Model name: model_name=EAM_Dynamo_MendelevAstaRahman_2009_AlMg__MO_658278549784_005
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=4.045270472764969
cohesive_energy=3.4109252230537166
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=[2.28507238070982e-19, 2.9349312452265596e-19, 3.3659167597725596e-19, 3.7020694393520996e-19, 3.9732378346566e-19, 4.1837478225978597e-19, 4.350662584327979e-19, 4.48877021017878e-19, 4.60669041044118e-19, 4.711584914669159e-19, 4.80904531931538e-19, 4.90291684830144e-19, 4.9946735041306195e-19, 5.08240869660846e-19, 5.163174420728399e-19, 5.23472762920284e-19, 5.29585066778994e-19, 5.3462231011629e-19, 5.38621342994754e-19, 5.4166387642272e-19, 5.43860460587934e-19, 5.45329656561312e-19, 5.46172401470796e-19, 5.46447975851844e-19, 5.461403579381159e-19, 5.45103749655918e-19, 5.43110641923222e-19, 5.398389972365939e-19, 5.348882714375339e-19, 5.27928416139438e-19, 5.19010700994594e-19, 5.088545033116679e-19, 4.98892169001456e-19, 4.89604351054158e-19, 4.71767318587836e-19, 3.93033154439808e-19, 4.478211866160719e-20, -1.2997689986857679e-18, -6.0122479279167e-18, -2.1592694714081397e-17, -7.151940254746259e-17, -2.29734505372626e-16, -7.337408221898099e-16, -2.3716059407121598e-15, -7.8796649036754e-15, -2.73409840415466e-14, -1.008124785998748e-13, -4.0333995672632997e-13, -1.7986195110947399e-12, -9.269056458913859e-12, -5.8071693187646996e-11, -4.77115384192128e-10, -5.82580263301812e-09, -1.322595209190366e-07]
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: 0.01050496803198899
Energy: 0.2389056909015733
Energy: 0.011110228805256459
Energy: 0.012033666747123656
Energy: 0.23898029594257925
Energy: 0.010828102010144705
Energy: 0.23890569090132288
Energy: 0.0513292444060908
Energy: 0.051204053843983896
Energy: 0.05138658981928757
Energy: 0.0511663347121638
Energy: 0.05129445716333781
Energy: 0.011110228804755573
Energy: 0.05120405384373346
Energy: 0.051511504445143644
Energy: 0.010921149899013126
Energy: 0.05120817994663331
Energy: 0.051838195595691555
Energy: 0.012033666747596716
Energy: 0.05138658981906495
Energy: 0.01092114989926357
Energy: 0.010660308438025979
Energy: 0.05131519756726832
Energy: 0.010847348960967016
Energy: 0.2389802959428297
Energy: 0.05116633471266469
Energy: 0.05120817994588199
Energy: 0.051315197566516986
Energy: 0.051174943821570666
Energy: 0.05120157245572029
Energy: 0.010828102010144705
Energy: 0.05129445716333781
Energy: 0.05183819559546894
Energy: 0.010847348961690519
Energy: 0.051201572455970734
Energy: 0.011014574804175715

minimum gb energy = 0.01050496803198899 eV
minimum distance =  2.85169578009522 Angstroms
sigma value = 1


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

Energy: 0.6582325739907767
Energy: 0.502220791214436
Energy: 0.5314063864888839
Energy: 0.6590949654039726
Energy: 0.5023438611028402
Energy: 0.5305867933191719
Energy: 0.6370315364559787
Energy: 0.49917544763168087
Energy: 0.49920207131851063
Energy: 0.5209929085787904
Energy: 0.4994132510045757
Energy: 0.4992622299995844
Energy: 0.6262434344556769
Energy: 0.4984601871631027
Energy: 0.4981522319646411
Energy: 0.5113420345811984
Energy: 0.4987182314279961
Energy: 0.49877759915265446
Energy: 0.7187990815454467
Energy: 0.501048643266644
Energy: 0.49600282141198354
Energy: 0.5018044505685708
Energy: 0.5027774189432271
Energy: 0.5013872704487288
Energy: 0.672209196524514
Energy: 0.511329386301471
Energy: 0.5122869878694236
Energy: 0.5158693807772756
Energy: 0.500998577823319
Energy: 0.5125549930890294
Energy: 0.6231458172515072
Energy: 0.5116611914045056
Energy: 0.5121338487915208
Energy: 0.5105690381501529
Energy: 0.501179567943241
Energy: 0.5106193996268465
Energy: 0.6161098073477006
Energy: 0.5099794618108712
Energy: 0.511251268663662
Energy: 0.5114448054808319
Energy: 0.5109745063849358
Energy: 0.5100284517658553
Energy: 0.5817755306529134
Energy: 0.514105162125975
Energy: 0.5140970531228384
Energy: 0.5105877904687998
Energy: 0.5143332709914417
Energy: 0.5116530037919071
Energy: 0.5015620149652087
Energy: 0.5109309856500639
Energy: 0.5106269673474572
Energy: 0.5023631353853438
Energy: 0.5105689969656766
Energy: 0.5122011624643675
Energy: 0.5006079007038535
Energy: 0.5153030533311977
Energy: 0.5112701364859223
Energy: 0.5000679124837613
Energy: 0.515415103115455
Energy: 0.5120747268969451
Energy: 0.5423059244311886
Energy: 0.4941048664930496
Energy: 0.49352057136369837
Energy: 0.5425694252348974
Energy: 0.5039113583830466
Energy: 0.5004096264535036
Energy: 0.5023420780019768
Energy: 0.4972541352822097
Energy: 0.501164328957191
Energy: 0.5032301878874553
Energy: 0.5166271452843765
Energy: 0.49848545397206045
Energy: 0.5026642898128744
Energy: 0.5056379049954141
Energy: 0.5000467037783001
Energy: 0.5026537115500036
Energy: 0.517738371888287
Energy: 0.5001609179671619
Energy: 0.5034458968578958
Energy: 0.5025982295911741
Energy: 0.5004855518769118
Energy: 0.5029964441817599
Energy: 0.5023719686122589
Energy: 0.49744921461531255
Energy: 0.4999971626590871
Energy: 0.5190430897816802
Energy: 0.5044839775906398
Energy: 0.49907513890578137
Energy: 0.51832499948315
Energy: 0.5056437454670137
Energy: 0.4972350581184941
Energy: 0.4961925396856104
Energy: 0.49612949540767887
Energy: 0.4977161343398385
Energy: 0.5108947787793606
Energy: 0.49612154050759677
Energy: 0.5364600090826165
Energy: 0.5104877285735171
Energy: 0.5104710048567987
Energy: 0.5143371697861084
Energy: 0.5115906853734697
Energy: 0.5005858839883408
Energy: 0.5394581865721175
Energy: 0.5175209299266087
Energy: 0.5165190064795014
Energy: 0.5191806767184888
Energy: 0.5189036344856377
Energy: 0.5163440742544554
Energy: 0.5367882230070432
Energy: 0.5177949291484106
Energy: 0.5165526381986215
Energy: 0.519156190987888
Energy: 0.518466820209664
Energy: 0.5163392285762133
Energy: 0.6595589325005385
Energy: 0.5181485155121457
Energy: 0.5166296108278606
Energy: 0.5189510610461806
Energy: 0.5213405181126441
Energy: 0.5161639874412891
Energy: 0.6609265157423379
Energy: 0.4967677101035419
Energy: 0.4939176289775856
Energy: 0.5041404840887784
Energy: 0.54623978766239
Energy: 0.49341676705323567
Energy: 0.6494685652043932
Energy: 0.4964996396577314
Energy: 0.4958641499544602
Energy: 0.5225377080068215
Energy: 0.4976232928472238
Energy: 0.496103299466632
Energy: 0.6729056979871464
Energy: 0.49747698642512905
Energy: 0.4976372395760194
Energy: 0.5233046609654196
Energy: 0.4987280430261969
Energy: 0.4980298557649401

minimum gb energy = 0.49341676705323567 eV
minimum distance =  2.53286855415628 Angstroms
sigma value = 33


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

Energy: 0.7548140410891864
Energy: 0.5174381589229045
Energy: 0.513814340155097
Energy: 0.6511103062800826
Energy: 0.6872521897510876
Energy: 0.5316819632045706
Energy: 0.6479326697262866
Energy: 0.5012495821797405
Energy: 0.49933707212378814
Energy: 0.5259460097104912
Energy: 0.5008448330545774
Energy: 0.5001007075341601
Energy: 0.6229915907436082
Energy: 0.5048450869135188
Energy: 0.5018048631812655
Energy: 0.5236269994159926
Energy: 0.5073648577154141
Energy: 0.504171471607637
Energy: 0.639021837391005
Energy: 0.5237515433834349
Energy: 0.5022902949231463
Energy: 0.5379287465907131
Energy: 0.5279704525289178
Energy: 0.5117612858170824
Energy: 0.5880479052953987
Energy: 0.5418923443836211
Energy: 0.5249097785965134
Energy: 0.525181098710607
Energy: 0.5450581623592781
Energy: 0.5414611813968211
Energy: 0.6315071909648055
Energy: 0.5328891106163723
Energy: 0.5343059296595232
Energy: 0.5478976791710829
Energy: 0.5349540873759546
Energy: 0.5351801901279768
Energy: 0.6336971192767591
Energy: 0.5358158322377493
Energy: 0.5368806371000029
Energy: 0.5506418086805678
Energy: 0.5295299800952523
Energy: 0.5349965975445408
Energy: 0.5859824179071573
Energy: 0.5213473137416711
Energy: 0.5239129103554216
Energy: 0.5543988694015018
Energy: 0.5299395547976629
Energy: 0.5232318930971804
Energy: 0.528096600423733
Energy: 0.5215482884429294
Energy: 0.5391901952391576
Energy: 0.5288307423800462
Energy: 0.5216061147544846
Energy: 0.5323243534315422
Energy: 0.5261662782212221
Energy: 0.5373977840833521
Energy: 0.5296336154042303
Energy: 0.5262556471860044
Energy: 0.5286749612659873
Energy: 0.5338030752342381
Energy: 0.5651351996724445
Energy: 0.4875624861318819
Energy: 0.4870496113971596
Energy: 0.5474772923033013
Energy: 0.4863832395021802
Energy: 0.48734253233988256
Energy: 0.5209081917612495
Energy: 0.5036573177814866
Energy: 0.5127398036261451
Energy: 0.5212688524279117
Energy: 0.5093303912135743
Energy: 0.5181879193811877
Energy: 0.5250554753938526
Energy: 0.5229971684042254
Energy: 0.5180317777497675
Energy: 0.5252431385314678
Energy: 0.5418188503104797
Energy: 0.5292743851761892
Energy: 0.5664243691594466
Energy: 0.5133896512026407
Energy: 0.5138106356904835
Energy: 0.5683959245844054
Energy: 0.5383313220330487
Energy: 0.5133374386150855
Energy: 0.5406783398474091
Energy: 0.5350805045312121
Energy: 0.5348104099737503
Energy: 0.5374117772433638
Energy: 0.5491566409169907
Energy: 0.5374264376034537
Energy: 0.5273552004209474
Energy: 0.5296844715051833
Energy: 0.5306406667070253
Energy: 0.5334926185958287
Energy: 0.529834390028144
Energy: 0.5309219370234438
Energy: 0.5861448111356232
Energy: 0.5429056459015235
Energy: 0.5300953704366395
Energy: 0.5635455648431579
Energy: 0.548452639651557
Energy: 0.5298455634290278
Energy: 0.5293473329163744
Energy: 0.5388316197143368
Energy: 0.539441817956813
Energy: 0.5296929829588356
Energy: 0.5394062257949727
Energy: 0.5221588535586162
Energy: 0.5294695603673107
Energy: 0.531903413819624
Energy: 0.5334582225228127
Energy: 0.5300233697213264
Energy: 0.5271525933525146
Energy: 0.5334604265176602
Energy: 0.6785555518955091
Energy: 0.5323776091569051
Energy: 0.5326865808629695
Energy: 0.5417155834166585
Energy: 0.5270691956221654
Energy: 0.5290988894283115
Energy: 0.728931439943879
Energy: 0.5234579342817897
Energy: 0.48739948861419086
Energy: 0.48689420207330136
Energy: 0.5619740779349828
Energy: 0.4888172525103029
Energy: 0.5100972386440827
Energy: 0.5181160050264706
Energy: 0.5180965172199382
Energy: 0.510887742637885
Energy: 0.518497939585946
Energy: 0.5133266062110481
Energy: 0.614085085815275
Energy: 0.5234413062413253
Energy: 0.5220560151630567
Energy: 0.5527510780008607
Energy: 0.5249254156529634
Energy: 0.5216771960015484
Energy: 0.6376111958575303
Energy: 0.5684947859285568
Energy: 0.5297967892553173
Energy: 0.5387927650519986
Energy: 0.5681004539700338
Energy: 0.5348745041618638
Energy: 0.6163041181516435
Energy: 0.5343211237986346
Energy: 0.5368873942065016
Energy: 0.5572742180889159
Energy: 0.537135116921597
Energy: 0.5350073809667399
Energy: 0.6307445463629779
Energy: 0.5311433060029314
Energy: 0.5309126571216425
Energy: 0.5398701515272527
Energy: 0.5332614716378826
Energy: 0.5310567965327672
Energy: 0.6482383649710112
Energy: 0.5303977858840708
Energy: 0.5302510577664088
Energy: 0.5460483944918861
Energy: 0.5303942300087905
Energy: 0.5303251162435326
Energy: 0.5877451156595745
Energy: 0.5213327947001529
Energy: 0.5220186243631518
Energy: 0.5402102478151637
Energy: 0.5349855923236119
Energy: 0.5430339950485072
Energy: 0.5269339377102017
Energy: 0.5213656002616807
Energy: 0.5222833672676551
Energy: 0.5268623419088666
Energy: 0.5347811137915135
Energy: 0.5313951438060751
Energy: 0.5289388787459794
Energy: 0.5369787345310392
Energy: 0.528039748117325
Energy: 0.5273681158670483
Energy: 0.5354896900578786
Energy: 0.5328792506680542
Energy: 0.5339267336954986
Energy: 0.4875243929572221
Energy: 0.48759941968100173
Energy: 0.5281854594785688
Energy: 0.4882221609836723
Energy: 0.48677597062847644
Energy: 0.5182454280102885
Energy: 0.4991721395450357
Energy: 0.48695245610280846
Energy: 0.5182234685494221
Energy: 0.5111994771131863
Energy: 0.5133030199741958
Energy: 0.5222313615515788
Energy: 0.5228379096707634
Energy: 0.5216196957765779
Energy: 0.5227876668564092
Energy: 0.5368613504313026
Energy: 0.5215849834054459
Energy: 0.5222288268260094
Energy: 0.5129587026885093
Energy: 0.5117278017075426
Energy: 0.5225066410001115
Energy: 0.5383953053145809
Energy: 0.5303598834447394
Energy: 0.544482686012122
Energy: 0.5378882723130803
Energy: 0.5378758318443346
Energy: 0.5436814311078576
Energy: 0.5535628641277014
Energy: 0.5383849756577725
Energy: 0.5274272821650854
Energy: 0.5322532653352624
Energy: 0.5298777754961088
Energy: 0.529058639380768
Energy: 0.5448152981837654
Energy: 0.5302320832119175
Energy: 0.5381562817149849
Energy: 0.548223740383975
Energy: 0.5430654846002666
Energy: 0.5402458262325617
Energy: 0.5415340894905134
Energy: 0.5444785459831954
Energy: 0.5294625535093818
Energy: 0.5334722089681175
Energy: 0.5136582960751599
Energy: 0.5304044302101175
Energy: 0.5380480064495887
Energy: 0.5326718327012426
Energy: 0.5294202371418432
Energy: 0.515175334894445
Energy: 0.5143377646535962
Energy: 0.5295115910507525
Energy: 0.5153742307665686
Energy: 0.5226335788138964
Energy: 0.6147832901063591
Energy: 0.5150483810612505
Energy: 0.5134271987857504
Energy: 0.5270132552124309
Energy: 0.5119811657727441
Energy: 0.5140842659206571
Energy: 0.5301720148109437
Energy: 0.5002137068754878
Energy: 0.48671683725346604
Energy: 0.487475561427531
Energy: 0.5140382088704234
Energy: 0.5035670625466412

minimum gb energy = 0.4863832395021802 eV
minimum distance =  2.62376326141182 Angstroms
sigma value = 51


