167549117861132
Energy: 0.3926017851534098
Energy: 0.39034381634921506
Energy: 0.41535901330516223
Energy: 0.46473675426798927
Energy: 0.4661319522805363
Energy: 0.36680229422683497
Energy: 0.42654105855916596
Energy: 0.4668629626971327
Energy: 0.3684701342641078
Energy: 0.45586823855316416
Energy: 0.4534560100813453
Energy: 0.36910541436876654
Energy: 0.4175399122947574
Energy: 0.3657396182440079
Energy: 0.36845664261605077
Energy: 0.45488822337396884
Energy: 0.3679387992053729
Energy: 0.36911608877554813
Energy: 0.36842920572846083
Energy: 0.3654342869495381
Energy: 0.44717923883331456
Energy: 0.41707893359529885
Energy: 0.4531808586493353
Energy: 0.3669221668993122
Energy: 0.3668064144539894
Energy: 0.45186758307275904
Energy: 0.44906897055336864
Energy: 0.3683155081436302
Energy: 0.36560247168603727
Energy: 0.4486554165318379
Energy: 0.36794400584033227
Energy: 0.36572630517881877
Energy: 0.4470999952037964
Energy: 0.4646734266077409
Energy: 0.4600124152715386
Energy: 0.4171081842339392
Energy: 0.36547411881396613
Energy: 0.46126192209722366
Energy: 0.39237782477420036
Energy: 0.45893708577508063
Energy: 0.41670390720393646
Energy: 0.3935858925846623
Energy: 0.3611367909830219
Energy: 0.39017493739313597
Energy: 0.3904820018073759
Energy: 0.46853329664254595
Energy: 0.4749346666216866
Energy: 0.39082649060511926
Energy: 0.46894295114739465
Energy: 0.3902803555772547
Energy: 0.44920185694806486
Energy: 0.47449363296362695
Energy: 0.44114876777398404
Energy: 0.37321147512471514
Energy: 0.4877170428800591
Energy: 0.4089912973858037
Energy: 0.38995528324140644
Energy: 0.4410823019489801
Energy: 0.39412175020806245
Energy: 0.3905606751042449
Energy: 0.44304973017416455
Energy: 0.44218319126062516
Energy: 0.44363545692996126
Energy: 0.4724806677547538
Energy: 0.4731362599853795
Energy: 0.4448263985737947
Energy: 0.4590587287167329
Energy: 0.4237424578604527
Energy: 0.504831949313884
Energy: 0.46635412807225324
Energy: 0.47294027746535133
Energy: 0.4929650534519718
Energy: 0.4619399317438372
Energy: 0.47513649553856946
Energy: 0.47320842084428777
Energy: 0.44044810388422184
Energy: 0.4384011700598167
Energy: 0.4733437181596286
Energy: 0.4395016858110215
Energy: 0.43866923072229835

minimum gb energy = 0.3611367909830219 eV
minimum distance =  2.6194087174798 Angstroms
sigma value = 33