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

Energy: 0.6912442964992161
Energy: 0.49668767582997103
Energy: 0.5472272983612729
Energy: 0.6300581082674969
Energy: 0.49814339886022657
Energy: 0.5142902670269618
Energy: 0.5305224540062048
Energy: 0.4963970349682628
Energy: 0.49638122421915576
Energy: 0.519194346162982
Energy: 0.4964508625330196
Energy: 0.4968416458467244
Energy: 0.634602286311299
Energy: 0.49423194851949726
Energy: 0.49416752656533547
Energy: 0.49211741232813927
Energy: 0.4952174109276061
Energy: 0.49428330247417157
Energy: 0.6291133320098662
Energy: 0.494521289390801
Energy: 0.49469173039261294
Energy: 0.4916293954843849
Energy: 0.5260462327799631
Energy: 0.4913828753718657
Energy: 0.5883924964444406
Energy: 0.5183044419842879
Energy: 0.5181003479057131
Energy: 0.5108147575586162
Energy: 0.5172628876948544
Energy: 0.5178819741180962
Energy: 0.5307277389713503
Energy: 0.5168492025203423
Energy: 0.5182306208220039
Energy: 0.5165755405756798
Energy: 0.5177636236812767
Energy: 0.5178769814361105
Energy: 0.5307550239368296
Energy: 0.5184912446298813
Energy: 0.5177960006115505
Energy: 0.5166033180288087
Energy: 0.5168861289234562
Energy: 0.5181784439885269
Energy: 0.5493753145466116
Energy: 0.48876854671138503
Energy: 0.48860638383482424
Energy: 0.5255180066362347
Energy: 0.48878624524819375
Energy: 0.48896113332705327
Energy: 0.4951178690195969
Energy: 0.4888023060283227
Energy: 0.4886959830222734
Energy: 0.49511346580896637
Energy: 0.488714782569399
Energy: 0.49479766768486666
Energy: 0.4965381428960419
Energy: 0.4970166466594326
Energy: 0.4968355826301438
Energy: 0.4965272380864155
Energy: 0.49863029570547746
Energy: 0.4965785205284109
Energy: 0.512649863204062
Energy: 0.493921990499323
Energy: 0.49402218017141397
Energy: 0.5130083686534788
Energy: 0.4941496740254417
Energy: 0.4937014274003856
Energy: 0.49224264875156937
Energy: 0.4976158716450898
Energy: 0.49688531301295996
Energy: 0.49271726923886083
Energy: 0.5182060196626237
Energy: 0.4968474085745424
Energy: 0.4917046441636713
Energy: 0.4921992277489694
Energy: 0.498122289061342
Energy: 0.49255471928184097
Energy: 0.4979226098782912
Energy: 0.4920591559466624
Energy: 0.4925747122861385
Energy: 0.4920591970121848
Energy: 0.4923251204519824
Energy: 0.4931713654486822
Energy: 0.49217204306128665
Energy: 0.49273412948113077
Energy: 0.5648412532249425
Energy: 0.49222757543951723
Energy: 0.4921506754027863
Energy: 0.4946563281295095
Energy: 0.49225334179873803
Energy: 0.4918791449651111
Energy: 0.5669044947779422
Energy: 0.4926821217134694
Energy: 0.49227748524924525
Energy: 0.4947117681911449
Energy: 0.4919629854677101
Energy: 0.494748736295841
Energy: 0.5865988637549174
Energy: 0.49233357606722017
Energy: 0.4921752493348524
Energy: 0.5112297323521083
Energy: 0.49222717035278635
Energy: 0.4922267387467382
Energy: 0.6985410949980687
Energy: 0.4967584014545095
Energy: 0.4976992609727558
Energy: 0.487794652393187
Energy: 0.4927530408980996
Energy: 0.49762996598177883

minimum gb energy = 0.487794652393187 eV
minimum distance =  2.65433184143256 Angstroms
sigma value = 19


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

Energy: 0.6379668776455044
Energy: 0.5106717321629496
Energy: 0.48212578286558844
Energy: 0.5879121132393981
Energy: 0.5106067203901097
Energy: 0.4828801924805038
Energy: 0.5589197515704919
Energy: 0.4767573522158083
Energy: 0.4767480552971695
Energy: 0.5176799807296087
Energy: 0.4766864315820077
Energy: 0.4770118947584786
Energy: 0.5465661757171325
Energy: 0.47673615101270644
Energy: 0.4767241671543147
Energy: 0.5014687616096369
Energy: 0.47676058118355236
Energy: 0.4767172709766918
Energy: 0.529546382742205
Energy: 0.49422858332685843
Energy: 0.4770861055532693
Energy: 0.5295734963142088
Energy: 0.4674008855793998
Energy: 0.4769934213556832
Energy: 0.5374706050433975
Energy: 0.4658883061189249
Energy: 0.49433350947550064
Energy: 0.5155451355073809
Energy: 0.46080448590962436
Energy: 0.5005673612642788
Energy: 0.5544203720293734
Energy: 0.4470445683263497
Energy: 0.5013183725147965
Energy: 0.5000229465720931
Energy: 0.44718507234249794
Energy: 0.5013782173635973
Energy: 0.5536653216673321
Energy: 0.4862437179434201
Energy: 0.48989548026638136
Energy: 0.4924071714385183
Energy: 0.4656056313805838
Energy: 0.49074208797680613
Energy: 0.5333165616516302
Energy: 0.4195579100410601
Energy: 0.41944286513651224
Energy: 0.53339020999007
Energy: 0.41991380910827397
Energy: 0.4196368627831969
Energy: 0.47869497711928666
Energy: 0.41963957234600047
Energy: 0.41949912966632064
Energy: 0.4685681467643581
Energy: 0.41973340198027215
Energy: 0.4195748247024144
Energy: 0.4781415732477922
Energy: 0.48166103001893645
Energy: 0.48100368390265247
Energy: 0.4781899755605342
Energy: 0.49779695626850684
Energy: 0.48096673970010584
Energy: 0.47868252317476795
Energy: 0.5138789808914385
Energy: 0.47184006575434645
Energy: 0.47872436654497086
Energy: 0.5147734690884442
Energy: 0.47869423819806767
Energy: 0.4898087059670149
Energy: 0.4969213109900441
Energy: 0.5056209041833379
Energy: 0.47655440402973626
Energy: 0.49720328387564744
Energy: 0.48947969957674875
Energy: 0.44710246571577505
Energy: 0.505032556463311
Energy: 0.5060658755720265
Energy: 0.4476649337627676
Energy: 0.5046671233883778
Energy: 0.5435000149040335
Energy: 0.4890777975632509
Energy: 0.4981140413300125
Energy: 0.49828794344216726
Energy: 0.4806861954290385
Energy: 0.4985008455049511
Energy: 0.4982666670916849
Energy: 0.5827126695928413
Energy: 0.4865972030785936
Energy: 0.48626791774856104
Energy: 0.41974681966783506
Energy: 0.4925908984856312
Energy: 0.41956870617026726
Energy: 0.586505515198915
Energy: 0.48660252619221733
Energy: 0.4195641391973856
Energy: 0.41972051786756026
Energy: 0.4867858293536635
Energy: 0.41956319617949206
Energy: 0.48903889538116807
Energy: 0.48676456228159565
Energy: 0.4865539184402891
Energy: 0.5183131734182799
Energy: 0.4828571682264259
Energy: 0.48651152489990557
Energy: 0.5279695558215329
Energy: 0.4826598725911752
Energy: 0.48262550492137163
Energy: 0.47181399424722287
Energy: 0.48267211375270896
Energy: 0.4828003408398823
Energy: 0.5279155120495204
Energy: 0.46438428299441764
Energy: 0.46450596272753225
Energy: 0.5141899629209661
Energy: 0.46438586362311135
Energy: 0.4647195310461472
Energy: 0.5536463199207938
Energy: 0.44699685665847727
Energy: 0.47460703115978514
Energy: 0.5057713140245148
Energy: 0.4471148116344467
Energy: 0.4820277963738258
Energy: 0.5564052772478295
Energy: 0.48070699452910515
Energy: 0.5004512992585353
Energy: 0.5402027702624722
Energy: 0.4807201262675312
Energy: 0.49988016875940977
Energy: 0.5548450720314826
Energy: 0.4840332803074176
Energy: 0.4856516894588429
Energy: 0.49247369395295537
Energy: 0.4654434876158528
Energy: 0.4858368213834299
Energy: 0.512594772550057
Energy: 0.41942154590845276
Energy: 0.41964331209314676
Energy: 0.5123638752327432
Energy: 0.41984942853230994
Energy: 0.5395657252464182
Energy: 0.47931427176756314
Energy: 0.487784670650739
Energy: 0.4680284406733409
Energy: 0.47761326184844366
Energy: 0.41988127556745886
Energy: 0.4676534121374314
Energy: 0.4771404050635815
Energy: 0.48956905546144186
Energy: 0.48019312489766025
Energy: 0.4771498296846058
Energy: 0.4865766351643439
Energy: 0.48034518009232435
Energy: 0.5522024615353338
Energy: 0.47204957308318196
Energy: 0.47255511291133445
Energy: 0.5350764097612707
Energy: 0.4724130727333965
Energy: 0.47770678328788424
Energy: 0.5462841110411782
Energy: 0.48957853482691394
Energy: 0.48975503365618356
Energy: 0.4775453355441957
Energy: 0.4896098288169812
Energy: 0.4951791896936281
Energy: 0.4471437423076575
Energy: 0.49087114405904464
Energy: 0.49164360767176807
Energy: 0.44714138208848275
Energy: 0.4911321507980299
Energy: 0.49106195966901667
Energy: 0.5807397473257377
Energy: 0.49116510075075037
Energy: 0.49238188221868046
Energy: 0.4982130220051639
Energy: 0.49184232180985415
Energy: 0.4919081833410184
Energy: 0.6429819458001661
Energy: 0.4775782822583897
Energy: 0.4520151192975594
Energy: 0.45083603470878303
Energy: 0.5359945142159341
Energy: 0.45200218734797637

minimum gb energy = 0.41942154590845276 eV
minimum distance =  2.64468055656185 Angstroms
sigma value = 27


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

Energy: 0.5102816401149449
Energy: 0.4790157668292017
Energy: 0.5284540216274821
Energy: 0.5104445582089223
Energy: 0.45940069604470607
Energy: 0.5294628531825584
Energy: 0.5175091695635092
Energy: 0.4597855431339671
Energy: 0.4598908632374166
Energy: 0.4539258245249387
Energy: 0.4597432031810491
Energy: 0.45983168828844045
Energy: 0.4681579148221704
Energy: 0.45853007801895584
Energy: 0.4581806443164922
Energy: 0.48244231295565215
Energy: 0.4621673478288812
Energy: 0.45864924805267693
Energy: 0.46943807323676173
Energy: 0.45869199566710256
Energy: 0.458446189147555
Energy: 0.4809075041937851
Energy: 0.4707485082723547
Energy: 0.5101580473858945
Energy: 0.5170179570228307
Energy: 0.4104684612843284
Energy: 0.45401099980576776
Energy: 0.48110932493197844
Energy: 0.41069843605975
Energy: 0.4522502923401386
Energy: 0.45867209187482677
Energy: 0.5075601746340345
Energy: 0.5061627812812571
Energy: 0.4585085984623953
Energy: 0.5033622897248814
Energy: 0.4175667127206725
Energy: 0.46113735744642986
Energy: 0.4598836682669921
Energy: 0.45955771623582536
Energy: 0.46083342282468487
Energy: 0.45405293593373325
Energy: 0.4595683209159706
Energy: 0.4594426314434283
Energy: 0.5094701773762556
Energy: 0.45242289220554094
Energy: 0.4595076289833722
Energy: 0.5087166072920545
Energy: 0.4576921830245876
Energy: 0.4683787901721533
Energy: 0.4526422885117285
Energy: 0.4605559894575018
Energy: 0.4597474930867876
Energy: 0.44408039830260077
Energy: 0.4600171929325835
Energy: 0.47082850222326955
Energy: 0.4444715010134808
Energy: 0.4433327341457145
Energy: 0.46909051481304986
Energy: 0.43634782992138216
Energy: 0.4671723325930353
Energy: 0.46792282246829375
Energy: 0.46644546264006587
Energy: 0.4686520583476513
Energy: 0.4672613577652592
Energy: 0.466806060146792
Energy: 0.4664460735721459
Energy: 0.4241979518290055
Energy: 0.46041772008408405
Energy: 0.4602826296327405
Energy: 0.4366680818094605
Energy: 0.4366759405283698
Energy: 0.44319677043532024

minimum gb energy = 0.4104684612843284 eV
minimum distance =  2.68679962364065 Angstroms
sigma value = 9


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

Energy: 0.779137932910057
Energy: 0.492812348321718
Energy: 0.4730835167497459
Energy: 0.4707064346377125
Energy: 0.49283807612347785
Energy: 0.6816805797132738
Energy: 0.40790768463711397
Energy: 0.40480413653560826
Energy: 0.404552996953199
Energy: 0.4392399087195963
Energy: 0.4048091783726904
Energy: 0.404535247990208
Energy: 0.40817373700576226
Energy: 0.40555442413528403
Energy: 0.40541438965566634
Energy: 0.4184891932296242
Energy: 0.4055990244170161
Energy: 0.4049582726601377
Energy: 0.40976631280240355
Energy: 0.4331944650880427
Energy: 0.4220028385757849
Energy: 0.41720701227382523
Energy: 0.40921293506277806
Energy: 0.40501403523303886
Energy: 0.4422842120146746
Energy: 0.44595424954540946
Energy: 0.4706619671370947
Energy: 0.46966418046684655
Energy: 0.44939666983758764
Energy: 0.4372937129530479
Energy: 0.43487323485827245
Energy: 0.3969415775862491
Energy: 0.46949847992776134
Energy: 0.43493014636028343
Energy: 0.39984238161490776
Energy: 0.4395064871607713
Energy: 0.4359794083438421
Energy: 0.44075704719520353
Energy: 0.4354084635713971
Energy: 0.434366622753711
Energy: 0.45306847254589067
Energy: 0.4347357361684619
Energy: 0.43396779966688975
Energy: 0.4176513369157032
Energy: 0.42991276205287776
Energy: 0.43398698398698743
Energy: 0.416697535322806
Energy: 0.43338656299778766
Energy: 0.415671414158336
Energy: 0.4251022822811393
Energy: 0.44931765157010134
Energy: 0.5130996408851337
Energy: 0.42578860303696753
Energy: 0.4572011466490819
Energy: 0.5913509964498153
Energy: 0.43361958251938454
Energy: 0.45454099545063587
Energy: 0.3988182413435341
Energy: 0.4252528515976174
Energy: 0.4179269548121472
Energy: 0.3837157562827059
Energy: 0.4332809648890468
Energy: 0.4339781471380026
Energy: 0.40001450144481693
Energy: 0.4340759053982357
Energy: 0.43395673119983347
Energy: 0.44853103886606877
Energy: 0.43496805430810537
Energy: 0.43505151269322023
Energy: 0.45081000012159983
Energy: 0.43492692967630714
Energy: 0.43767515244440885
Energy: 0.6868708695008232
Energy: 0.43543739364232853
Energy: 0.4325878009282871
Energy: 0.4566234393103524
Energy: 0.4355257599237481
Energy: 0.6172156833649404
Energy: 0.4475486427695341
Energy: 0.4341001617498532
Energy: 0.4347863509293145
Energy: 0.4507801345919184
Energy: 0.43397822356852533
Energy: 0.4327357948135226
Energy: 0.40600302633116087
Energy: 0.432287230440136
Energy: 0.4346865986225708
Energy: 0.4059901769016254
Energy: 0.43229303648413864
Energy: 0.49501742713159846
Energy: 0.40603271882978537
Energy: 0.41579882357823705
Energy: 0.4052554893150225
Energy: 0.40671632630012483
Energy: 0.41689555125570815
Energy: 0.40499139848316046
Energy: 0.40445090401091244
Energy: 0.4461111325998991
Energy: 0.4372506509801679
Energy: 0.4044482622251152
Energy: 0.4462798011000695
Energy: 0.40490694496982466
Energy: 0.4094129492220377
Energy: 0.45019709729967067
Energy: 0.4705592668929078
Energy: 0.404957634723364
Energy: 0.4271113454418459
Energy: 0.43408127520363265
Energy: 0.40823230574152186
Energy: 0.41586619173814215
Energy: 0.3969857723148177
Energy: 0.40994833606902015
Energy: 0.4386365506220287
Energy: 0.40524616722008566
Energy: 0.408823412080787
Energy: 0.4113672969864704
Energy: 0.4097554345420911
Energy: 0.40993308928135225
Energy: 0.410362647453956
Energy: 0.40990142773609894
Energy: 0.40812569815205973
Energy: 0.4100471113052803
Energy: 0.409203567959503
Energy: 0.405217125889994
Energy: 0.40979536179180337
Energy: 0.3954410859545572
Energy: 0.43924030145436793
Energy: 0.4047644073445518
Energy: 0.42438679578750976
Energy: 0.4457062014943865
Energy: 0.40471941277206075
Energy: 0.4396018270583418
Energy: 0.4351139798745506
Energy: 0.40466171480850194
Energy: 0.40477792630716125
Energy: 0.4488543947335778
Energy: 0.4047099770606886
Energy: 0.42488122626406183
Energy: 0.40834443400191767
Energy: 0.40490050757107793
Energy: 0.4065987292716283
Energy: 0.41587255946637436
Energy: 0.40800212501918015
Energy: 0.4053154157123487
Energy: 0.5131992535417148
Energy: 0.40571026942856436
Energy: 0.4046047544122832
Energy: 0.45939278448271553
Energy: 0.40619662742124557
Energy: 0.49502685274889785
Energy: 0.4083174047235589
Energy: 0.41162550738112724
Energy: 0.4117614422579307
Energy: 0.43517303127026274
Energy: 0.41173642768099455
Energy: 0.4637118523412719
Energy: 0.43537108750046216
Energy: 0.554632172499466
Energy: 0.5524523430721286
Energy: 0.4354037263222779
Energy: 0.46224970475403143
Energy: 0.4402281132120419
Energy: 0.4435136691695806
Energy: 0.4154322526325093
Energy: 0.4350377493454063
Energy: 0.4352476895173415
Energy: 0.4259518164076765
Energy: 0.4351569291794782
Energy: 0.43529307133209016
Energy: 0.4243075602165746
Energy: 0.43414538041788225
Energy: 0.4356066489457936
Energy: 0.425674733269765
Energy: 0.4341492027310358
Energy: 0.41497258595437186
Energy: 0.41790816186806734
Energy: 0.4473652405544314
Energy: 0.41392967795180835
Energy: 0.4166328269407403
Energy: 0.4469542652750929
Energy: 0.3837466858135798
Energy: 0.43392685019717564
Energy: 0.4333203954341422
Energy: 0.4008061386578895
Energy: 0.45668541195966855
Energy: 0.46578869330826367
Energy: 0.38396952277414725
Energy: 0.4337865818929865
Energy: 0.43337003423764514
Energy: 0.3988918232573445
Energy: 0.43396569956618325
Energy: 0.4367346202159023
Energy: 0.41013103276952984
Energy: 0.4347239163637704
Energy: 0.4346265811966309
Energy: 0.45180973247519746
Energy: 0.43509056579414807
Energy: 0.4344915035746361
Energy: 0.40937744843433077
Energy: 0.4350586344528888
Energy: 0.43508755964488466
Energy: 0.426296347779715
Energy: 0.4351142074453626
Energy: 0.4332499804451223
Energy: 0.41011725101244384
Energy: 0.43459093257598463
Energy: 0.43490139456538623
Energy: 0.42496279533782605
Energy: 0.43774782942297297
Energy: 0.46360929848360777
Energy: 0.4099966363980157
Energy: 0.43408210183264995
Energy: 0.405688735350982
Energy: 0.4090449122647217
Energy: 0.43368103563895727
Energy: 0.4545894951944759
Energy: 0.4065825646901325
Energy: 0.4172589628760079
Energy: 0.3999217952686246
Energy: 0.40602132616425557
Energy: 0.4181907105900702
Energy: 0.405522615606825
Energy: 0.4044406618429818
Energy: 0.41675316933863954
Energy: 0.40515696378708255
Energy: 0.4045587197084521
Energy: 0.4172184930733373
Energy: 0.40473202537553504
Energy: 0.40473858784065414
Energy: 0.5083463894394674
Energy: 0.6172830565257063
Energy: 0.404825271493387
Energy: 0.4553775347391136
Energy: 0.4850894946719849
Energy: 0.4076582528559149
Energy: 0.41659243214207914
Energy: 0.40230840630238757
Energy: 0.4045076643610755
Energy: 0.416182173733534
Energy: 0.4048705362843331
Energy: 0.40870385565947587
Energy: 0.4103327244045842
Energy: 0.4045797799319317
Energy: 0.40948983289263696
Energy: 0.4097396567243507
Energy: 0.41031203045153236
Energy: 0.4081038416474762
Energy: 0.4118578516393003
Energy: 0.4098433689208224
Energy: 0.40958276336581706
Energy: 0.41062550325745134
Energy: 0.40902784761270283
Energy: 0.4354072685983049
Energy: 0.40471193815459205
Energy: 0.4048053653693943
Energy: 0.44842357745234135
Energy: 0.4045558353821666
Energy: 0.424317345390528

minimum gb energy = 0.3837157562827059 eV
minimum distance =  2.65475281401651 Angstroms
sigma value = 57


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

Energy: 0.20244987899043906
Energy: 0.22269975826811486
Energy: 0.20788713026692224
Energy: 0.20403805282066378
Energy: 0.22272162878928628
Energy: 0.2027150697728524
Energy: 0.2487016999099908
Energy: 0.22962055697058856
Energy: 0.20840061914052646
Energy: 0.22445911674251204
Energy: 0.22403597600187988
Energy: 0.2292020797586923
Energy: 0.2471473268849955
Energy: 0.22267036693820466
Energy: 0.22272880627764557
Energy: 0.22501082824952492
Energy: 0.22274012931494244
Energy: 0.22287125532494345
Energy: 0.24715355225937147
Energy: 0.22279653565027702
Energy: 0.22279024929228794
Energy: 0.22329519261459113
Energy: 0.24713399738450798
Energy: 0.24905269610518593
Energy: 0.24788338870159102
Energy: 0.20287656945171292
Energy: 0.21818862129612696
Energy: 0.2488574075634425
Energy: 0.2026470763306026
Energy: 0.22947703585531581
Energy: 0.2226567237025711
Energy: 0.20261831885038925
Energy: 0.20279322806353495
Energy: 0.20960285077402163
Energy: 0.20260086256249377
Energy: 0.218167319962023
Energy: 0.2231521089257335
Energy: 0.20870913980153216
Energy: 0.2088437328223538
Energy: 0.2239165534454213
Energy: 0.2227297430809368
Energy: 0.23002877807221223
Energy: 0.222693609855934
Energy: 0.24841997192642076
Energy: 0.2479406398094024
Energy: 0.22277394853790647
Energy: 0.22307808156115505
Energy: 0.22276702810734444
Energy: 0.24809172563070941
Energy: 0.22327622993485116
Energy: 0.22307094511035705
Energy: 0.24883915799597386
Energy: 0.22531979038496094
Energy: 0.22291076462516984
Energy: 0.20257104600689826
Energy: 0.22312143179396354
Energy: 0.21900786102149866
Energy: 0.2025800447417969
Energy: 0.225121265631926
Energy: 0.21887311528732187
Energy: 0.20263572470589677
Energy: 0.208383663899618
Energy: 0.20865351744618907
Energy: 0.20257160354748965
Energy: 0.22321188372672232
Energy: 0.22050442618995406
Energy: 0.2493172018232834
Energy: 0.2227829319783899
Energy: 0.22314087808232208
Energy: 0.24733950947496672
Energy: 0.2228125081322585
Energy: 0.2291504594869307
Energy: 0.24720503157349383
Energy: 0.24721019284295837
Energy: 0.24807771009986354
Energy: 0.24814841344446392
Energy: 0.24719818850661268
Energy: 0.24822394138687798
Energy: 0.24878505874905538
Energy: 0.22272371352612053
Energy: 0.22284930883121257
Energy: 0.24930791212435668
Energy: 0.2249915197203104
Energy: 0.22935969154124097
Energy: 0.2470601604343159
Energy: 0.20257216154121666
Energy: 0.20269964887649886
Energy: 0.22532898998958836
Energy: 0.20575810767712321
Energy: 0.21874620654205554
Energy: 0.22510229874039492
Energy: 0.22315063853379932
Energy: 0.2297481799011936
Energy: 0.22420309487773102
Energy: 0.20270645566152687
Energy: 0.2084768387088617
Energy: 0.2226842073720348
Energy: 0.22324602724052106
Energy: 0.22342496558888947
Energy: 0.22274066545486396
Energy: 0.22428773375337652
Energy: 0.22282484492181887
Energy: 0.24718982424865893
Energy: 0.22306896395412515
Energy: 0.24814920523035436
Energy: 0.24717018730092147
Energy: 0.22350712762883435
Energy: 0.2230112653940651
Energy: 0.20266941148038334
Energy: 0.20880554711140342
Energy: 0.2091697813356937
Energy: 0.20263515133063126
Energy: 0.2495919297624379
Energy: 0.2232580639162863

minimum gb energy = 0.20244987899043906 eV
minimum distance =  2.72863871191682 Angstroms
sigma value = 11


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

Energy: 0.6658040644285734
Energy: 0.37705300294930794
Energy: 0.4782019161603675
Energy: 0.5363181734756176
Energy: 0.3772305393882438
Energy: 0.47704955258468706
Energy: 0.3763699885763437
Energy: 0.3769342910508003
Energy: 0.38904967799362244
Energy: 0.3777544840436027
Energy: 0.3769030382415517
Energy: 0.400719552718877
Energy: 0.375274245871029
Energy: 0.37941600304882894
Energy: 0.37567479433254297
Energy: 0.37628737411143326
Energy: 0.37706859644199403
Energy: 0.37069766629753853
Energy: 0.3751895897426184
Energy: 0.4032865899249068
Energy: 0.3942536873215913
Energy: 0.37607713382050845
Energy: 0.37912915865797425
Energy: 0.3710631781067302
Energy: 0.3761983487571661
Energy: 0.4074750954133725
Energy: 0.37757855070932134
Energy: 0.3761594382885152
Energy: 0.4218419352114295
Energy: 0.38902754836073455
Energy: 0.4675665713922507
Energy: 0.45441218951642337
Energy: 0.39908999968010583
Energy: 0.46739244220249665
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Energy: 0.42525286761090914
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Energy: 0.37226813656454544
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Energy: 0.4947596236921244
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Energy: 0.43112867664676585
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Energy: 0.38897941510506845
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Energy: 0.406580474047647
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Energy: 0.403291019092419
Energy: 0.406001287667648
Energy: 0.5205238588249503
Energy: 0.5202917528732391
Energy: 0.4062717920176807
Energy: 0.5181679193429248
Energy: 0.4061810294557216
Energy: 0.571403864807118
Energy: 0.4080371194838275
Energy: 0.3853821370644652
Energy: 0.5044292390315568
Energy: 0.4069358646233544
Energy: 0.3853322499888833
Energy: 0.5199942184200774
Energy: 0.5387356017819636
Energy: 0.43223944523068
Energy: 0.4973534515737204
Energy: 0.5379918368073553
Energy: 0.43463043165866827
Energy: 0.5751624130833005
Energy: 0.4327420113027818
Energy: 0.42462841205364166
Energy: 0.3792518754365007
Energy: 0.4069524516542148
Energy: 0.3776587158464757
Energy: 0.552915375062124
Energy: 0.4095804533307806
Energy: 0.40779360890473637
Energy: 0.3710313003636042
Energy: 0.43091033342793
Energy: 0.3742187691761781
Energy: 0.4548038644689903
Energy: 0.4359351603372841
Energy: 0.4338215602926025
Energy: 0.4440381112556498
Energy: 0.4915480102236689
Energy: 0.43524358952420655
Energy: 0.5545589337444186
Energy: 0.40693004638847885
Energy: 0.3910396284898653
Energy: 0.3718535938332141
Energy: 0.4326689982731996
Energy: 0.37753729822759824
Energy: 0.37052921834173047
Energy: 0.48658230907964667
Energy: 0.48660781223988864
Energy: 0.3706628732046312
Energy: 0.5330783514047409
Energy: 0.37866823886652584
Energy: 0.37212327401355594
Energy: 0.3751455351127879
Energy: 0.39003544473672574
Energy: 0.37213282932928665
Energy: 0.3777025312092759
Energy: 0.39883561379192606
Energy: 0.3967286336492046
Energy: 0.37913229763185285
Energy: 0.37014835321078104
Energy: 0.39759582179265157
Energy: 0.37631981324854513
Energy: 0.37121488845074246
Energy: 0.406635390770401
Energy: 0.3792338469454284
Energy: 0.37573264428661396
Energy: 0.406935967883035
Energy: 0.3767252631881386
Energy: 0.4130654513581458
Energy: 0.5429123005375894
Energy: 0.39149866177999365
Energy: 0.3894803966572964
Energy: 0.4338953014552666
Energy: 0.37716273664688515
Energy: 0.371921429899175

minimum gb energy = 0.362673408070074 eV
minimum distance =  2.59871291464619 Angstroms
sigma value = 41


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

Energy: 0.6509349880459179
Energy: 0.4895123775183293
Energy: 0.4626637500475454
Energy: 0.5165381169132417
Energy: 0.48939226126279695
Energy: 0.5137639160507289
Energy: 0.41450359905991097
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Energy: 0.4140245143555599
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Energy: 0.46407924015260166
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Energy: 0.41568801270945765
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Energy: 0.41149965739775535
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Energy: 0.44310068209917436
Energy: 0.4543668768986529
Energy: 0.4516913718014782
Energy: 0.444316795963495
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Energy: 0.44381810695633644
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Energy: 0.42711412481526867
Energy: 0.4219905774940649
Energy: 0.4145473510068588
Energy: 0.4092612884639921
Energy: 0.417944949574519
Energy: 0.5272827802244808
Energy: 0.41500487158510163
Energy: 0.4156519512232671
Energy: 0.41246316885981776
Energy: 0.41489925410467854
Energy: 0.41944372221804127
Energy: 0.5313396815341961
Energy: 0.4307644645892491
Energy: 0.41495378656840864
Energy: 0.44697572499003696
Energy: 0.4720539282560149
Energy: 0.41932843032290074
Energy: 0.5329859842466514
Energy: 0.3993509444003945
Energy: 0.43523891419592486
Energy: 0.42341036284375
Energy: 0.39383163173007046
Energy: 0.44761184477783533
Energy: 0.4332949367726209
Energy: 0.4251834807264909
Energy: 0.42503047147420336
Energy: 0.4331875075800238
Energy: 0.4251842668186409
Energy: 0.4251979187299573
Energy: 0.43087263067575915
Energy: 0.44587967818599566
Energy: 0.4361638897817279
Energy: 0.43138153966785187
Energy: 0.4483392586304085
Energy: 0.435825864958691
Energy: 0.4533024282327635
Energy: 0.44855169314805926
Energy: 0.44355856488900425
Energy: 0.45113393089571274
Energy: 0.41235600823896673
Energy: 0.45051410028228867
Energy: 0.41388170050548023
Energy: 0.4130020574994092
Energy: 0.42190820375105104
Energy: 0.41396360638777235
Energy: 0.41420947712761874
Energy: 0.40893525800170577
Energy: 0.6273523766256419
Energy: 0.42015321522583315
Energy: 0.39911828684617995
Energy: 0.6295773048594362
Energy: 0.41482105358301957
Energy: 0.40740249616693625

minimum gb energy = 0.3908621375987119 eV
minimum distance =  2.61008319354465 Angstroms
sigma value = 33