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

Energy: 0.4945168681659905
Energy: 0.4502399709429839
Energy: 0.5587549027510577
Energy: 0.5349908453283388
Energy: 0.45082332362201205
Energy: 0.4957000318562308
Energy: 0.5400694965824129
Energy: 0.5092753971148442
Energy: 0.5087592727226605
Energy: 0.510970353432989
Energy: 0.5103139365348155
Energy: 0.5088850976015548
Energy: 0.5425758435312413
Energy: 0.449694682636395
Energy: 0.5206529545254109
Energy: 0.5140426921997459
Energy: 0.4517071621045437
Energy: 0.5098388475119661
Energy: 0.5115441573757836
Energy: 0.48644286852896285
Energy: 0.519811008893668
Energy: 0.5122724223157773
Energy: 0.44936717095928813
Energy: 0.5199669737712025
Energy: 0.44808545640883773
Energy: 0.5089264159731793
Energy: 0.5080833142517014
Energy: 0.4481957698709816
Energy: 0.5095183147726676
Energy: 0.5192674496400916
Energy: 0.5122225339580564
Energy: 0.4653344604339122
Energy: 0.46104822586781513
Energy: 0.4019133057754608
Energy: 0.4651253735937731
Energy: 0.45025297461305724
Energy: 0.4483947749842578
Energy: 0.4650030120023672
Energy: 0.4627796126037335
Energy: 0.44837572036837947
Energy: 0.458434241717261
Energy: 0.4629826381356983
Energy: 0.45072611053734135
Energy: 0.39869614589811747
Energy: 0.4056411752325534
Energy: 0.4515590522243876
Energy: 0.4018683882056017
Energy: 0.4499420906608587
Energy: 0.4415199419205324
Energy: 0.4976847120248777
Energy: 0.501937976398325
Energy: 0.4061073427371055
Energy: 0.3992383921657195
Energy: 0.4999480049437993
Energy: 0.4860604758313444
Energy: 0.3996889703335648
Energy: 0.39970602709789704
Energy: 0.48738478707903893
Energy: 0.4000991643240408
Energy: 0.39915512082306953
Energy: 0.4413506614598348
Energy: 0.4510009592342484
Energy: 0.4895514947508487
Energy: 0.4016661635477905
Energy: 0.39935796628305636
Energy: 0.4884168658279595
Energy: 0.3989423754347714
Energy: 0.43939080990987744
Energy: 0.3992072354804001
Energy: 0.39920415094341344
Energy: 0.4883306740491011
Energy: 0.39924808913407084
Energy: 0.3990644873441655
Energy: 0.49657560900117076
Energy: 0.39916033058498024
Energy: 0.39918259277850043
Energy: 0.40614135287053166
Energy: 0.3992933771086572
Energy: 0.38632865791743676
Energy: 0.5101248972538219
Energy: 0.40570391231927794
Energy: 0.3892859046537124
Energy: 0.47477458850514465
Energy: 0.412377839586012
Energy: 0.3874546030893748
Energy: 0.4485237264171507
Energy: 0.44860636981879715
Energy: 0.387703344991861
Energy: 0.4517938043468701
Energy: 0.4542014578193087
Energy: 0.452468559883818
Energy: 0.5062648983404133
Energy: 0.5069851640566464
Energy: 0.45676619368177307
Energy: 0.4106870821331048
Energy: 0.4628627827297884
Energy: 0.5291038828794142
Energy: 0.41025070944587777
Energy: 0.5114620626246215
Energy: 0.5119563136596186
Energy: 0.41328105605097976
Energy: 0.49321197394993943
Energy: 0.5404112063557469
Energy: 0.5090860821873814
Energy: 0.5092508412561045
Energy: 0.5105385493938399
Energy: 0.5111789559629953
Energy: 0.5078649558732579
Energy: 0.5291112254456485
Energy: 0.45015492552985825
Energy: 0.41253843947038255
Energy: 0.4139102341856044
Energy: 0.44992129648646934
Energy: 0.5013741621139391
Energy: 0.4838746586067993
Energy: 0.5089696417119326
Energy: 0.5080969861280261
Energy: 0.4838941110122135
Energy: 0.5098787543975134
Energy: 0.5088310738688829
Energy: 0.5488251834942232
Energy: 0.4869017489601044
Energy: 0.5197635427660913
Energy: 0.5128753730105096
Energy: 0.461574035477823
Energy: 0.5097445917146614
Energy: 0.513173020827722
Energy: 0.4498489300078298
Energy: 0.5202372421584898
Energy: 0.5142008527454045
Energy: 0.45321912679469323
Energy: 0.5205904834991957
Energy: 0.4482022125468863
Energy: 0.5088367612809962
Energy: 0.508389655088279
Energy: 0.4483505700768851
Energy: 0.5102163989895617
Energy: 0.5199262075729975
Energy: 0.40094609278597076
Energy: 0.4654820897483237
Energy: 0.46555397787752556
Energy: 0.40017546624515926
Energy: 0.4598245418908623
Energy: 0.4571744412860507
Energy: 0.4480704898924347
Energy: 0.5213100211133553
Energy: 0.5207684695557397
Energy: 0.44806399457726537
Energy: 0.520084935356454
Energy: 0.4630342096342372
Energy: 0.45093173072684023
Energy: 0.39861838883367345
Energy: 0.45405715127568874
Energy: 0.4505071013112025
Energy: 0.4015163354216394
Energy: 0.4500754020662849
Energy: 0.42819942858094906
Energy: 0.45720252563614366
Energy: 0.4996935164525775
Energy: 0.40672241791186164
Energy: 0.3990754519526463
Energy: 0.5018932955604601
Energy: 0.4861000200405464
Energy: 0.39983141228323454
Energy: 0.39952729315703994
Energy: 0.4873825252464327
Energy: 0.4007708523541413
Energy: 0.39915813537578904
Energy: 0.4415888571592699
Energy: 0.3992271900148994
Energy: 0.40892429681530773
Energy: 0.3989884554303739
Energy: 0.39922968961321414
Energy: 0.4896876088806366
Energy: 0.39892009578318793
Energy: 0.40045479236381054
Energy: 0.39911061236820633
Energy: 0.399028343976227
Energy: 0.48758804161064395
Energy: 0.39907923888284663
Energy: 0.40224442171052927
Energy: 0.49704275784490193
Energy: 0.3994614424271377
Energy: 0.3992141780060547
Energy: 0.4061022877687804
Energy: 0.3992496661047288
Energy: 0.3863292160783447
Energy: 0.5059394690988159
Energy: 0.5058742913854611
Energy: 0.38886769918332764
Energy: 0.47492420578592304
Energy: 0.49007182288051465
Energy: 0.3871760263550008
Energy: 0.45428732069385597
Energy: 0.44831723521868067
Energy: 0.38733075437813436
Energy: 0.4511206804141063
Energy: 0.46327732103179253
Energy: 0.4544446986995504
Energy: 0.412612125974247
Energy: 0.46273350781243383
Energy: 0.4553122664370625
Energy: 0.41078605904758325
Energy: 0.46252530615167914
Energy: 0.5288946498743425
Energy: 0.41024136770415265
Energy: 0.5121218824729837
Energy: 0.5286304025726277
Energy: 0.38608067719849837
Energy: 0.5021986152126955
Energy: 0.540539676126013
Energy: 0.44831001129107867
Energy: 0.44841185352247814
Energy: 0.5107936606727538
Energy: 0.4484968122575229
Energy: 0.5210587251448741
Energy: 0.5306793247939274
Energy: 0.450622487639505
Energy: 0.41482359996791246
Energy: 0.41276823174647415
Energy: 0.4503169490151713
Energy: 0.5010141829796851

minimum gb energy = 0.38608067719849837 eV
minimum distance =  2.62815164231402 Angstroms
sigma value = 41