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

Energy: 0.49022995490214566
Energy: 0.4835304760652848
Energy: 0.6121341390640069
Energy: 0.489684887864032
Energy: 0.48287949110407363
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Energy: 0.45691271575868986
Energy: 0.4374431294524253
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Energy: 0.4612859979053663
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Energy: 0.45526501528658175
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Energy: 0.44472622728281125
Energy: 0.49092219649188457
Energy: 0.4427079610712448
Energy: 0.5635005597361092
Energy: 0.4563423220112
Energy: 0.43748635224324367
Energy: 0.43316973111775564
Energy: 0.45545917872730374
Energy: 0.43876663387896103
Energy: 0.6928447706712972
Energy: 0.5518756344803047
Energy: 0.4273667849045679
Energy: 0.42513142884755667
Energy: 0.5529276249742567
Energy: 0.425674554650428

minimum gb energy = 0.4194812952805214 eV
minimum distance =  2.67799587930277 Angstroms
sigma value = 67


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

Energy: 0.5444078864416995
Energy: 0.5026600171211646
Energy: 0.4394965769874819
Energy: 0.5130374271155977
Energy: 0.5032207523367455
Energy: 0.4386892072766788
Energy: 0.5243411426735664
Energy: 0.45185664016440363
Energy: 0.4519225523795425
Energy: 0.4637841887600483
Energy: 0.4804925995152304
Energy: 0.4518999481496852
Energy: 0.4951401341917794
Energy: 0.43604043762120714
Energy: 0.4552289448310188
Energy: 0.45527333226224953
Energy: 0.436009004967179
Energy: 0.45514639947066887
Energy: 0.48438319222773524
Energy: 0.4558286180927197
Energy: 0.45523696374264416
Energy: 0.48361463080871697
Energy: 0.4551492184814119
Energy: 0.4557368816286265
Energy: 0.48366327104589074
Energy: 0.47059058778999513
Energy: 0.4711510888278856
Energy: 0.4844360254255017
Energy: 0.4709359048377378
Energy: 0.48268513342668246
Energy: 0.4831452918367462
Energy: 0.4458384503994981
Energy: 0.48383353642664906
Energy: 0.4835185305575325
Energy: 0.4444711508910803
Energy: 0.4835947921197576
Energy: 0.5208172754176589
Energy: 0.45634551767324094
Energy: 0.4558121482137565
Energy: 0.49766326518094844
Energy: 0.4560193269488207
Energy: 0.45588070818964954

minimum gb energy = 0.436009004967179 eV
minimum distance =  2.68972373921403 Angstroms
sigma value = 3


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

Energy: 0.69745442384889
Energy: 0.7175732572631747
Energy: 0.5575569270280318
Energy: 0.5215018767017242
Energy: 0.716748864789191
Energy: 0.5588277517387983
Energy: 0.4963410013422194
Energy: 0.534066332488902
Energy: 0.5233397433632804
Energy: 0.5307916236055065
Energy: 0.517356352010573
Energy: 0.5094857339030714
Energy: 0.54492140608306
Energy: 0.5104630622334558
Energy: 0.5103612927081828
Energy: 0.5460358889257102
Energy: 0.510468219611187
Energy: 0.5078532023691141
Energy: 0.5003386962438422
Energy: 0.507463790827769
Energy: 0.4969807529833057
Energy: 0.5006486206535682
Energy: 0.5124943060265116
Energy: 0.49705122148482783
Energy: 0.5051040845059706
Energy: 0.5120624470913143
Energy: 0.5068753273813663
Energy: 0.5059169016701939
Energy: 0.5098639997540363
Energy: 0.5031271363627796
Energy: 0.5202594799530987
Energy: 0.5117160327938444
Energy: 0.5121721075730592
Energy: 0.521096099586001
Energy: 0.509941825635533
Energy: 0.5173034113203636
Energy: 0.49911896524602584
Energy: 0.5490343262391414
Energy: 0.5296573507328793
Energy: 0.5376986845189452
Energy: 0.5487431794341648
Energy: 0.5343089632370042
Energy: 0.6567319190324403
Energy: 0.5596239132509035
Energy: 0.571662678284727
Energy: 0.5105317104493762
Energy: 0.5729709553587788
Energy: 0.5481261611029439
Energy: 0.4993386203767486
Energy: 0.5240924785123732
Energy: 0.5343765686661409
Energy: 0.5359560836899986
Energy: 0.5203957796632913
Energy: 0.5287792172756229
Energy: 0.6421257042400473
Energy: 0.512191018477445
Energy: 0.5125604843174573
Energy: 0.6429932391289607
Energy: 0.5122427804230018
Energy: 0.5361707191087197
Energy: 0.554520206845502
Energy: 0.5152044938439596
Energy: 0.5138561192976537
Energy: 0.5273739020303424
Energy: 0.5153528587494985
Energy: 0.5173996415919878
Energy: 0.5794509152894214
Energy: 0.5141163648679639
Energy: 0.5164886350748104
Energy: 0.53381287832234
Energy: 0.5235521993826208
Energy: 0.5196553564798171
Energy: 0.5476063917717234
Energy: 0.5102300087039429
Energy: 0.5133292542134296
Energy: 0.5434042134219156
Energy: 0.5101546315895517
Energy: 0.507405846401273
Energy: 0.5189853773152509
Energy: 0.49958555363807755
Energy: 0.4959866397647497
Energy: 0.520365201699844
Energy: 0.4998944772109754
Energy: 0.4954584451595459
Energy: 0.5811812447996098
Energy: 0.49801730716438725
Energy: 0.5211488627646425
Energy: 0.5117056693872399
Energy: 0.49706570326150884
Energy: 0.5076941424068816
Energy: 0.5189014161652145
Energy: 0.5125955367427235
Energy: 0.5095927458336107
Energy: 0.5192829335530749
Energy: 0.5396068689526929
Energy: 0.5094546665457722
Energy: 0.6268287704215644
Energy: 0.5268777386060922
Energy: 0.5262341273447617
Energy: 0.6238872043300419
Energy: 0.5264841222023221
Energy: 0.5807035916522393
Energy: 0.5202087007567217
Energy: 0.5271758133320952
Energy: 0.5216807496264478
Energy: 0.5249650441372816
Energy: 0.53835026616925
Energy: 0.5164349435781328
Energy: 0.689972472337596
Energy: 0.5265841800689013
Energy: 0.5073649942639228
Energy: 0.49856364749794296
Energy: 0.5457626615758594
Energy: 0.4986230481562152
Energy: 0.6115910926601963
Energy: 0.5175753190652438
Energy: 0.5069283784234112
Energy: 0.4995977886077008
Energy: 0.5170658317385672
Energy: 0.5003504465833486
Energy: 0.5246317247574003
Energy: 0.5224858600289961
Energy: 0.5234374433353935
Energy: 0.5259844396710014
Energy: 0.5237327737971377
Energy: 0.5158424887645218
Energy: 0.5306855766636948
Energy: 0.5295091623638999
Energy: 0.520086990261794
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Energy: 0.5319661971335372
Energy: 0.5182343343741508
Energy: 0.5118367864886028
Energy: 0.5333828396305961
Energy: 0.5114212426272964
Energy: 0.5125260845835796
Energy: 0.5213683042705859
Energy: 0.5095505868872074
Energy: 0.5175647902691058
Energy: 0.5114932125928002
Energy: 0.5184251646116911
Energy: 0.5178449665199573
Energy: 0.5112244594617704
Energy: 0.5187622789058073
Energy: 0.5087218557873298
Energy: 0.5265297528709925
Energy: 0.5086241211398571
Energy: 0.5268916916398135
Energy: 0.5176555432209278
Energy: 0.5086719764500078
Energy: 0.6910477732333755
Energy: 0.5614817523995422
Energy: 0.586014804722714
Energy: 0.50979043213035
Energy: 0.630017051185745
Energy: 0.5357421396822162
Energy: 0.5613944709128413
Energy: 0.554047590485819
Energy: 0.585367385792192
Energy: 0.512581364609403
Energy: 0.5682765187646142
Energy: 0.5259292959615578
Energy: 0.537738691078588
Energy: 0.5095443720565533
Energy: 0.5075165992995633
Energy: 0.5403854729558194
Energy: 0.529704802801765
Energy: 0.5078356085253964
Energy: 0.5130633491227146
Energy: 0.5106375757077962
Energy: 0.5071682841421173
Energy: 0.5140767257569911
Energy: 0.5094968144799066
Energy: 0.5020820357792863
Energy: 0.49579708355872903
Energy: 0.5309699659492538
Energy: 0.49815327752119515
Energy: 0.49693215786579653
Energy: 0.5275462684084656
Energy: 0.4965113287377302
Energy: 0.5122218190838455
Energy: 0.5115286887430204
Energy: 0.5067506809833513
Energy: 0.5130533396614383
Energy: 0.5107031625496558
Energy: 0.5068245279795703
Energy: 0.5041386863878741
Energy: 0.5369179195975229
Energy: 0.5324433963891617
Energy: 0.5263079355301085
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Energy: 0.5345707991148649
Energy: 0.6534434066470295
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Energy: 0.5465188825105639
Energy: 0.510537422918896
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Energy: 0.5177526350213382
Energy: 0.5417516732360173
Energy: 0.549444120482948
Energy: 0.5492853666441215
Energy: 0.5083693632590002
Energy: 0.553725095204316
Energy: 0.5125728159372974
Energy: 0.5207156208664294
Energy: 0.5148568967088195
Energy: 0.5135743767634747
Energy: 0.5243085838664677
Energy: 0.5176074024878878
Energy: 0.5171252363245274
Energy: 0.5607182164948915
Energy: 0.5125472537195275
Energy: 0.5125248931070238
Energy: 0.5603757845317632
Energy: 0.5122271527606295
Energy: 0.5361776605458513
Energy: 0.5188464165847846
Energy: 0.5226349456474768
Energy: 0.5338615434755823
Energy: 0.5197233347411713
Energy: 0.52353007820168
Energy: 0.5349165846600806
Energy: 0.5478574449541689
Energy: 0.514494558015217
Energy: 0.5054340484877622
Energy: 0.5458526016394997
Energy: 0.5124853626518001
Energy: 0.5167106920373219
Energy: 0.525928198812147
Energy: 0.49910414495971467
Energy: 0.4982323902274579
Energy: 0.5273271082444643
Energy: 0.49753871505640257
Energy: 0.4990329124818117
Energy: 0.5808118461821077
Energy: 0.4991719206427423
Energy: 0.4990895282237705
Energy: 0.5118547944480799
Energy: 0.5121884733227103
Energy: 0.49916576810439606
Energy: 0.519468631008884
Energy: 0.5276805334477219
Energy: 0.507559409850346
Energy: 0.5373003671250614
Energy: 0.5470960167299415
Energy: 0.4964546289701568
Energy: 0.5814305166621672
Energy: 0.5288132637989041
Energy: 0.5453414485656104
Energy: 0.5518214408136144
Energy: 0.5066132126788555
Energy: 0.5199715526134738
Energy: 0.6595390600993494
Energy: 0.5260552155926924
Energy: 0.5263354590907892
Energy: 0.6086959370210928
Energy: 0.5117691151135844
Energy: 0.5782592921302675
Energy: 0.5140448788834285
Energy: 0.5114495198917183
Energy: 0.5119874729213668
Energy: 0.5189097641291657
Energy: 0.5309206480232939
Energy: 0.5090448716639482
Energy: 0.6171905347816012
Energy: 0.5179306756891018
Energy: 0.5234419855522693
Energy: 0.5112185344438444
Energy: 0.5176790436095008
Energy: 0.5237042303576012
Energy: 0.5140447995699019
Energy: 0.5117243010039344
Energy: 0.5121301599315787
Energy: 0.5190207644936753
Energy: 0.513459444571146
Energy: 0.5090276494253884
Energy: 0.530440786904819
Energy: 0.5271773827259121
Energy: 0.5181981544687868
Energy: 0.5292800565163726
Energy: 0.5288680813352056
Energy: 0.5212250900181921
Energy: 0.5229270309863373
Energy: 0.5269423486799689
Energy: 0.5213046738136821
Energy: 0.5241498620874607
Energy: 0.5293459663418313
Energy: 0.5154622822809584
Energy: 0.5220349905367001
Energy: 0.5079679917656021
Energy: 0.5076608329275524
Energy: 0.522359357780595
Energy: 0.5070396041569799
Energy: 0.5085215532579829
Energy: 0.5915264851537481
Energy: 0.5073220331954927
Energy: 0.5075146473175562
Energy: 0.6031441619926182
Energy: 0.5066160968848695
Energy: 0.5066375766370098
Energy: 0.49378157647624193
Energy: 0.5316311470329482
Energy: 0.5165462780485818
Energy: 0.53659126780564
Energy: 0.5493090895180357
Energy: 0.5230691645893703

minimum gb energy = 0.49378157647624193 eV
minimum distance =  2.59891130722453 Angstroms
sigma value = 81


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

Energy: 0.7660271112034013
Energy: 0.6027055858169924
Energy: 0.5664963163999541
Energy: 0.560388001921762
Energy: 0.6024610404459383
Energy: 0.5665804647527448
Energy: 0.5357149349738558
Energy: 0.5535337209103803
Energy: 0.5532579428948969
Energy: 0.5383291441418627
Energy: 0.5548412805901547
Energy: 0.5173517715510089
Energy: 0.5520842681995664
Energy: 0.5175683840115075
Energy: 0.509618510825556
Energy: 0.5525593763241715
Energy: 0.5150399713186766
Energy: 0.5471700076164784
Energy: 0.5071560997982889
Energy: 0.5227278146306551
Energy: 0.5321159682219764
Energy: 0.5069979650071887
Energy: 0.5113850789912935
Energy: 0.5085999986014935
Energy: 0.5053682309438822
Energy: 0.5209306353953546
Energy: 0.5239461320072596
Energy: 0.5055845163246312
Energy: 0.5161300950176121
Energy: 0.523567868637727
Energy: 0.5068601817913603
Energy: 0.5163326496317547
Energy: 0.5184816750184815
Energy: 0.5258297381390696
Energy: 0.5150875414071158
Energy: 0.5186647911715987
Energy: 0.517719263113152
Energy: 0.504292203499991
Energy: 0.525218442529711
Energy: 0.5178566750132616
Energy: 0.5028605463319371
Energy: 0.5121972425525436
Energy: 0.5009824850419611
Energy: 0.5830588532550394
Energy: 0.6037337895352392
Energy: 0.49757568886812864
Energy: 0.5830695479539767
Energy: 0.50620954664546
Energy: 0.5417573603373301
Energy: 0.520702679294798
Energy: 0.521838166422451
Energy: 0.528604978821832
Energy: 0.5128320269300777
Energy: 0.530107658242792
Energy: 0.5321407730800229
Energy: 0.5050622862638974
Energy: 0.5045437684225537
Energy: 0.5323789456058178
Energy: 0.5050224822221985
Energy: 0.5062533921003132
Energy: 0.5215067276990423
Energy: 0.5048864255357763
Energy: 0.5048497171701604
Energy: 0.5214615478285468
Energy: 0.49398378282906824
Energy: 0.5270985500228493
Energy: 0.5012528175363735
Energy: 0.5301704688753168
Energy: 0.5303065846782372
Energy: 0.5104835095901898
Energy: 0.5257347704329977
Energy: 0.5272115018191965
Energy: 0.5525812080953167
Energy: 0.5413974590165178
Energy: 0.5394642450532723
Energy: 0.5090670503335099
Energy: 0.5198820597590756
Energy: 0.5124719319903357
Energy: 0.489258594894401
Energy: 0.4995730269507601
Energy: 0.5200554576898863
Energy: 0.4897616230332955
Energy: 0.5075566917564889
Energy: 0.5196407928677506
Energy: 0.4897482672363317
Energy: 0.5186468820311189
Energy: 0.5335432781555488
Energy: 0.504021133140799
Energy: 0.5184866377314038
Energy: 0.5041368543092734
Energy: 0.49572859159390376
Energy: 0.5030129053215409
Energy: 0.5038415935373174
Energy: 0.4891358194671818
Energy: 0.4752072047646116
Energy: 0.5040960248669758
Energy: 0.5836187492042335
Energy: 0.49743826560497445
Energy: 0.5071716925056394
Energy: 0.5820583430484659
Energy: 0.4984223018180727
Energy: 0.507204909855475
Energy: 0.4731154223705831
Energy: 0.47361037666563444
Energy: 0.4737066125293169
Energy: 0.4737245131488288
Energy: 0.4733379702037574
Energy: 0.4947922498833343
Energy: 0.47326312698615347
Energy: 0.4734769672471819
Energy: 0.47331053953211505
Energy: 0.47290707048379954
Energy: 0.5051984616759443
Energy: 0.4732708214964625
Energy: 0.4731493019773087
Energy: 0.4737544234208889
Energy: 0.47347862107123795
Energy: 0.4730904472201114
Energy: 0.5059234593441603
Energy: 0.47351801017476847
Energy: 0.4732665664262392
Energy: 0.4732922945599994
Energy: 0.4737140411179089
Energy: 0.4737436171675315
Energy: 0.4732499749235522
Energy: 0.474786981035321
Energy: 0.5334892956435642
Energy: 0.5092396268801972
Energy: 0.5106008702757191
Energy: 0.533936687269817
Energy: 0.5103101358296768
Energy: 0.5133641927351696
Energy: 0.48817396101184785
Energy: 0.4746775655744654
Energy: 0.5025503393446978
Energy: 0.48885649847276746
Energy: 0.47448781683607616
Energy: 0.5002028878004311
Energy: 0.48803381017329306
Energy: 0.5398866895205058
Energy: 0.4996161931777738
Energy: 0.5017734733990655
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Energy: 0.5000042138859604
Energy: 0.540168708824471
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Energy: 0.5215932131996975
Energy: 0.540854290271202
Energy: 0.5090333432134786
Energy: 0.5216251944075424
Energy: 0.5011908810603558
Energy: 0.566662382147666
Energy: 0.5716615147073869
Energy: 0.49737990624370076
Energy: 0.5872128049271476
Energy: 0.5277498560662767
Energy: 0.5011358093575335
Energy: 0.5304996320704589
Energy: 0.5293955885313002
Energy: 0.507634240446531
Energy: 0.5262889970012012
Energy: 0.5300850872785936
Energy: 0.5713411082909472
Energy: 0.49561204490782407
Energy: 0.5125913221774264
Energy: 0.5719505588796561
Energy: 0.4935910175561253
Energy: 0.5269087231506576
Energy: 0.5348007989143575
Energy: 0.5059505338306786
Energy: 0.5059298274938162
Energy: 0.5347778333674477
Energy: 0.5055866869651381
Energy: 0.5044675667023878
Energy: 0.5399294156308475
Energy: 0.5211293740678714
Energy: 0.5225545289252592
Energy: 0.5279063554231528
Energy: 0.5114600829241791
Energy: 0.51255176351011
Energy: 0.5560191379793884
Energy: 0.5561117593736071
Energy: 0.5549123742270288
Energy: 0.5108109051269343
Energy: 0.5723306107643626
Energy: 0.5185855569949801
Energy: 0.5035743738890118
Energy: 0.5009643553732115
Energy: 0.5007147063450869
Energy: 0.5179961948909033
Energy: 0.5011495611972029
Energy: 0.5005406049805952
Energy: 0.5139422687489237
Energy: 0.500570428537015
Energy: 0.500505939566407
Energy: 0.5257753944720864
Energy: 0.5009866177099919
Energy: 0.5010031381638855
Energy: 0.5104462319144915
Energy: 0.5258742014569148
Energy: 0.5267103026701756
Energy: 0.5212742749115846
Energy: 0.5309420848636905
Energy: 0.5279387962628984
Energy: 0.5085077873535953
Energy: 0.52040977597283
Energy: 0.5208247763436401
Energy: 0.5086413601205203
Energy: 0.5119710371074895
Energy: 0.5325458358471428
Energy: 0.5852285828174255
Energy: 0.49848002429015553
Energy: 0.49756027401396846
Energy: 0.5852701366200128
Energy: 0.4986140313186678
Energy: 0.5948211151966417
Energy: 0.5358217853549603
Energy: 0.5547547422181555
Energy: 0.5501527739781755
Energy: 0.5380015800775461
Energy: 0.5557522136124495
Energy: 0.5211097723975967
Energy: 0.48011942316059114
Energy: 0.5751266295479422
Energy: 0.5664124668367126
Energy: 0.5362982912024254
Energy: 0.5760099249406752
Energy: 0.5645589613224986

minimum gb energy = 0.47290707048379954 eV
minimum distance =  2.57711936592009 Angstroms
sigma value = 43


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

Energy: 0.7488234771752675
Energy: 0.663878269955959
Energy: 0.5163457848996488
Energy: 0.5313761572653303
Energy: 0.6638193272642293
Energy: 0.5314039843050729
Energy: 0.5297712735446923
Energy: 0.5015767697618069
Energy: 0.5321878848270668
Energy: 0.5031736052464476
Energy: 0.4890380202325804
Energy: 0.5093330928053599
Energy: 0.4851519849530391
Energy: 0.46797557450321614
Energy: 0.4922645683933601
Energy: 0.48530929084896757
Energy: 0.5148204274104914
Energy: 0.5093595554638302
Energy: 0.4852316434001233
Energy: 0.4678380552651688
Energy: 0.48533550872202574
Energy: 0.48522846996069235
Energy: 0.5160716062070428
Energy: 0.4851515222086944
Energy: 0.48575208283353244
Energy: 0.5082337208878297
Energy: 0.5078048575901026
Energy: 0.4858073424902646
Energy: 0.5084465149768682
Energy: 0.5092127884336288
Energy: 0.5349207637408335
Energy: 0.5081960051059261
Energy: 0.5085058068521805
Energy: 0.5297164404108197
Energy: 0.48613642432213117
Energy: 0.5198721247070652
Energy: 0.5009882874617289
Energy: 0.4854698794223842
Energy: 0.48536348747012936
Energy: 0.5009641323366699
Energy: 0.4854596411366879
Energy: 0.48546162785766106
Energy: 0.5263511526720737
Energy: 0.48636821440051353
Energy: 0.4858567768592525
Energy: 0.5172483429765485
Energy: 0.4859571217616214
Energy: 0.5318834441684722
Energy: 0.5012175323100653
Energy: 0.5099298477264729
Energy: 0.48564188052247925
Energy: 0.501803202672206
Energy: 0.5325641553723992
Energy: 0.485947735960907
Energy: 0.5515588030859095
Energy: 0.5016462795005906
Energy: 0.5120828156481403
Energy: 0.5537069729199326
Energy: 0.5100009706689815
Energy: 0.5653644826809284
Energy: 0.5329233002491344
Energy: 0.5336951213174507
Energy: 0.4981030603481068
Energy: 0.5370522968209792
Energy: 0.5261482106491208
Energy: 0.5226390817315907
Energy: 0.5309447141031246
Energy: 0.5316399499739815
Energy: 0.5089915014350012
Energy: 0.46921959074796166
Energy: 0.5510403642268755
Energy: 0.5091278567821014
Energy: 0.5314326596393638
Energy: 0.5089325892116026
Energy: 0.5024959253172769
Energy: 0.49259736981985314
Energy: 0.5028483874864487
Energy: 0.502448221681471
Energy: 0.46643030968799776
Energy: 0.5098877382877334
Energy: 0.5265217869093001
Energy: 0.4893000116697801
Energy: 0.503365063656642
Energy: 0.5272164380336352
Energy: 0.46616861622886596
Energy: 0.5207444728101783
Energy: 0.5209543959416402
Energy: 0.46637447898237605
Energy: 0.5184026397385417
Energy: 0.46654809096072364
Energy: 0.466530892388811
Energy: 0.5002381170721395
Energy: 0.466088728044158
Energy: 0.46716769186317453
Energy: 0.5037205440527248
Energy: 0.46632093845527367
Energy: 0.46632247402492494
Energy: 0.48146926981677257
Energy: 0.4670438979982717
Energy: 0.4666113484739696
Energy: 0.5193443931763885
Energy: 0.4671341870007192
Energy: 0.46645422599311304
Energy: 0.5067899537902321
Energy: 0.48953018509154833
Energy: 0.5213072410286743
Energy: 0.504504618364748
Energy: 0.5126243021722646
Energy: 0.5631720344385474
Energy: 0.5179539389596809
Energy: 0.517293954465457
Energy: 0.5682987877731054
Energy: 0.5047109960529832
Energy: 0.5084911733638369
Energy: 0.5007701292030613
Energy: 0.5116805236174196
Energy: 0.5171867558446618
Energy: 0.508805206460271
Energy: 0.5430906416580957
Energy: 0.508696723496354
Energy: 0.46649157515762524
Energy: 0.5173369479092829
Energy: 0.5078049035412969
Energy: 0.5209750497361019
Energy: 0.5312469371043366
Energy: 0.5283304165146805
Energy: 0.5797966689496584
Energy: 0.5013839433687914
Energy: 0.5256367918321523
Energy: 0.5797246091845184
Energy: 0.5155085605436878
Energy: 0.541811252416114
Energy: 0.5042311671438882
Energy: 0.5114070685548199
Energy: 0.5088809473076699
Energy: 0.5045207367896414
Energy: 0.5044927187939818
Energy: 0.5078910097199091
Energy: 0.5224249366471647
Energy: 0.49578885573976245
Energy: 0.5170238076987195
Energy: 0.5091987485143789
Energy: 0.466493666477157
Energy: 0.51719943834269
Energy: 0.5173416378349329
Energy: 0.4662741773989853
Energy: 0.4662624959627496
Energy: 0.5175047546126814
Energy: 0.4662972952595106
Energy: 0.46653766692576776
Energy: 0.5026594406501029
Energy: 0.46694873746845933
Energy: 0.4676732721496069
Energy: 0.5172940875630949
Energy: 0.46669102734238205
Energy: 0.4666568628183038
Energy: 0.5027549431440745
Energy: 0.5230121123347411
Energy: 0.5237506673029999
Energy: 0.5097140790129768
Energy: 0.46641175729855966
Energy: 0.5191582483375827
Energy: 0.5030330618097034
Energy: 0.5282739565208584
Energy: 0.5092705969154506
Energy: 0.503747174034962
Energy: 0.5006878195775294
Energy: 0.5092578543918173
Energy: 0.518473304286745
Energy: 0.4856703703170522
Energy: 0.5018492234460082
Energy: 0.5183502111186704
Energy: 0.5169262958030054
Energy: 0.5425501700200593
Energy: 0.5286492948325802
Energy: 0.5015905223089777
Energy: 0.527260487818984
Energy: 0.5033504387350419
Energy: 0.4894760955906362
Energy: 0.48540874124586636
Energy: 0.4679870359906675
Energy: 0.5776330113140864
Energy: 0.5646053262047481
Energy: 0.5012998563649778
Energy: 0.6149457872943418
Energy: 0.5022810038075879

minimum gb energy = 0.466088728044158 eV
minimum distance =  2.6298977070337 Angstroms
sigma value = 57


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

Energy: 0.5502034357981289
Energy: 0.5134205136527514
Energy: 0.5325071591226647
Energy: 0.45300406609682553
Energy: 0.5130410337835488
Energy: 0.5294259313923991
Energy: 0.5325125172778645
Energy: 0.46995676964475974
Energy: 0.47007757677036716
Energy: 0.47025682830694293
Energy: 0.46990402369600737
Energy: 0.4667916704734136
Energy: 0.46844254973128385
Energy: 0.42541345064671743
Energy: 0.4254403243799555
Energy: 0.46614009180563254
Energy: 0.4254553337456787
Energy: 0.4696247800874107
Energy: 0.46629688627201754
Energy: 0.4252028981587109
Energy: 0.4253510995806758
Energy: 0.4658979579310614
Energy: 0.4818116271078078
Energy: 0.46607563580378397
Energy: 0.46607646240087053
Energy: 0.48538457289513853
Energy: 0.4405401310622734
Energy: 0.4659912998599063
Energy: 0.4406687830334775
Energy: 0.4408561397479352
Energy: 0.4252359818539732
Energy: 0.4404508341645801
Energy: 0.44051261733033964
Energy: 0.4775163204405209
Energy: 0.46665133681437765
Energy: 0.4849836669097517
Energy: 0.5000904582929985
Energy: 0.4668702718604612
Energy: 0.46615571460472854
Energy: 0.5006716649637549
Energy: 0.46770706064086626
Energy: 0.4661413117789103
Energy: 0.4651269271714421
Energy: 0.46656653606853143
Energy: 0.4670148686595179
Energy: 0.4858278891517234
Energy: 0.4662756234070591
Energy: 0.46689503380062614
Energy: 0.4701930513304295
Energy: 0.46749115839038624
Energy: 0.466659504565539
Energy: 0.47057823910324015
Energy: 0.4709659751005098
Energy: 0.4669180657411552
Energy: 0.5716066595563999
Energy: 0.4666410273714972
Energy: 0.46618169213880106
Energy: 0.5716681716714829
Energy: 0.46736230728466804
Energy: 0.4909607725132264
Energy: 0.532676434636333
Energy: 0.46617104545599175
Energy: 0.46735516668928945
Energy: 0.46963624818795924
Energy: 0.46918757632860686
Energy: 0.5173600534740228
Energy: 0.425273922756479
Energy: 0.4702097428059066
Energy: 0.4699465807974263
Energy: 0.4264712654338599
Energy: 0.470391761262248
Energy: 0.5058530075194544
Energy: 0.42526656089999815
Energy: 0.47135644271669885
Energy: 0.50615802700903
Energy: 0.5058338363542503
Energy: 0.47013525518478433
Energy: 0.5062129097156843
Energy: 0.5317353552595946
Energy: 0.47004525759286064
Energy: 0.4667729636768359
Energy: 0.47021179448283634
Energy: 0.4706074449355026
Energy: 0.46636631903903236
Energy: 0.466244014330188
Energy: 0.45339976049512765
Energy: 0.45237580474087313
Energy: 0.46654916237979727
Energy: 0.4256236067778334
Energy: 0.45268769853087454
Energy: 0.46600106191558655
Energy: 0.4849223751712419
Energy: 0.46731606395277503
Energy: 0.4667593792509648
Energy: 0.50097087040654
Energy: 0.4660175290322607
Energy: 0.46664133103263744
Energy: 0.4862141646244572
Energy: 0.44055504636564685
Energy: 0.4666274434970766
Energy: 0.4407385864398204
Energy: 0.4404864822511915
Energy: 0.4667796529550141
Energy: 0.46657898594880864
Energy: 0.44150633514607523
Energy: 0.4669276869072532
Energy: 0.46654568872889407
Energy: 0.4418457639314234
Energy: 0.47086956022082055
Energy: 0.46616056260622935
Energy: 0.4662617623299971
Energy: 0.4697791533497253
Energy: 0.46607617635928333
Energy: 0.4663156745330545
Energy: 0.47056332602429585
Energy: 0.5169213192059874
Energy: 0.4664506942565105
Energy: 0.47062844797929376
Energy: 0.5129227795336486
Energy: 0.4666945269812319
Energy: 0.47010172993612864
Energy: 0.5131130941723595
Energy: 0.5231268285801911
Energy: 0.47019887765868873
Energy: 0.4710080774457422
Energy: 0.4665491330154053
Energy: 0.5135995664548959
Energy: 0.4910434367908665
Energy: 0.4912740891225319
Energy: 0.5135823312496578
Energy: 0.4653968147284328
Energy: 0.4910382516213006
Energy: 0.531698531653544
Energy: 0.46991502079597336
Energy: 0.4702108231321001
Energy: 0.4708470545543393
Energy: 0.47118175769158843
Energy: 0.5233603854994835
Energy: 0.4251763962817874
Energy: 0.5624927440726147
Energy: 0.5061206846908785
Energy: 0.5057920847081764
Energy: 0.5584207631847062
Energy: 0.5062747980088425

minimum gb energy = 0.4251763962817874 eV
minimum distance =  2.65090205568137 Angstroms
sigma value = 17