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

Energy: 0.6428703466424799
Energy: 0.522126371254672
Energy: 0.5876788983817738
Energy: 0.5521782547529023
Energy: 0.5218421307426325
Energy: 0.5893856263041288
Energy: 0.5685965561719636
Energy: 0.5236086200850858
Energy: 0.5219699769284832
Energy: 0.5230608602237553
Energy: 0.5227345691912728
Energy: 0.5222854251464496
Energy: 0.5685052851584547
Energy: 0.4571632162058719
Energy: 0.5416100680375296
Energy: 0.5227309379799959
Energy: 0.45816306780673943
Energy: 0.5205860732813412
Energy: 0.5224545115574654
Energy: 0.500819843435595
Energy: 0.5408878452482455
Energy: 0.5233135155144081
Energy: 0.4598880233173389
Energy: 0.45859135663618544
Energy: 0.4557112224611018
Energy: 0.5238513545988605
Energy: 0.5222269302086853
Energy: 0.4560899938222167
Energy: 0.5224058974175259
Energy: 0.5035426369011774
Energy: 0.5344771465849815
Energy: 0.5373001885153365
Energy: 0.5438460642167421
Energy: 0.47511427020561336
Energy: 0.5364924738506407
Energy: 0.542843387733658
Energy: 0.4560321873890503
Energy: 0.5037664712392553
Energy: 0.5030178760846924
Energy: 0.455755623363287
Energy: 0.5410146531322848
Energy: 0.45650276740662565
Energy: 0.45731972212963584
Energy: 0.4389185042204881
Energy: 0.456745514397433
Energy: 0.4580449164255928
Energy: 0.4806536438363372
Energy: 0.4568614102991205
Energy: 0.5175781898807359
Energy: 0.496364620413647
Energy: 0.5365404728044887
Energy: 0.5213159494597343
Energy: 0.4563382198763008
Energy: 0.44006867546457323
Energy: 0.4826007036480114
Energy: 0.45976332205517334
Energy: 0.45739967200524584
Energy: 0.48334083098811076
Energy: 0.4567211211145738
Energy: 0.4569780834223254
Energy: 0.5347626985367877
Energy: 0.45635557422860373
Energy: 0.4563473628229851
Energy: 0.5377541245632614
Energy: 0.42455180988913827
Energy: 0.5026755886499754
Energy: 0.5417614492175666
Energy: 0.5381105467549894
Energy: 0.5147696831163499
Energy: 0.5416774795199212
Energy: 0.42437703964427154
Energy: 0.5138364754621442
Energy: 0.5732115823571811
Energy: 0.5219140189309748
Energy: 0.4704423203482398
Energy: 0.5239034546120834
Energy: 0.5227123015472254
Energy: 0.5220836395051608
Energy: 0.5480350149415774
Energy: 0.521251849961494
Energy: 0.5482728761507466
Energy: 0.4287959371134153
Energy: 0.5216442368611968
Energy: 0.5480079788665216

minimum gb energy = 0.42437703964427154 eV
minimum distance =  2.67397564115282 Angstroms
sigma value = 11


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

Energy: 0.7993077609810847
Energy: 0.671808787243108
Energy: 0.5887988745669156
Energy: 0.5435346195729212
Energy: 0.6743858298760719
Energy: 0.6250696554069264
Energy: 0.6395875809992249
Energy: 0.500206930034277
Energy: 0.5004966884405034
Energy: 0.5407378909042937
Energy: 0.5003362510996917
Energy: 0.5007684637042649
Energy: 0.6210778512058928
Energy: 0.5325993677951208
Energy: 0.5319772436442792
Energy: 0.5697141091351894
Energy: 0.5278300345216876
Energy: 0.534602179999051
Energy: 0.5348767681903233
Energy: 0.5046510419853578
Energy: 0.5110952961216607
Energy: 0.5348527172168381
Energy: 0.5276228946315376
Energy: 0.5181627991737909
Energy: 0.5370406709987063
Energy: 0.5005721786507301
Energy: 0.5006162756539899
Energy: 0.537047842698333
Energy: 0.5010426472155383
Energy: 0.5003698574280102
Energy: 0.5347020936022087
Energy: 0.5070001995358656
Energy: 0.5071001391042598
Energy: 0.5008981596707742
Energy: 0.5071562732937964
Energy: 0.5072344887392377
Energy: 0.5069784805715131
Energy: 0.5157689542307307
Energy: 0.5075681844383909
Energy: 0.5072131898598933
Energy: 0.5063556739551973
Energy: 0.506933718374358
Energy: 0.5069865733055702
Energy: 0.54447852430435
Energy: 0.5007629618143019
Energy: 0.501553675886858
Energy: 0.5372882595451569
Energy: 0.5005771673874625
Energy: 0.5076078210191493
Energy: 0.535147816950356
Energy: 0.533615003806654
Energy: 0.5233662536497283
Energy: 0.5346395209766853
Energy: 0.4896841627929239
Energy: 0.5077310409494449
Energy: 0.5352060489624291
Energy: 0.533453622954115
Energy: 0.5225284515242213
Energy: 0.5549634593204127
Energy: 0.4892973414840351
Energy: 0.5069607323797857
Energy: 0.5321290021391891
Energy: 0.500387759831931
Energy: 0.5014577027623238
Energy: 0.5162927578651074
Energy: 0.5005036881690087
Energy: 0.5013873636071826
Energy: 0.5295919841909269
Energy: 0.51649964284947
Energy: 0.5018945547813646
Energy: 0.5322333424526119
Energy: 0.6056818813987207
Energy: 0.5000893546754538
Energy: 0.5370013796462627
Energy: 0.5375512819770699
Energy: 0.5004664748092948
Energy: 0.5394676559801834
Energy: 0.500709523039725
Energy: 0.5293780609000835
Energy: 0.5354380198220647
Energy: 0.5317914923174574
Energy: 0.5353741385951414
Energy: 0.5569299477257372
Energy: 0.5338858646594116
Energy: 0.48774826511957625
Energy: 0.5447732934421667
Energy: 0.5120731310940903
Energy: 0.48784911373777856
Energy: 0.5411503725990342
Energy: 0.488280613980482
Energy: 0.4892568949456265
Energy: 0.5302824847888699
Energy: 0.48826608525761034
Energy: 0.48887122821309836
Energy: 0.5329126992622054
Energy: 0.48771047215244856
Energy: 0.4878748689860849
Energy: 0.5363714305001427
Energy: 0.5247246911413967
Energy: 0.4878712310950671
Energy: 0.5362718738985507
Energy: 0.4973503016342444
Energy: 0.6256050048996464
Energy: 0.553226504412238
Energy: 0.5531692532810022
Energy: 0.5113413186466377
Energy: 0.5542537089397539
Energy: 0.5200084267239241
Energy: 0.5171359831994555
Energy: 0.5169776242341445
Energy: 0.517671246049193
Energy: 0.5169164486312094
Energy: 0.5194946587845596
Energy: 0.5177629930825596
Energy: 0.5351233236015323
Energy: 0.5308456330876822
Energy: 0.5281858223391733
Energy: 0.535415340837294
Energy: 0.5289805568486664
Energy: 0.5292245756908333
Energy: 0.5540664661659266
Energy: 0.4886811009619325
Energy: 0.5324138235499751
Energy: 0.5207342392244304
Energy: 0.514972355971316
Energy: 0.5224078666032723
Energy: 0.5122986426051037
Energy: 0.517213580261007
Energy: 0.5225919849154576
Energy: 0.49962033606644585
Energy: 0.5197573697250709
Energy: 0.5246250727057014
Energy: 0.5427835758250572
Energy: 0.5211929107154967
Energy: 0.5339533582140267
Energy: 0.52506660186562
Energy: 0.5208405309016318
Energy: 0.487428868819534
Energy: 0.5645744567991726
Energy: 0.5174938275856578
Energy: 0.5303947815633643
Energy: 0.5191829058277609
Energy: 0.5171347496567805
Energy: 0.5178201143375286
Energy: 0.5541039682856232
Energy: 0.5219317477427498
Energy: 0.5236276865496468
Energy: 0.5534765286201744
Energy: 0.499895745833037
Energy: 0.5200695094687962
Energy: 0.5478104574290362
Energy: 0.488085647867257
Energy: 0.4965402769882066
Energy: 0.536385303029386
Energy: 0.4876768853281668
Energy: 0.5362716558093951
Energy: 0.546240667225825
Energy: 0.4880410635206924
Energy: 0.4878611885784624
Energy: 0.5435602169987558
Energy: 0.4896374579536882
Energy: 0.4873345699467618
Energy: 0.5460128382511618
Energy: 0.48848543372480707
Energy: 0.48789532951496994
Energy: 0.5411365187641978
Energy: 0.48786493177134876
Energy: 0.5127831541451061
Energy: 0.5693811801590234
Energy: 0.5384539158115487
Energy: 0.5361812484065908
Energy: 0.5699721562223581
Energy: 0.5074040930691492
Energy: 0.5410152625362392
Energy: 0.6398828092250457
Energy: 0.5003201301734107
Energy: 0.5008706655464639
Energy: 0.537284013173441
Energy: 0.5008556450362249
Energy: 0.5506394867442476
Energy: 0.5521734908741421
Energy: 0.5006684452150651
Energy: 0.5238408428981709
Energy: 0.5308993592485793
Energy: 0.5023075430100463
Energy: 0.5277205701698394