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

Energy: 0.6673161857964542
Energy: 0.6157073411428431
Energy: 0.5429963239541049
Energy: 0.4466854741015505
Energy: 0.6164366598944168
Energy: 0.44657712869673316
Energy: 0.46826118826502394
Energy: 0.4727308534449394
Energy: 0.4715775192282574
Energy: 0.5263477384286863
Energy: 0.5267638084946707
Energy: 0.47158072773512283
Energy: 0.5677745071911808
Energy: 0.4223419667657596
Energy: 0.4222056911628141
Energy: 0.5688928259341058
Energy: 0.4222898322601885
Energy: 0.4223865095193347
Energy: 0.4714099244749388
Energy: 0.4223670959327289
Energy: 0.4225602390673567
Energy: 0.47147624558735796
Energy: 0.5389690240056828
Energy: 0.47119644154923274
Energy: 0.4154191209166751
Energy: 0.45758614642622547
Energy: 0.4580913381789377
Energy: 0.4156716812662075
Energy: 0.5043009049372208
Energy: 0.45671953716370733
Energy: 0.4224379755371638
Energy: 0.4085988615873981
Energy: 0.4098609902071051
Energy: 0.3935142670422606
Energy: 0.4082732666404512
Energy: 0.44155164431302774
Energy: 0.45986524633974424
Energy: 0.408603284638952
Energy: 0.40824325519294036
Energy: 0.4598371842071276
Energy: 0.41030823625412305
Energy: 0.40880548949839485
Energy: 0.4088616616205056
Energy: 0.44854597402740387
Energy: 0.4487047070292154
Energy: 0.4819553311423205
Energy: 0.4482609764907881
Energy: 0.4816566161605661
Energy: 0.40970872507228956
Energy: 0.44888368572363735
Energy: 0.44874414793297895
Energy: 0.41037291502901563
Energy: 0.5131954431063659
Energy: 0.4084996024314928
Energy: 0.40826236621398965
Energy: 0.4088278702631255
Energy: 0.4087351039852776
Energy: 0.4081549334985741
Energy: 0.4086353256011002
Energy: 0.40961573367404286
Energy: 0.47389802016797405
Energy: 0.4396388993740902
Energy: 0.4567476522291245
Energy: 0.5037352408043146
Energy: 0.471349375410214
Energy: 0.45692941683354865
Energy: 0.5212613606849096
Energy: 0.471588672255248
Energy: 0.4713487795058104
Energy: 0.5213099254645605
Energy: 0.47196280221643727
Energy: 0.47127248028345486
Energy: 0.4702151205161276
Energy: 0.4715373529454695
Energy: 0.4714459093849894
Energy: 0.4386772117881806
Energy: 0.5698650673637522
Energy: 0.47152516624734
Energy: 0.5232028309484708
Energy: 0.47159396582056695
Energy: 0.4715146663283531
Energy: 0.5246718308824682
Energy: 0.4723036486944366
Energy: 0.4716289797336131
Energy: 0.5956760346627811
Energy: 0.4708133221061307
Energy: 0.5196332083080771
Energy: 0.5954382666312911
Energy: 0.47094420137523946
Energy: 0.5197323319966434
Energy: 0.5694291800847663
Energy: 0.478633687436775
Energy: 0.4714260460647279
Energy: 0.5258870072291664
Energy: 0.47849465142181513
Energy: 0.4715983958471105
Energy: 0.5286819793376668
Energy: 0.5280121799484497
Energy: 0.5191666685477592
Energy: 0.528236345572287
Energy: 0.5247825640984839
Energy: 0.5190478116280897

minimum gb energy = 0.3935142670422606 eV
minimum distance =  2.62462575668848 Angstroms
sigma value = 17


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

Energy: 0.708137866416523
Energy: 0.5782606128981032
Energy: 0.4446977816647195
Energy: 0.44107893277975224
Energy: 0.5785718357288399
Energy: 0.4411664174637878
Energy: 0.48749368483298444
Energy: 0.4676370040672272
Energy: 0.4663709919361076
Energy: 0.4669099576641807
Energy: 0.46714433032728536
Energy: 0.4664694496385439
Energy: 0.5487285758315326
Energy: 0.4276295944870991
Energy: 0.4227696139803505
Energy: 0.5495774892929607
Energy: 0.4276279192372772
Energy: 0.42283005331392065
Energy: 0.4681065780909999
Energy: 0.4228496370715359
Energy: 0.42304115578124085
Energy: 0.46837207182517715
Energy: 0.5143144504096212
Energy: 0.4228055483618093
Energy: 0.4702580483305952
Energy: 0.44908281712112724
Energy: 0.45087061340115436
Energy: 0.4702326371091635
Energy: 0.44891716255404857
Energy: 0.44829159511391187
Energy: 0.4228066596887202
Energy: 0.4028428728432876
Energy: 0.4287290077976862
Energy: 0.3802574761529769
Energy: 0.40271177677648445
Energy: 0.42631893337612276
Energy: 0.5043596628943025
Energy: 0.40256917389891045
Energy: 0.40255210830510196
Energy: 0.4876321053474466
Energy: 0.40368500177586475
Energy: 0.39597154183584476
Energy: 0.47401589068462024
Energy: 0.41490441477983336
Energy: 0.42258033730492656
Energy: 0.4650209322751374
Energy: 0.4501406251004721
Energy: 0.42281092611618665
Energy: 0.37645517526467737
Energy: 0.37492129140433955
Energy: 0.374802856399825
Energy: 0.3756990140480743
Energy: 0.48945300683598064
Energy: 0.3750398450203121
Energy: 0.3749732777429223
Energy: 0.4514858076338783
Energy: 0.45326649594977236
Energy: 0.3748752614384409
Energy: 0.45131260737533174
Energy: 0.45244249963998756
Energy: 0.3745867379341872
Energy: 0.3750047128049033
Energy: 0.4522603904096326
Energy: 0.45152351802684576
Energy: 0.37514183954096686
Energy: 0.4532455596215908
Energy: 0.4893971291416975
Energy: 0.3747816149189018
Energy: 0.37493273802461824
Energy: 0.4879269393653654
Energy: 0.37715701077989744
Energy: 0.37517479108861485
Energy: 0.4021689809423181
Energy: 0.46244045625647634
Energy: 0.4622380810619649
Energy: 0.45142862137265405
Energy: 0.46327721600354516
Energy: 0.4620051540488356
Energy: 0.4029472813657716
Energy: 0.4638382850137109
Energy: 0.43794381243291924
Energy: 0.4036010378862098
Energy: 0.4877569895932833
Energy: 0.40243508370074416
Energy: 0.40256252059468534
Energy: 0.42032007752262757
Energy: 0.4204991896058879
Energy: 0.40253314384803307
Energy: 0.37437069494006253
Energy: 0.4026222793657176
Energy: 0.49574617559680695
Energy: 0.4494652913159775
Energy: 0.4049304783983981
Energy: 0.4910701610497396
Energy: 0.47026775502196266
Energy: 0.4040747924095364
Energy: 0.44661114091922655
Energy: 0.46648178224201475
Energy: 0.4664696485609098
Energy: 0.5025984177866494
Energy: 0.4665536408362593
Energy: 0.40162285440189205
Energy: 0.408288125257658
Energy: 0.4663099517508336
Energy: 0.46642772299310836
Energy: 0.46855313787894476
Energy: 0.46634306843192286
Energy: 0.4493942788657845
Energy: 0.5111038541352256
Energy: 0.46620989775656735
Energy: 0.4485892832367282
Energy: 0.5120212128076098
Energy: 0.4900729301848197
Energy: 0.45025182644831213
Energy: 0.5977237732186619
Energy: 0.4476759092947872
Energy: 0.44766164455596574
Energy: 0.5975747204484743
Energy: 0.4478511687751273
Energy: 0.5094958916201333
Energy: 0.48796517448233734
Energy: 0.4661247042715861
Energy: 0.46623384443668164
Energy: 0.5138768468431877
Energy: 0.46839925985925784
Energy: 0.46689403349836756
Energy: 0.4400329395191408
Energy: 0.4685490066049351
Energy: 0.5080596591407499
Energy: 0.42226417010023143
Energy: 0.549801875379101
Energy: 0.4226048538358593
Energy: 0.47846655480263833
Energy: 0.46785848270906893
Energy: 0.46610632966468074
Energy: 0.47913706034115655
Energy: 0.5116077646833811
Energy: 0.507890188568237
Energy: 0.5481686830805649
Energy: 0.45658722291672194
Energy: 0.466841729173731
Energy: 0.5112212725339714
Energy: 0.5137239435983355
Energy: 0.466492515710448
Energy: 0.4667140453321159
Energy: 0.4271718707370312
Energy: 0.42297851132000897
Energy: 0.46674535678472656
Energy: 0.380319405927282
Energy: 0.4228894309679243
Energy: 0.4700511081714306
Energy: 0.4487256958966422
Energy: 0.4482870395167914
Energy: 0.47062090461292305
Energy: 0.45143135050686195
Energy: 0.448627313149563
Energy: 0.4227806697075072
Energy: 0.44911745209633164
Energy: 0.4483558693776663
Energy: 0.38018253404137314
Energy: 0.4915348648604641
Energy: 0.42897357174905987
Energy: 0.4588076836688772
Energy: 0.4025823081412766
Energy: 0.40270903945156816
Energy: 0.4586205681640485
Energy: 0.40327945598988185
Energy: 0.40274932542553865
Energy: 0.4319174958848111
Energy: 0.42093985449939214
Energy: 0.42168599166916587
Energy: 0.46395245924603684
Energy: 0.4023520881830528
Energy: 0.4221001502754113
Energy: 0.3749675967020442
Energy: 0.41566649928630217
Energy: 0.3750197911311395
Energy: 0.3750270944539646
Energy: 0.45054770971208247
Energy: 0.37711563937448234
Energy: 0.37736066365086085
Energy: 0.45509150316077684
Energy: 0.4525101101137204
Energy: 0.3777857817776054
Energy: 0.45133674124678275
Energy: 0.4171077547334521
Energy: 0.37712454908447796
Energy: 0.4561837704661003
Energy: 0.4547949162013882
Energy: 0.41742460531591025
Energy: 0.42913383886088696
Energy: 0.4556004233337177
Energy: 0.4873520577215125
Energy: 0.37743421992302206
Energy: 0.37483874621063873
Energy: 0.48828687561160417
Energy: 0.3765001776527827
Energy: 0.3749699648247485
Energy: 0.4028252351193474
Energy: 0.46268021364871464
Energy: 0.46559412969748804
Energy: 0.3745452115487298
Energy: 0.37430063616788234
Energy: 0.46122999259373815
Energy: 0.40244623384787087
Energy: 0.4657538158156291
Energy: 0.4657247349361872
Energy: 0.4023811978057981
Energy: 0.46399921790257037
Energy: 0.4663911197768974
Energy: 0.40245135160645534
Energy: 0.3755031834015349
Energy: 0.4019337825270275
Energy: 0.4024592501281538
Energy: 0.4578366666386561
Energy: 0.4025733884000435
Energy: 0.4960733444991919
Energy: 0.4034123185667644
Energy: 0.4027474257025194
Energy: 0.4916778826348799
Energy: 0.47030648046972434
Energy: 0.40267918575664824
Energy: 0.5057171964801987
Energy: 0.46634771157975896
Energy: 0.4664247609100104
Energy: 0.4603044381338256
Energy: 0.46818347763334695
Energy: 0.4664521020281703
Energy: 0.4653636684499347
Energy: 0.549810559608267
Energy: 0.44812553217685225
Energy: 0.4031758273884918
Energy: 0.5517383482745211
Energy: 0.44778582595541644
Energy: 0.5154629802567335
Energy: 0.46632922317616915
Energy: 0.4663375880667195
Energy: 0.5162516075007517
Energy: 0.46865236157304274
Energy: 0.4366267299917349
Energy: 0.5120808070423851
Energy: 0.4022117862401124
Energy: 0.46613577877632684
Energy: 0.5125036028059543
Energy: 0.40272000293678295
Energy: 0.4661846966846703
Energy: 0.54721422813173
Energy: 0.4389127785469629
Energy: 0.4660658148261317
Energy: 0.5111743504307844
Energy: 0.49355769425081925
Energy: 0.4662462048559082
Energy: 0.47892824435052683
Energy: 0.4675518858744537
Energy: 0.4661575394191827
Energy: 0.4781999325982686
Energy: 0.5123704296108548
Energy: 0.507816048121093

minimum gb energy = 0.37430063616788234 eV
minimum distance =  2.62202639355933 Angstroms
sigma value = 57


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

Energy: 0.45588650156254296
Energy: 0.5443032837777496
Energy: 0.43450182387828834
Energy: 0.46118031669322557
Energy: 0.5815679564142311
Energy: 0.43447792297780763
Energy: 0.46903203000200416
Energy: 0.45786384658189444
Energy: 0.4534965769790209
Energy: 0.4554073772544783
Energy: 0.4550286109816442
Energy: 0.43746685929041673
Energy: 0.5224830095231855
Energy: 0.38188611334385203
Energy: 0.3767843996904321
Energy: 0.5233920846849348
Energy: 0.3786961154301771
Energy: 0.4160060606351968
Energy: 0.4568764485992104
Energy: 0.38490265830896064
Energy: 0.4162235529834883
Energy: 0.45746543928801453
Energy: 0.4432654431622211
Energy: 0.4159306915696573
Energy: 0.4473569085411283
Energy: 0.4387295002024114
Energy: 0.3971459374190535
Energy: 0.4475507283274946
Energy: 0.43752685038054817
Energy: 0.39782489639604407
Energy: 0.3746250539995351
Energy: 0.3960911153446413
Energy: 0.4171163812694861
Energy: 0.39648513077790043
Energy: 0.3961417947999728
Energy: 0.3747684799240219
Energy: 0.48221067471919077
Energy: 0.39902357924499504
Energy: 0.3961262024965104
Energy: 0.46655449564610085
Energy: 0.39840736394777476
Energy: 0.3868744300130156
Energy: 0.4566518797281197
Energy: 0.43670171049115836
Energy: 0.4341418128062613
Energy: 0.44657481601871996
Energy: 0.429595933952919
Energy: 0.40900011120495655
Energy: 0.36602830278234344
Energy: 0.36475044031481824
Energy: 0.36470231352482746
Energy: 0.36689987142980107
Energy: 0.41771546976166446
Energy: 0.3644866637089849
Energy: 0.364684581481268
Energy: 0.4349168503722318
Energy: 0.4335777961186916
Energy: 0.364633430122552
Energy: 0.43567979761073666
Energy: 0.43816499602856107
Energy: 0.3534810915796827
Energy: 0.350637395992031
Energy: 0.3920869534281378
Energy: 0.42662875390366034
Energy: 0.35037864089656545
Energy: 0.391486351633076
Energy: 0.4546822166678405
Energy: 0.3546044824601473
Energy: 0.3504390565078925
Energy: 0.45538880324048886
Energy: 0.35520299225569996
Energy: 0.39377429267180764
Energy: 0.4017193218085939
Energy: 0.42867100239925915
Energy: 0.42774234281860823
Energy: 0.35237178614757264
Energy: 0.4314417675238979
Energy: 0.42748766981817515
Energy: 0.3506742009351133
Energy: 0.4296879992077912
Energy: 0.350202857157883
Energy: 0.3515518593262819
Energy: 0.45407833900102024
Energy: 0.35036000502216674
Energy: 0.35042291373318774
Energy: 0.3943522325991682
Energy: 0.3915438243390672
Energy: 0.3505035403162396
Energy: 0.39170739365450263
Energy: 0.3924563926762782
Energy: 0.4469882830495089
Energy: 0.3644718226799451
Energy: 0.4350849628054419
Energy: 0.4382723306430218
Energy: 0.37019064088655873
Energy: 0.4328383858751102
Energy: 0.415952958376859
Energy: 0.3700352880605746
Energy: 0.36450624839761003
Energy: 0.41577899720661815
Energy: 0.36805215369815303
Energy: 0.36559124988424113
Energy: 0.39578009737128833
Energy: 0.4447838776835713
Energy: 0.4101721183505798
Energy: 0.4229960060616734
Energy: 0.4453240715004632
Energy: 0.36523941221940187
Energy: 0.39594024698399494
Energy: 0.4468987733948652
Energy: 0.3959889407083026
Energy: 0.39702175203068363
Energy: 0.46675217793805973
Energy: 0.3958294140461359
Energy: 0.4799198691386479
Energy: 0.40749965764724105
Energy: 0.409213445780788
Energy: 0.4804582650571049
Energy: 0.36481920509754534
Energy: 0.43681213687780507
Energy: 0.48216230453279213
Energy: 0.4406360768967038
Energy: 0.43660196039561766
Energy: 0.4782294269837569
Energy: 0.43828271721421275
Energy: 0.40341397465639645
Energy: 0.43716402950311434
Energy: 0.45346909051258494
Energy: 0.39577912161418555
Energy: 0.4354998513035274
Energy: 0.4595190607956097
Energy: 0.3955959656627671
Energy: 0.4417315175065441
Energy: 0.4582359566380345
Energy: 0.45332305625677183
Energy: 0.4424951108532135
Energy: 0.45677239795738467
Energy: 0.45362908355067577
Energy: 0.49139137750952383
Energy: 0.436399703369704
Energy: 0.43789501188208213
Energy: 0.49224570539849344
Energy: 0.4724952572457814
Energy: 0.439734821817209
Energy: 0.5257807195783496
Energy: 0.39513474105406005
Energy: 0.4375990345083732
Energy: 0.5262489871705631
Energy: 0.3958232039395158
Energy: 0.4535423092062242
Energy: 0.47363496260293814
Energy: 0.4584411842876276
Energy: 0.45341633789470315
Energy: 0.4956310033159216
Energy: 0.4560678112175774
Energy: 0.45411931958831636
Energy: 0.41604536593371905
Energy: 0.4925396787633034
Energy: 0.41706640493865094
Energy: 0.4163080744667086
Energy: 0.5259699072814759
Energy: 0.41589222925487673

minimum gb energy = 0.350202857157883 eV
minimum distance =  2.64854587966386 Angstroms
sigma value = 43