minimum gb energy = 0.4873345699467618 eV
minimum distance =  2.63115887417787 Angstroms
sigma value = 57


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

Energy: 0.7002450313864454
Energy: 0.4937615597084843
Energy: 0.5840420837559624
Energy: 0.6159669738791901
Energy: 0.7663747729444835
Energy: 0.5836769701457554
Energy: 0.5654783059885727
Energy: 0.4899825119362442
Energy: 0.4899364675989249
Energy: 0.49347228019825184
Energy: 0.49323399951667624
Energy: 0.5279110115411344
Energy: 0.5362885272389463
Energy: 0.5120722748574836
Energy: 0.4864497034891753
Energy: 0.5369505706227665
Energy: 0.5126407809820501
Energy: 0.4892855400618876
Energy: 0.5245388423507755
Energy: 0.49563766609031196
Energy: 0.4892815988792926
Energy: 0.48992748864066404
Energy: 0.48744646664057
Energy: 0.4897079628976648
Energy: 0.49974897544713404
Energy: 0.4914202511842634
Energy: 0.4908102062732815
Energy: 0.5003426440335516
Energy: 0.4907752607011886
Energy: 0.4913823520542975
Energy: 0.6066364170515426
Energy: 0.5335603820987964
Energy: 0.5340296523748074
Energy: 0.49451982597166944
Energy: 0.5359457364813991
Energy: 0.5553586557107533
Energy: 0.5334735372905554
Energy: 0.5008793678390248
Energy: 0.5031429883067174
Energy: 0.5343890745894441
Energy: 0.5040836951156193
Energy: 0.5341709101959075
Energy: 0.5648909821952043
Energy: 0.49136319611168305
Energy: 0.4908456765829238
Energy: 0.49166133269046985
Energy: 0.5003035169139178
Energy: 0.489421906529842
Energy: 0.47258573218369315
Energy: 0.5298893982840924
Energy: 0.4996253768163998
Energy: 0.47284197510146503
Energy: 0.5269295999068798
Energy: 0.4989016053393586
Energy: 0.47269789607244783
Energy: 0.5269165404520874
Energy: 0.5035707388639344
Energy: 0.47312923796376466
Energy: 0.5348569008440965
Energy: 0.49930016783455344
Energy: 0.564332915749206
Energy: 0.4905816441965931
Energy: 0.49042629687214573
Energy: 0.4916568100539567
Energy: 0.5003347033780213
Energy: 0.4897094464091584
Energy: 0.5284223433517732
Energy: 0.550007372959546
Energy: 0.5546733544536122
Energy: 0.5286990569317818
Energy: 0.5480427084063838
Energy: 0.5260694868593466
Energy: 0.49654018460850785
Energy: 0.49245122479173525
Energy: 0.49268727505609267
Energy: 0.49750668061474557
Energy: 0.4963738181229149
Energy: 0.5238774632971983
Energy: 0.6040952214675083
Energy: 0.5390120365043468
Energy: 0.5353554620582035
Energy: 0.4905654055996866
Energy: 0.5356310359900243
Energy: 0.5259354694056224
Energy: 0.5330532007379835
Energy: 0.5024315333762326
Energy: 0.4910799625257489
Energy: 0.5012887057107094
Energy: 0.5005557226481354
Energy: 0.49156178128574146
Energy: 0.5363661460788767
Energy: 0.5043918582259563
Energy: 0.498625946622785
Energy: 0.537269711155652
Energy: 0.5012296048060403
Energy: 0.4912354554191184
Energy: 0.47229283080332424
Energy: 0.48935880334250625
Energy: 0.49000189245991654
Energy: 0.472593551280627
Energy: 0.4934321969530704
Energy: 0.49024711704154783

minimum gb energy = 0.47229283080332424 eV
minimum distance =  2.65143964069198 Angstroms
sigma value = 9