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

Energy: 0.40766884660338104
Energy: 0.5136650304109214
Energy: 0.40049898464590394
Energy: 0.3988872788148679
Energy: 0.465030538326999
Energy: 0.36705525948904627
Energy: 0.4190248224402706
Energy: 0.4084036350055881
Energy: 0.3950675730070724
Energy: 0.40949472379869484
Energy: 0.4094996401084895
Energy: 0.39506363917105086
Energy: 0.46043874134713886
Energy: 0.3247922911914568
Energy: 0.3479624713439214
Energy: 0.46148351909268526
Energy: 0.32562458687647017
Energy: 0.3458986727070151
Energy: 0.3979526439903165
Energy: 0.3459849527302905
Energy: 0.346033337666754
Energy: 0.39501451772115914
Energy: 0.37611625089980494
Energy: 0.3797744941569803
Energy: 0.3988156096324526
Energy: 0.3648373284212475
Energy: 0.36372283745536743
Energy: 0.3987306383376044
Energy: 0.39585249666378336
Energy: 0.36366335291146656
Energy: 0.3249671215935828
Energy: 0.36325094191961516
Energy: 0.3460552696586678
Energy: 0.37791561659772716
Energy: 0.3632634445424649
Energy: 0.36020059038708196
Energy: 0.4284706909704235
Energy: 0.3632919892519093
Energy: 0.36325888945703355
Energy: 0.4158574045965484
Energy: 0.36603695787820856
Energy: 0.36350662219669194
Energy: 0.40931830839339267
Energy: 0.3780384640772359
Energy: 0.38392304747067063
Energy: 0.3356203597031749
Energy: 0.37508862364391926
Energy: 0.3249318830225818
Energy: 0.33681748550423113
Energy: 0.38378595058654347
Energy: 0.3355924509447707
Energy: 0.33753556716050404
Energy: 0.4032621570852194
Energy: 0.3358970385729961
Energy: 0.36145983930640935
Energy: 0.3874929836627685
Energy: 0.38365741560947964
Energy: 0.3356231465303842
Energy: 0.3567563945631307
Energy: 0.38467611171012905
Energy: 0.3115775069143648
Energy: 0.3183800028948167
Energy: 0.3188190822581443
Energy: 0.37256999379960953
Energy: 0.3185157600273332
Energy: 0.31302494837035366
Energy: 0.39961404219199115
Energy: 0.3185140777567787
Energy: 0.3182648511736521
Energy: 0.4005977200742024
Energy: 0.31846738421282916
Energy: 0.37930029760084677
Energy: 0.3922157445304909
Energy: 0.37285679231019864
Energy: 0.34624313384368555
Energy: 0.39323296698732874
Energy: 0.3703677380954914
Energy: 0.37984077451398035
Energy: 0.3082748402890544
Energy: 0.3906588415061397
Energy: 0.30757660351171257
Energy: 0.3091281999882599
Energy: 0.3931550420029601
Energy: 0.3077656891655907
Energy: 0.3073703775026155
Energy: 0.37573788251174467
Energy: 0.374991845118754
Energy: 0.3074213129971094
Energy: 0.37421824164242173
Energy: 0.37576833400816745
Energy: 0.38986786682815705
Energy: 0.3027339816800879
Energy: 0.3024990041032892
Energy: 0.36976564382535637
Energy: 0.30280758998552687
Energy: 0.3701805393195198
Energy: 0.3900570334597278
Energy: 0.30269999619993104
Energy: 0.30258037653718567
Energy: 0.3893953552537942
Energy: 0.30272851083154606
Energy: 0.3694124431280409
Energy: 0.3868312256802756
Energy: 0.37499427515778594
Energy: 0.373092172746473
Energy: 0.38771895813418483
Energy: 0.37259590715225743
Energy: 0.3729546418345515
Energy: 0.30268992307803977
Energy: 0.3897139760504325
Energy: 0.3028270559796192
Energy: 0.30380786124113157
Energy: 0.3913922449441446
Energy: 0.3026997983859412
Energy: 0.38768959498746075
Energy: 0.3730270371800873
Energy: 0.37391087537587053
Energy: 0.3886037546613369
Energy: 0.37350102594866563
Energy: 0.3753991470371986
Energy: 0.3953728945771878
Energy: 0.30786550098150806
Energy: 0.3077387618498328
Energy: 0.386575150559487
Energy: 0.30783136409178113
Energy: 0.3723608715509657
Energy: 0.39304151049433406
Energy: 0.3078371265036093
Energy: 0.307512110862954
Energy: 0.3727739648721117
Energy: 0.30795797659210045
Energy: 0.3714830065799089
Energy: 0.318031123065723
Energy: 0.3785943939239469
Energy: 0.37879671706024903
Energy: 0.3180185966501013
Energy: 0.37956775232423207
Energy: 0.3806095871049338
Energy: 0.3186502356269448
Energy: 0.3995049170492794
Energy: 0.31829304075951215
Energy: 0.3194693303316092
Energy: 0.39968947236554214
Energy: 0.31836910369637955
Energy: 0.39960716435268706
Energy: 0.3752555004970138
Energy: 0.3187218532665511
Energy: 0.4005918658377176
Energy: 0.3730244899511378
Energy: 0.3857228235442727
Energy: 0.41034158799229004
Energy: 0.3357934608191783
Energy: 0.3356123005348714
Energy: 0.40206520081679387
Energy: 0.3358691246341909
Energy: 0.39268172932024575
Energy: 0.31830674307484436
Energy: 0.3357234315288647
Energy: 0.3355705274042008
Energy: 0.3756048842643916
Energy: 0.3357764625284978
Energy: 0.31861611619057234
Energy: 0.3821526947231335
Energy: 0.33658755361820825
Energy: 0.36654236454998457
Energy: 0.3822834899067439
Energy: 0.3387419889686965
Energy: 0.3665129832097138
Energy: 0.36467203329853226
Energy: 0.3661945869716163
Energy: 0.36338136821885214
Energy: 0.3654668537494274
Energy: 0.4103622321232504
Energy: 0.3634005614397663
Energy: 0.42612122845031136
Energy: 0.3825290239934845
Energy: 0.336437660391628
Energy: 0.39285929757243376
Energy: 0.3793945839190897
Energy: 0.3359459591379048
Energy: 0.42527265087682053
Energy: 0.39612579819944876
Energy: 0.3951354075713697
Energy: 0.39690374423020036
Energy: 0.3636486719138874
Energy: 0.45538519335261735
Energy: 0.3361421346713543
Energy: 0.408421101591919
Energy: 0.36288165331801686
Energy: 0.3833789097471496
Energy: 0.40847905266215984
Energy: 0.3683076414845959
Energy: 0.3973701683256769
Energy: 0.40860303785330276
Energy: 0.4083122707817078
Energy: 0.3952767583055056
Energy: 0.41006527865958253
Energy: 0.40817333203172074
Energy: 0.42508901214137784
Energy: 0.364874012118616
Energy: 0.36304688698067683
Energy: 0.42557556227227017
Energy: 0.3930756792097725
Energy: 0.4081485459168822
Energy: 0.46052439176788645
Energy: 0.3356075181174174
Energy: 0.36313202896556307
Energy: 0.4613802885704498
Energy: 0.33668911148591646
Energy: 0.3632940532007586
Energy: 0.4357438544370878
Energy: 0.4083256693521699
Energy: 0.4081601785027648
Energy: 0.4368818668969993
Energy: 0.4094062970196303
Energy: 0.4086436905029714

minimum gb energy = 0.3024990041032892 eV
minimum distance =  2.61044462966614 Angstroms
sigma value = 81


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

Energy: 0.1725952028498503
Energy: 0.2602185171267325
Energy: 0.0752200405282224
Energy: 0.0763002809136682
Energy: 0.26078594637027497
Energy: 0.17262178968147995
Energy: 0.27616048541482086
Energy: 0.2604421181456019
Energy: 0.2603324131742717
Energy: 0.2968060079089895
Energy: 0.26079222578800176
Energy: 0.2557338832692751
Energy: 0.27428241163623396
Energy: 0.07511518607422192
Energy: 0.0752229987389293
Energy: 0.29720538155352483
Energy: 0.07513965941944149
Energy: 0.07522053932117508
Energy: 0.2732098371678825
Energy: 0.07516681547914518
Energy: 0.07537343627393778
Energy: 0.27719165004453744
Energy: 0.07514662173275677
Energy: 0.09647180587164308
Energy: 0.0960292986402853
Energy: 0.2931148297737142
Energy: 0.29311266252763324
Energy: 0.0967930491305004
Energy: 0.293084031709646
Energy: 0.2931941154920881
Energy: 0.07558676911490059
Energy: 0.2748464960360209
Energy: 0.07530284120027357
Energy: 0.07652980909792657
Energy: 0.2724862634848873
Energy: 0.07517662657419753
Energy: 0.2928658202937571
Energy: 0.2653522437211495
Energy: 0.2723006242455204
Energy: 0.2979618291878007
Energy: 0.27230666831329775
Energy: 0.272501467185224
Energy: 0.29232707008712067
Energy: 0.07517534645133832
Energy: 0.07518337186259884
Energy: 0.29833340821043464
Energy: 0.07510106607790602
Energy: 0.075404673908102
Energy: 0.2556204548366879
Energy: 0.07530668203918123
Energy: 0.09696785044370408
Energy: 0.27666490660572923
Energy: 0.0751723065771151
Energy: 0.09734112635363194
Energy: 0.17273307986306136
Energy: 0.2805134268381424
Energy: 0.28110714202756376
Energy: 0.07503232468402625
Energy: 0.28113197020558195
Energy: 0.2747602575070856

minimum gb energy = 0.07503232468402625 eV
minimum distance =  2.77491498826632 Angstroms
sigma value = 3


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

Energy: 0.4633008925636745
Energy: 0.47973485828921814
Energy: 0.4359504849523373
Energy: 0.4240017023787972
Energy: 0.47983784770241494
Energy: 0.3888464619464125
Energy: 0.456965640780809
Energy: 0.43615610293037377
Energy: 0.43588872782271026
Energy: 0.42849933563785114
Energy: 0.4362890592038401
Energy: 0.4281855744369638
Energy: 0.4171388809453816
Energy: 0.40488379292208987
Energy: 0.40492361360045875
Energy: 0.40459132226079064
Energy: 0.4049370420763665
Energy: 0.42436162327763927
Energy: 0.403812734936415
Energy: 0.4049771921794484
Energy: 0.4050327170176881
Energy: 0.4045957610972861
Energy: 0.3618128104002511
Energy: 0.4244382639989143
Energy: 0.36294333309915455
Energy: 0.43621430963250374
Energy: 0.42587023414037073
Energy: 0.36284067943637355
Energy: 0.4363633115037945
Energy: 0.42590523567929084
Energy: 0.40590678242899786
Energy: 0.4271125344509955
Energy: 0.40533764463482597
Energy: 0.4031074855051352
Energy: 0.4268025351858547
Energy: 0.40283492235129964
Energy: 0.40739903768034513
Energy: 0.39517825736455514
Energy: 0.39478538923355244
Energy: 0.4074549568933903
Energy: 0.3956109124069164
Energy: 0.3972981528653126
Energy: 0.40558331327454133
Energy: 0.3975047582646472
Energy: 0.39297945901346043
Energy: 0.40400756581298386
Energy: 0.3898795715668981
Energy: 0.3776513519899613
Energy: 0.4031821914733152
Energy: 0.39318040921876685
Energy: 0.40646304848225945
Energy: 0.4070566804718771
Energy: 0.3367118914828105
Energy: 0.4066636352137802
Energy: 0.37254805100176575
Energy: 0.36113979229966925
Energy: 0.3612028695510548
Energy: 0.3725925900730045
Energy: 0.36313196299230505
Energy: 0.3610879431225328
Energy: 0.38741023910059086
Energy: 0.3932499365656449
Energy: 0.3936450295311402
Energy: 0.38970659069344127
Energy: 0.3884541612603758
Energy: 0.39012647688027635
Energy: 0.33641999454004423
Energy: 0.3942651693645867
Energy: 0.398656793742703
Energy: 0.33558562897424427
Energy: 0.3916904887948582
Energy: 0.33623851381646974
Energy: 0.33532044177716397
Energy: 0.38094325911716187
Energy: 0.3894876941142099
Energy: 0.3352167691768625
Energy: 0.3808487301285544
Energy: 0.3356808922920858
Energy: 0.3818611875364947
Energy: 0.32044278118461395
Energy: 0.38293953527659047
Energy: 0.38284822424767734
Energy: 0.32103573124820567
Energy: 0.3829315337772769
Energy: 0.37962928792989914
Energy: 0.3205688740443484
Energy: 0.3204789282402409
Energy: 0.37822770310471104
Energy: 0.32167416677945193
Energy: 0.32044912424149863
Energy: 0.3777405383999903
Energy: 0.3832410755148387
Energy: 0.38260491919109574
Energy: 0.3811997448703305
Energy: 0.38709791689219203
Energy: 0.38162383759508123
Energy: 0.31324256847547466
Energy: 0.3779675030032696
Energy: 0.37930000695485727
Energy: 0.3132667930913098
Energy: 0.37814471763752294
Energy: 0.31325690729298034
Energy: 0.31324378151050924
Energy: 0.37687189339601024
Energy: 0.3775263419155518
Energy: 0.3132648769689319
Energy: 0.37675118206593244
Energy: 0.3773055714551528
Energy: 0.3928377262023965
Energy: 0.3838673832381856
Energy: 0.37745458587248154
Energy: 0.37675456143918745
Energy: 0.35426293423652233
Energy: 0.3774643139622548
Energy: 0.37350304908883736
Energy: 0.3133914205429769
Energy: 0.31338549412215666
Energy: 0.37439684417806257
Energy: 0.3135309228047214
Energy: 0.3132402834840088
Energy: 0.3736866704664503
Energy: 0.38150946977228034
Energy: 0.3829251097602999
Energy: 0.3741368440955232
Energy: 0.35227453825234784
Energy: 0.38141393790349937
Energy: 0.3212854474724905
Energy: 0.3814007346477254
Energy: 0.3530261612967953
Energy: 0.3219898065195081
Energy: 0.37775235462855355
Energy: 0.3203583496826459
Energy: 0.3207453554831562
Energy: 0.3826576269625368
Energy: 0.38289716106089344
Energy: 0.3207672230844872
Energy: 0.3832074872641479
Energy: 0.3822162309741764
Energy: 0.38158646750219394
Energy: 0.33539119798322736
Energy: 0.3683191094982486
Energy: 0.3840643121811536
Energy: 0.3352798331421015
Energy: 0.38408542733427287
Energy: 0.3880220790638982
Energy: 0.33551979376765045
Energy: 0.33547451322194205
Energy: 0.3890526249676345
Energy: 0.33563706248796743
Energy: 0.33526626878160093
Energy: 0.388618001325705
Energy: 0.39360270448357776
Energy: 0.38628924845674095
Energy: 0.3884630759947207
Energy: 0.3837082569713028
Energy: 0.39407482509825903
Energy: 0.3610076842760452
Energy: 0.38767160921361277
Energy: 0.36665198533338506
Energy: 0.36204822923266927
Energy: 0.3624275594896745
Energy: 0.3610214310278631
Energy: 0.3484122517879805
Energy: 0.4067056932388521
Energy: 0.4063883202016466
Energy: 0.3481202499464501
Energy: 0.40654090395044407
Energy: 0.4063491104471672
Energy: 0.39367864245053436
Energy: 0.4038420858166716
Energy: 0.3938432234348622
Energy: 0.3954409916980195
Energy: 0.4039508400874139
Energy: 0.36645767149203057
Energy: 0.3941554961222167
Energy: 0.3955432956807276
Energy: 0.39488556595650504
Energy: 0.394092211939255
Energy: 0.3980113436841837
Energy: 0.3998522246620533
Energy: 0.3962275695911981
Energy: 0.4090322895465487
Energy: 0.3995405177077129
Energy: 0.39646044685214304
Energy: 0.39544659072762234
Energy: 0.39348838833847277
Energy: 0.4647558582269691
Energy: 0.40396723334006573
Energy: 0.4104230523410663
Energy: 0.4358922413703564
Energy: 0.383507664060409
Energy: 0.4254056511707792
Energy: 0.3768949257510639
Energy: 0.4041989002683677
Energy: 0.40419123362672393
Energy: 0.37696348293285714
Energy: 0.4055288952897236
Energy: 0.4085567419477924

minimum gb energy = 0.3132402834840088 eV
minimum distance =  2.59693806208962 Angstroms
sigma value = 67