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

Energy: 0.8497474003208114
Energy: 0.5535605030312404
Energy: 0.5899929839305161
Energy: 0.5607851514659041
Energy: 0.7913432574082422
Energy: 0.5896724467495774
Energy: 0.6185954135753605
Energy: 0.5500614182070824
Energy: 0.5447855298175367
Energy: 0.547876593676262
Energy: 0.5456560159467138
Energy: 0.5483362119058798
Energy: 0.59220891722068
Energy: 0.547349989487712
Energy: 0.5446912465153213
Energy: 0.5931152198666573
Energy: 0.5462265121349988
Energy: 0.5511287891806761
Energy: 0.5370759740624865
Energy: 0.5557390280672124
Energy: 0.5542734582360527
Energy: 0.5371158647452852
Energy: 0.5429071660713921
Energy: 0.5533726312921529
Energy: 0.5422819036529407
Energy: 0.5388042007073628
Energy: 0.5286359497756128
Energy: 0.5443265710913399
Energy: 0.5436935274620531
Energy: 0.5289109895245875
Energy: 0.5369906013174267
Energy: 0.5420372379089151
Energy: 0.542588948229421
Energy: 0.5378295056872295
Energy: 0.5396857114113534
Energy: 0.5420831602950258
Energy: 0.5915314603606423
Energy: 0.5391867771224556
Energy: 0.5479241248642788
Energy: 0.5925555432392342
Energy: 0.5368983851639567
Energy: 0.5863350768934057
Energy: 0.5485676524203923
Energy: 0.5401643544316859
Energy: 0.546937080139431
Energy: 0.5355022500157005
Energy: 0.5399602723818774
Energy: 0.5471553040306129
Energy: 0.6241586821052523
Energy: 0.5573317770758792
Energy: 0.5524933866278608
Energy: 0.5472429557398395
Energy: 0.5632769518488274
Energy: 0.5476409976297026
Energy: 0.631428635806468
Energy: 0.5379174230340866
Energy: 0.5283459377117331
Energy: 0.5485806432243759
Energy: 0.5354409559218803
Energy: 0.5282918957775842
Energy: 0.5490352287046136
Energy: 0.5487564126015817
Energy: 0.5472656088909553
Energy: 0.5365065577041516
Energy: 0.5514959167051066
Energy: 0.5461438136712866
Energy: 0.5488247075287577
Energy: 0.5489423455037845
Energy: 0.5502915383962157
Energy: 0.5453922665392409
Energy: 0.5450135372821998
Energy: 0.5292760166639606
Energy: 0.6386410694495581
Energy: 0.5718101310676196
Energy: 0.576064884181507
Energy: 0.5370633368812524
Energy: 0.5680435861673667
Energy: 0.5392585532225692
Energy: 0.5544781094648221
Energy: 0.5442040637425877
Energy: 0.549863429844152
Energy: 0.5400367908559569
Energy: 0.5655413909583816
Energy: 0.5513836868934343
Energy: 0.5561646899010874
Energy: 0.5501330116396512
Energy: 0.5474606391497078
Energy: 0.5551940289496669
Energy: 0.5491290540496522
Energy: 0.5291162087978487
Energy: 0.5514811528011839
Energy: 0.5619411037017508
Energy: 0.5517128105680857
Energy: 0.5520120682461462
Energy: 0.5473595179350382
Energy: 0.5518570227281868
Energy: 0.5444597566804686
Energy: 0.5558707953038142
Energy: 0.5546115319694342
Energy: 0.5445126607369203
Energy: 0.5562777372840768
Energy: 0.5507655711850666
Energy: 0.5920381637619552
Energy: 0.5776596281323224
Energy: 0.5738196372960641
Energy: 0.5648653729517924
Energy: 0.5780981662382242
Energy: 0.5463090952439851
Energy: 0.5758375239509519
Energy: 0.549639614956066
Energy: 0.5496925968904872
Energy: 0.5765054149590106
Energy: 0.5558998295323498
Energy: 0.5482777657155607
Energy: 0.5757842128162828
Energy: 0.5503774413160699
Energy: 0.5499361964827633
Energy: 0.5758196729744688
Energy: 0.5488837751627808
Energy: 0.5470911363096783
Energy: 0.5430479116549141
Energy: 0.5490678138290449
Energy: 0.5426527845055792
Energy: 0.5399918767974454
Energy: 0.5463504693511831
Energy: 0.5508352659018381

minimum gb energy = 0.5282918957775842 eV
minimum distance =  2.59459432493056 Angstroms
sigma value = 27


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

Energy: 0.6792393943926677
Energy: 0.829574881872674
Energy: 0.5501750042967295
Energy: 0.542071693338715
Energy: 0.8253468591080017
Energy: 0.5527231558645652
Energy: 0.6578925881166667
Energy: 0.553681930549377
Energy: 0.5723436490548927
Energy: 0.5850123426928602
Energy: 0.589726065717709
Energy: 0.5848572386156687
Energy: 0.5738892713619186
Energy: 0.5810892119266601
Energy: 0.554319615393417
Energy: 0.568626574219344
Energy: 0.5160326271240198
Energy: 0.5254024846650882
Energy: 0.5459869751258336
Energy: 0.5583841112989384
Energy: 0.5705693477540764
Energy: 0.5543883802020523
Energy: 0.5561143351589739
Energy: 0.5721084587959131
Energy: 0.5284521568370955
Energy: 0.5794784797635799
Energy: 0.5799021323396213
Energy: 0.5293906581400888
Energy: 0.5788645492838856
Energy: 0.5717741390441593
Energy: 0.5462477448523565
Energy: 0.5784280399298728
Energy: 0.5771563286147038
Energy: 0.5465027885495672
Energy: 0.5763786833287073
Energy: 0.5761225102892348
Energy: 0.5892525916220338
Energy: 0.5339109681041483
Energy: 0.5263575257907123
Energy: 0.5901031628183793
Energy: 0.5314326011002518
Energy: 0.5500925338706434
Energy: 0.5673661637899976
Energy: 0.5399770767987994
Energy: 0.5823666935215692
Energy: 0.5669670872823873
Energy: 0.5339611003176719
Energy: 0.5820248550627916
Energy: 0.6481611700241224
Energy: 0.543292906639915
Energy: 0.5319485666147777
Energy: 0.552220053591668
Energy: 0.5503251795532916
Energy: 0.5209984089093337
Energy: 0.6189043122530913
Energy: 0.4804602467675525
Energy: 0.48080842940990387
Energy: 0.5266629253470875
Energy: 0.4803784885602404
Energy: 0.518561797083182
Energy: 0.5821186083450792
Energy: 0.5271325631109188
Energy: 0.5375104631880138
Energy: 0.582390251737905
Energy: 0.5218221284384248
Energy: 0.5380498027492755
Energy: 0.5115491463311612
Energy: 0.4799083244953129
Energy: 0.4822192820830773
Energy: 0.5124678092010007
Energy: 0.4803189531144455
Energy: 0.5098756527810114
Energy: 0.4821529161362714
Energy: 0.5105580186528843
Energy: 0.510718510473463
Energy: 0.4794412571611365
Energy: 0.5072801284540842
Energy: 0.5111177717216537
Energy: 0.4789921132318082
Energy: 0.5069797892394237
Energy: 0.5061987814421169
Energy: 0.4800095865729993
Energy: 0.5084843633457027
Energy: 0.5064318389349762
Energy: 0.49631029754566347
Energy: 0.48608056652813486
Energy: 0.5071241674060847
Energy: 0.49704110008611274
Energy: 0.48241567703743865
Energy: 0.4992140723942362
Energy: 0.5787083224671242
Energy: 0.5344352886792264
Energy: 0.5302673668449068
Energy: 0.5670135048522956
Energy: 0.48346291258493207
Energy: 0.5246568052693583
Energy: 0.5286057056434301
Energy: 0.5174129546487682
Energy: 0.5245479379505938
Energy: 0.5284366463469742
Energy: 0.5171404043076019
Energy: 0.5250179541032871
Energy: 0.5737281534889322
Energy: 0.5724147890016436
Energy: 0.5707076313663341
Energy: 0.5525095780561977
Energy: 0.5812251208898155
Energy: 0.565523050075019
Energy: 0.5653498123155558
Energy: 0.5339843990556536
Energy: 0.5442435868528851
Energy: 0.5658981037275371
Energy: 0.5351631633857682
Energy: 0.544015586028523
Energy: 0.5909628021456595
Energy: 0.5342962717048464
Energy: 0.5440810135357437
Energy: 0.58154169086478
Energy: 0.5347964339440407
Energy: 0.5437035399960722
Energy: 0.6221277641315275
Energy: 0.5720376261716512
Energy: 0.5729818843818422
Energy: 0.5545039051079039
Energy: 0.5633570829646093
Energy: 0.570847910027776
Energy: 0.5249501154692363
Energy: 0.5755043153177939
Energy: 0.5745429909983091
Energy: 0.5261297672749573
Energy: 0.5749938980634792
Energy: 0.5694313736556197
Energy: 0.5865957880911087
Energy: 0.575864628405437
Energy: 0.5786277716881905
Energy: 0.5371102004118287
Energy: 0.5370799747564067
Energy: 0.5779918263536254
Energy: 0.5826939353068896
Energy: 0.5637635358067127
Energy: 0.5735246405670004
Energy: 0.5281640274338666
Energy: 0.5616389052679348
Energy: 0.5736095911257998
Energy: 0.5729093688290715
Energy: 0.5906635181635354
Energy: 0.5809712189558169
Energy: 0.520630079082711
Energy: 0.5897498101214491
Energy: 0.5516232964493991

minimum gb energy = 0.4789921132318082 eV
minimum distance =  2.58832260370163 Angstroms
sigma value = 19


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

Energy: 0.5602184560641915
Energy: 0.512226665062264
Energy: 0.494699708013287
Energy: 0.5107303217133183
Energy: 0.5123869650811778
Energy: 0.4942725405691318
Energy: 0.6109258180237979
Energy: 0.5122620072671563
Energy: 0.5038131164845284
Energy: 0.583695142415567
Energy: 0.5254857985403593
Energy: 0.5040711346496282
Energy: 0.5579951173825332
Energy: 0.5109185729425691
Energy: 0.5039544862600507
Energy: 0.5542392852700089
Energy: 0.5110620376139419
Energy: 0.5337802743580918
Energy: 0.562950437588894
Energy: 0.5101163440367116
Energy: 0.5096489706383522
Energy: 0.540323077939826
Energy: 0.5214158219499467
Energy: 0.5035493135393225
Energy: 0.5119972170463138
Energy: 0.5525789008082184
Energy: 0.5398846154742926
Energy: 0.5134332445979054
Energy: 0.5532697840847673
Energy: 0.5358339880909788
Energy: 0.5247699275968839
Energy: 0.5107223152764163
Energy: 0.5038287302923944
Energy: 0.5382886188565381
Energy: 0.5597108026922775
Energy: 0.5180733141304188
Energy: 0.5127202242974651
Energy: 0.5025883161935022
Energy: 0.5028421852699716
Energy: 0.5123803436346466
Energy: 0.5025656576589409
Energy: 0.5021368888007562
Energy: 0.5031839500091572
Energy: 0.5036222429173677
Energy: 0.5100350142111827
Energy: 0.5033708778549952
Energy: 0.5179253952139762
Energy: 0.5753356998447849
Energy: 0.5033493953553596
Energy: 0.5442941605459016
Energy: 0.5039779163904382
Energy: 0.5032716008276934
Energy: 0.5530208161517117
Energy: 0.5095266335917747
Energy: 0.5031741545064472
Energy: 0.5044352834567299
Energy: 0.5041579025115029
Energy: 0.5110456178380605
Energy: 0.504300718341302
Energy: 0.5047691569485651
Energy: 0.5534503012687223
Energy: 0.6261267813803769
Energy: 0.6262606102747743
Energy: 0.5530444606618431
Energy: 0.6252631720199292
Energy: 0.6232412541343633
Energy: 0.5433056574277393
Energy: 0.4923842409332092
Energy: 0.49237146853542046
Energy: 0.5373936167544691
Energy: 0.5099849154148162
Energy: 0.4920278787363028
Energy: 0.56529320104931
Energy: 0.5270861948416417
Energy: 0.5432554652966477
Energy: 0.5020100597646423
Energy: 0.5250220878345613
Energy: 0.5415796982659358
Energy: 0.5559293638818342
Energy: 0.4921324506361111
Energy: 0.5203238368421169
Energy: 0.5059495052692111
Energy: 0.5019088774638452
Energy: 0.5456124833305782
Energy: 0.5436178226491852
Energy: 0.49354234682757825
Energy: 0.49186001689234976
Energy: 0.543272819494554
Energy: 0.4916026725041895
Energy: 0.4920026174860097
Energy: 0.5431354408835618
Energy: 0.49152560399861417
Energy: 0.4920976649861788
Energy: 0.5355637495548419
Energy: 0.4933699346939562
Energy: 0.49169632737124397
Energy: 0.512595752941187
Energy: 0.5504496928989168
Energy: 0.5485147396247291
Energy: 0.4942723036395532
Energy: 0.5535620045052767
Energy: 0.5129269382014738
Energy: 0.5378067529620882
Energy: 0.5362519672693368
Energy: 0.49268753400851806
Energy: 0.5048803577953243
Energy: 0.5527856560586154
Energy: 0.4920048460641886
Energy: 0.562068009592654
Energy: 0.5277281534128797
Energy: 0.5028349243548953
Energy: 0.5637548320959919
Energy: 0.5015088364970235
Energy: 0.5348562944594026
Energy: 0.5534153447225891
Energy: 0.5282369133883298
Energy: 0.5309194333123373
Energy: 0.5475954995042439
Energy: 0.5000853973815904
Energy: 0.5235840731752134
Energy: 0.4915306668549727
Energy: 0.527788080246394
Energy: 0.4927109568549869
Energy: 0.4915277623052001
Energy: 0.5394848600121545
Energy: 0.5264766444265835
Energy: 0.5014099492640675
Energy: 0.49206257903770395
Energy: 0.492236765757832
Energy: 0.4918721394469301
Energy: 0.535892478231383
Energy: 0.49197816047684884
Energy: 0.5374745480496241
Energy: 0.5141976992147934
Energy: 0.5110983249315151
Energy: 0.49163401547075003
Energy: 0.5558586016356236
Energy: 0.5401857789705393
Energy: 0.5350711683404507
Energy: 0.4892902723202728
Energy: 0.4892267658394589
Energy: 0.524658371744911
Energy: 0.48841460747423104
Energy: 0.48950722694640914
Energy: 0.5268901882605124
Energy: 0.5474803166521992
Energy: 0.49225122335986454
Energy: 0.5098752842367142
Energy: 0.5479720006592551
Energy: 0.49227977168458287
Energy: 0.5128725037986286
Energy: 0.5406892868756696
Energy: 0.5387397996113557
Energy: 0.50238491131446
Energy: 0.5415842538754634
Energy: 0.5037980494931643
Energy: 0.5575695770854093
Energy: 0.5052668160763283
Energy: 0.5043341953329153
Energy: 0.5532175333665951
Energy: 0.5089255618084285
Energy: 0.5040766215211189
Energy: 0.5574185025835631
Energy: 0.5116506408479867
Energy: 0.5033840542440149
Energy: 0.5507177201061129
Energy: 0.5107935601277082
Energy: 0.5203570335755899
Energy: 0.538859948822277
Energy: 0.5271279151752825
Energy: 0.5265118439388095
Energy: 0.5036500145798141
Energy: 0.5272961240034639
Energy: 0.48990233191218474

minimum gb energy = 0.48841460747423104 eV
minimum distance =  2.59911844926218 Angstroms
sigma value = 101


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

Energy: 0.732030091411136
Energy: 0.4821200851507922
Energy: 0.49377462498567126
Energy: 0.661907419053755
Energy: 0.5474637780780253
Energy: 0.5270073864552962
Energy: 0.5928094611134925
Energy: 0.4976654478193747
Energy: 0.4927900197045693
Energy: 0.4960832907169867
Energy: 0.5014970142971975
Energy: 0.48230189016493397
Energy: 0.5562694069044027
Energy: 0.4814639908591072
Energy: 0.4821915765174465
Energy: 0.5377487027765024
Energy: 0.48477840241285625
Energy: 0.5252403135089494
Energy: 0.4992908220536674
Energy: 0.4824968594663936
Energy: 0.48255219866763516
Energy: 0.5251107105114985
Energy: 0.482825741682293
Energy: 0.49859336216809436
Energy: 0.4926474478261765
Energy: 0.5381891742491861
Energy: 0.5353176916388392
Energy: 0.49456313963936266
Energy: 0.5438753645839419
Energy: 0.492985879871216
Energy: 0.5213939263399678
Energy: 0.4821558029979149
Energy: 0.49773973446251035
Energy: 0.5181980670145274
Energy: 0.5480054379989642
Energy: 0.4825643405357903
Energy: 0.5379162411784281
Energy: 0.48194507423447847
Energy: 0.5219486273671381
Energy: 0.5392689472948489
Energy: 0.48119864060065776
Energy: 0.535799033260129
Energy: 0.48222982330168607
Energy: 0.4827210172678936
Energy: 0.49360252782293523
Energy: 0.4816679658489704
Energy: 0.49488660578971533
Energy: 0.5200019007707324
Energy: 0.48303107937841977
Energy: 0.5248533718720984
Energy: 0.4819520396109893
Energy: 0.4840300486034224
Energy: 0.538202586639804
Energy: 0.48203460261925973
Energy: 0.4813961048609487
Energy: 0.48297565614742655
Energy: 0.48199411884002336
Energy: 0.48197861807630554
Energy: 0.5325966426883594
Energy: 0.48265925687083955
Energy: 0.5516096171643303
Energy: 0.5346925855978614
Energy: 0.526196671898175
Energy: 0.5446887489633578
Energy: 0.5394022831662133
Energy: 0.5293424250731267
Energy: 0.5351613348906574
Energy: 0.4830194855555946
Energy: 0.48276095689439336
Energy: 0.5263005553321697
Energy: 0.5150988645555172
Energy: 0.48288297945865755
Energy: 0.4981484361266733
Energy: 0.5433830477240198
Energy: 0.4815275379826101
Energy: 0.48279814011659467
Energy: 0.543416279830229
Energy: 0.4816969644506822
Energy: 0.4977809009406566
Energy: 0.5100467117962272
Energy: 0.5056883191066285
Energy: 0.4978163228245581
Energy: 0.5105057379995241
Energy: 0.48321911790927996
Energy: 0.5550220376092493
Energy: 0.48194563694328674
Energy: 0.48202916625076675
Energy: 0.5400799338779101
Energy: 0.4844545284169766
Energy: 0.4821618650880636
Energy: 0.5547274514009058
Energy: 0.4919915248677776
Energy: 0.4945078850305649
Energy: 0.5429089558366258
Energy: 0.5015860036454358
Energy: 0.5066839268130574
Energy: 0.5002458603386641
Energy: 0.5744708012034146
Energy: 0.49356521363504335
Energy: 0.4706071963171562
Energy: 0.5277230350440695
Energy: 0.5221249238714022
Energy: 0.5673247538131815
Energy: 0.4821584746907374
Energy: 0.48410137634752864
Energy: 0.5189124750917714
Energy: 0.5007945445015469
Energy: 0.4947536925072027
Energy: 0.5564593551227545
Energy: 0.48250705767673274
Energy: 0.48199975233423237
Energy: 0.5379707318286078
Energy: 0.482301470830719
Energy: 0.48183761704781225
Energy: 0.5569356125741652
Energy: 0.4916765170190379
Energy: 0.4821631252154943
Energy: 0.5238272243744982
Energy: 0.48403098806373174
Energy: 0.48201306001008565
Energy: 0.4945422418804337
Energy: 0.5350914297449312
Energy: 0.5306870479336105
Energy: 0.4950344048850976
Energy: 0.5371345913047899
Energy: 0.49442847344759583
Energy: 0.5180193438899342
Energy: 0.4821375935149808
Energy: 0.4821314429848835
Energy: 0.5087534960646093
Energy: 0.5362947693454686
Energy: 0.4936865509350579
Energy: 0.5004316247998415
Energy: 0.48052075568240343
Energy: 0.4805332313220551
Energy: 0.5006235030819531
Energy: 0.48079770466771166
Energy: 0.4806669842464177
Energy: 0.5295578834294056
Energy: 0.511612003239225
Energy: 0.49728024196971937
Energy: 0.5206984559781058
Energy: 0.5112344427758807
Energy: 0.5181150496124115
Energy: 0.4820283420633646
Energy: 0.48163997649416146
Energy: 0.4844834792044382
Energy: 0.48156256493646216
Energy: 0.5235358201097409
Energy: 0.49271613472021836
Energy: 0.48298022312364686
Energy: 0.4846121059492498
Energy: 0.48509994369510095
Energy: 0.483460137217377
Energy: 0.4829746015735924
Energy: 0.4855333832594726
Energy: 0.5502142596222012
Energy: 0.4678725225897825
Energy: 0.4677834194567873
Energy: 0.4977731336064518
Energy: 0.4703504741947175
Energy: 0.46811947762718015
Energy: 0.5605435769084954
Energy: 0.4684666573841283
Energy: 0.46906175673383843
Energy: 0.5612046628997864
Energy: 0.4677933278582974
Energy: 0.4827607058195695
Energy: 0.49844739933737253
Energy: 0.525807197965218
Energy: 0.4982240832985473
Energy: 0.4805282728865049
Energy: 0.5366479968610558
Energy: 0.4972418332125614
Energy: 0.4992956744096454
Energy: 0.48190922878873216
Energy: 0.48178663419300133
Energy: 0.4806686233189916
Energy: 0.536586394026956
Energy: 0.48204337764448735
Energy: 0.5575259598612801
Energy: 0.4834488032647597
Energy: 0.48218333438101074
Energy: 0.5360883481215689
Energy: 0.4820164482651496
Energy: 0.4845052844149889
Energy: 0.5548948383746571
Energy: 0.48277672501241115
Energy: 0.49237647855186595
Energy: 0.5424012299395333
Energy: 0.48321266579490185
Energy: 0.48221154933208477
Energy: 0.5016916165759399
Energy: 0.48431060611621063
Energy: 0.46945825093185295
Energy: 0.4667393552470717
Energy: 0.4823351110080526
Energy: 0.4682571783669552

minimum gb energy = 0.4667393552470717 eV
minimum distance =  2.61208183820465 Angstroms
sigma value = 33


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

Energy: 0.013637428795911814
Energy: 0.39206804144225543
Energy: 0.01405376837607927
Energy: 0.015165104868389715
Energy: 0.3923534142272307
Energy: 0.014092532229171013
Energy: 0.318372403347498
Energy: 0.07522277328138861
Energy: 0.07484587607634438
Energy: 0.0741549121230141
Energy: 0.07412599471407763
Energy: 0.07455294667714768
Energy: 0.639771282597931
Energy: 0.39293320948745164
Energy: 0.3915355712571536
Energy: 0.3912126713196292
Energy: 0.39203231078887235
Energy: 0.39111892676013615
Energy: 0.3183724033509685
Energy: 0.07522277328138861
Energy: 0.07484587607634438
Energy: 0.0741549121230141
Energy: 0.07412599471441285
Energy: 0.07455294667645751

minimum gb energy = 0.013637428795911814 eV
minimum distance =  2.82239881562126 Angstroms
sigma value = 1