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

Energy: 0.4854222191099724
Energy: 0.5612117579912775
Energy: 0.4816905564169794
Energy: 0.4645134872131311
Energy: 0.56094860993086
Energy: 0.49674652761430566
Energy: 0.5182670311941254
Energy: 0.49126773622275044
Energy: 0.48667702866702656
Energy: 0.4976247927219283
Energy: 0.489357652947117
Energy: 0.4831812088265343
Energy: 0.5090277770251876
Energy: 0.4548237879258033
Energy: 0.47851271285550645
Energy: 0.48847073842891897
Energy: 0.45379821531015707
Energy: 0.47910299942607776
Energy: 0.43919846908140747
Energy: 0.4785584420622189
Energy: 0.4786492338590709
Energy: 0.44003620815623073
Energy: 0.44774145759519096
Energy: 0.47888342460631006
Energy: 0.43790320438621894
Energy: 0.4908788320501231
Energy: 0.4792759741671603
Energy: 0.43775731656874683
Energy: 0.488402596731995
Energy: 0.47891431342510504
Energy: 0.4483892254080178
Energy: 0.4813426669562933
Energy: 0.45736399695611535
Energy: 0.45787742807261855
Energy: 0.4808099618989637
Energy: 0.4542352406060765
Energy: 0.4402793198611406
Energy: 0.48193641093411654
Energy: 0.479139864019032
Energy: 0.44090492306379203
Energy: 0.48047373300092006
Energy: 0.43440997969453793
Energy: 0.4413668322672191
Energy: 0.448704139563794
Energy: 0.44955151166187635
Energy: 0.4420711741843438
Energy: 0.44864799721843124
Energy: 0.4332427024844868
Energy: 0.44868453703920647
Energy: 0.45396474946092275
Energy: 0.4542403292572903
Energy: 0.4556135680456043
Energy: 0.38926921711195234
Energy: 0.4550088285464724
Energy: 0.4509749705886206
Energy: 0.3918637157174948
Energy: 0.3889630519874027
Energy: 0.4518903525519038
Energy: 0.39134165841852053
Energy: 0.38903043139561316
Energy: 0.4490508044476478
Energy: 0.4507377628021026
Energy: 0.45197733651270633
Energy: 0.4487493561536273
Energy: 0.45213228028912233
Energy: 0.45073539877741564
Energy: 0.37153955432093094
Energy: 0.4431595531759888
Energy: 0.4435162875056059
Energy: 0.3678513961947287
Energy: 0.44474168075956627
Energy: 0.36771011643679447
Energy: 0.37083848556455984
Energy: 0.44130527575578354
Energy: 0.44076301149303737
Energy: 0.371304607563821
Energy: 0.4403491319404676
Energy: 0.36758742345151313
Energy: 0.4322188138899982
Energy: 0.41173697863927544
Energy: 0.440798975661639
Energy: 0.44029464761432235
Energy: 0.4066027105135977
Energy: 0.44034059298674494
Energy: 0.4324991328816127
Energy: 0.37019266834071674
Energy: 0.3675658599268298
Energy: 0.43333803944242844
Energy: 0.36958120969966635
Energy: 0.3676478847497294
Energy: 0.4336030890665615
Energy: 0.4450743000310356
Energy: 0.44831522898967185
Energy: 0.44579888903890535
Energy: 0.3684258270592509
Energy: 0.4479909025490232
Energy: 0.39105161867415195
Energy: 0.44470640265592826
Energy: 0.44186896816428356
Energy: 0.39043810157156045
Energy: 0.44079375101957863
Energy: 0.3893557747063133
Energy: 0.3910259730759823
Energy: 0.4608717030648215
Energy: 0.4641373593052156
Energy: 0.39081766798002254
Energy: 0.45378023673949497
Energy: 0.43615428215745883
Energy: 0.43652216031265434
Energy: 0.46118084293962097
Energy: 0.43118681179242213
Energy: 0.4539039478712191
Energy: 0.4750932029302925
Energy: 0.4534373210792377
Energy: 0.43783790737339584
Energy: 0.4396422655528568
Energy: 0.4333076145599908
Energy: 0.43608379033977296
Energy: 0.4416691428594682
Energy: 0.4333396339877804
Energy: 0.43402285492595216
Energy: 0.4576482240847706
Energy: 0.4576213745777463
Energy: 0.4341495994387659
Energy: 0.4209594627818879
Energy: 0.45807980153558553
Energy: 0.508587542120997
Energy: 0.45352088573962124
Energy: 0.4576060879897497
Energy: 0.48834673649314
Energy: 0.4652556628990794
Energy: 0.457864578527886
Energy: 0.470220324623714
Energy: 0.49121740673037606
Energy: 0.4868240774017338
Energy: 0.4702948676164312
Energy: 0.48937635391153345
Energy: 0.47908554091964684

minimum gb energy = 0.3675658599268298 eV
minimum distance =  2.62677017422957 Angstroms
sigma value = 33


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

Energy: 0.6681372502531568
Energy: 0.5192533532753983
Energy: 0.5521829284828856
Energy: 0.5163522710889338
Energy: 0.5189644112765728
Energy: 0.5146730044026674
Energy: 0.5386661136920745
Energy: 0.5033184237591173
Energy: 0.5021804573671174
Energy: 0.5075906359008412
Energy: 0.5071991965629316
Energy: 0.5022518914024134
Energy: 0.5425321218377891
Energy: 0.5011585213183432
Energy: 0.5010783257553659
Energy: 0.5070842278450378
Energy: 0.5095959217579282
Energy: 0.504514769670747
Energy: 0.505443097840679
Energy: 0.5013072401138332
Energy: 0.5097439976433634
Energy: 0.5060099263780566
Energy: 0.44591611529518543
Energy: 0.5094702478929342
Energy: 0.44434260957961386
Energy: 0.5056777861083455
Energy: 0.5057359067655407
Energy: 0.44437099935542257
Energy: 0.5068709675692523
Energy: 0.5080790273172111
Energy: 0.5032647694087916
Energy: 0.5152475238215629
Energy: 0.5022558530070054
Energy: 0.4852415873947666
Energy: 0.5161115973389864
Energy: 0.47857176154748277
Energy: 0.44415536318415944
Energy: 0.5005354834494432
Energy: 0.5008660883241023
Energy: 0.44420761479714665
Energy: 0.5020195031808686
Energy: 0.4443248987042141
Energy: 0.44754445185615843
Energy: 0.4856988577280249
Energy: 0.45390509285159714
Energy: 0.448115766843824
Energy: 0.4860154084149698
Energy: 0.4466565062713629
Energy: 0.46762165622243573
Energy: 0.4836197172339134
Energy: 0.48590060907740606
Energy: 0.4765472738039068
Energy: 0.40079498331776087
Energy: 0.486028622338881
Energy: 0.4666956906161045
Energy: 0.40043059341884524
Energy: 0.40040261892975315
Energy: 0.4676089487113972
Energy: 0.40109631385367644
Energy: 0.40052488904895756
Energy: 0.46732824848861954
Energy: 0.445164729069264
Energy: 0.4760974128793323
Energy: 0.47465053935465695
Energy: 0.40034586777313597
Energy: 0.4750562357007569
Energy: 0.4001975713018187
Energy: 0.47631162944048805
Energy: 0.47420645422534446
Energy: 0.4002689915342872
Energy: 0.47207160194006675
Energy: 0.4002791168132687
Energy: 0.4002390773737868
Energy: 0.4808039689239789
Energy: 0.4806880234182946
Energy: 0.40033017965701295
Energy: 0.47604865356221165
Energy: 0.4005208911991665
Energy: 0.47347133994791185
Energy: 0.45442906562539087
Energy: 0.48501643730699473
Energy: 0.4734821503160715
Energy: 0.4884470773260665
Energy: 0.477722493518401
Energy: 0.4359264194269767
Energy: 0.44743591755736517
Energy: 0.4470507631126633
Energy: 0.43564263546906845
Energy: 0.44842051180369286
Energy: 0.4537303083268996
Energy: 0.5002139608745514
Energy: 0.4760812916440566
Energy: 0.4757786646239831
Energy: 0.5011450421730148
Energy: 0.4099039793558593
Energy: 0.5009867378406561
Energy: 0.5435624416912225
Energy: 0.47819680315826335
Energy: 0.47658974945355737
Energy: 0.544270796317874
Energy: 0.49505703760388525
Energy: 0.49003333397467747
Energy: 0.5385008251059157
Energy: 0.5020989543806854
Energy: 0.5023798003694334
Energy: 0.5035336833510464
Energy: 0.5054955088706724
Energy: 0.5006671829732406
Energy: 0.5311545000695927
Energy: 0.5053000600254012
Energy: 0.5239374497563118
Energy: 0.479107136572675
Energy: 0.505862668369471
Energy: 0.4754490406835045
Energy: 0.47684627217716063
Energy: 0.5055884562633242
Energy: 0.5056569515932038
Energy: 0.4772996678813863
Energy: 0.5071175481244038
Energy: 0.5060094325565981
Energy: 0.5345929365631074
Energy: 0.5015677624395427
Energy: 0.5011180761147649
Energy: 0.5066772790696056
Energy: 0.4923931090557509
Energy: 0.5045967302812078
Energy: 0.5066572060675191
Energy: 0.5011086141431238
Energy: 0.5100133757658961
Energy: 0.5071021387645434
Energy: 0.5003649316632275
Energy: 0.5098369453659172
Energy: 0.4446204515396135
Energy: 0.5030937400867448
Energy: 0.5021814153313753
Energy: 0.444353232444983
Energy: 0.507477186293519
Energy: 0.5082047821535419
Energy: 0.5030307326731668
Energy: 0.5154721135676633
Energy: 0.5026240098303644
Energy: 0.4856971749511821
Energy: 0.5155027587536759
Energy: 0.48506640225774833
Energy: 0.44403345308953196
Energy: 0.5097620405367197
Energy: 0.5077236122623343
Energy: 0.44410183798580416
Energy: 0.5040709219538456
Energy: 0.5090337158369717
Energy: 0.4476418413877285
Energy: 0.485878272219744
Energy: 0.4546274704467879
Energy: 0.44720518546152965
Energy: 0.4858976751763063
Energy: 0.4464901319565872
Energy: 0.47608118596334575
Energy: 0.48596320921849623
Energy: 0.486385678830956
Energy: 0.4685973034008762
Energy: 0.40092552530720493
Energy: 0.48713037565760914
Energy: 0.4666138672536146
Energy: 0.4005369746305439
Energy: 0.4005078293745502
Energy: 0.46767891752702473
Energy: 0.4019042698053378
Energy: 0.40046924663253064
Energy: 0.46699545950377536
Energy: 0.40157287967667776
Energy: 0.47749960539996805
Energy: 0.4745197893760989
Energy: 0.4007024480585137
Energy: 0.47613179610930495
Energy: 0.3999548441749193
Energy: 0.4746507929838572
Energy: 0.4759293713106974
Energy: 0.399999910839723
Energy: 0.47359219908014316
Energy: 0.3999716074328279
Energy: 0.40027590617005004
Energy: 0.47754337508407463
Energy: 0.44476972541030363
Energy: 0.4003161133874613
Energy: 0.4758363626280422
Energy: 0.39988153109886637
Energy: 0.47341419826276476
Energy: 0.4901630015650452
Energy: 0.49026252486290806
Energy: 0.47427742059850464
Energy: 0.48871791373052287
Energy: 0.4771724281391514
Energy: 0.43556986280682247
Energy: 0.44738929121566257
Energy: 0.4463948944433463
Energy: 0.43571602681076843
Energy: 0.4476536521763606
Energy: 0.4539420102335038
Energy: 0.5001122551824875
Energy: 0.4598694594679765
Energy: 0.5074436796596743
Energy: 0.5057612281618002
Energy: 0.40982536758113186
Energy: 0.5103934467426441
Energy: 0.5450057817546725
Energy: 0.4947554956449759
Energy: 0.4942416573161116
Energy: 0.5421257954360241
Energy: 0.47353266017333406
Energy: 0.49006888249978253
Energy: 0.5428529854096413
Energy: 0.5023791149159689
Energy: 0.5026706896986838
Energy: 0.5058843530506196
Energy: 0.5080684792396641
Energy: 0.5027673481993528
Energy: 0.5308626431884851
Energy: 0.5054044808523064
Energy: 0.5236604740208501
Energy: 0.4800359879078858
Energy: 0.5055596108256194
Energy: 0.48992016196230326

minimum gb energy = 0.39988153109886637 eV
minimum distance =  2.58384043753505 Angstroms
sigma value = 41


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

Energy: 0.6010467955005717
Energy: 0.5289316979223931
Energy: 0.5754889318863835
Energy: 0.5309684517552855
Energy: 0.5291758122691376
Energy: 0.5749974171171134
Energy: 0.5601670573959479
Energy: 0.5167092203036083
Energy: 0.5150518052690831
Energy: 0.5149494234197708
Energy: 0.51600215128653
Energy: 0.514488498310959
Energy: 0.5569550129662986
Energy: 0.529203402537317
Energy: 0.52975347763759
Energy: 0.5576528091025843
Energy: 0.5276639188384222
Energy: 0.5140392145159656
Energy: 0.5168938589889378
Energy: 0.5286569019658962
Energy: 0.5291928988600357
Energy: 0.517473450747777
Energy: 0.46287274238106274
Energy: 0.5151533218708839
Energy: 0.45845670886632084
Energy: 0.5167764131638697
Energy: 0.515342135680006
Energy: 0.458547239954089
Energy: 0.5163789995796797
Energy: 0.5152828103371803
Energy: 0.511775486817805
Energy: 0.5315801570271393
Energy: 0.5315055608445384
Energy: 0.5090644868098143
Energy: 0.5324633153099243
Energy: 0.5316753977978501
Energy: 0.459529626669636
Energy: 0.5265657456319865
Energy: 0.5240387674566943
Energy: 0.45960193593673776
Energy: 0.5260794095240352
Energy: 0.45867893743115673
Energy: 0.4596298038124008
Energy: 0.5229649607806917
Energy: 0.47786529428441443
Energy: 0.46030567719168836
Energy: 0.5211187406268654
Energy: 0.4596275357137135
Energy: 0.49007594443201075
Energy: 0.5205294884747217
Energy: 0.5205226722105749
Energy: 0.4907692422331454
Energy: 0.4748247348854827
Energy: 0.520792375477744
Energy: 0.4685589123464923
Energy: 0.4620403324756922
Energy: 0.458973835852399
Energy: 0.46837657221809026
Energy: 0.4594077827451531
Energy: 0.45924324638631264
Energy: 0.5157740291585775
Energy: 0.4587375345128495
Energy: 0.5254213726655519
Energy: 0.5165038026613847
Energy: 0.4308964383574456
Energy: 0.5272202612779306
Energy: 0.5592610314076826
Energy: 0.5192784525342737
Energy: 0.5190286397562801
Energy: 0.5598173880960541
Energy: 0.5195625810361173
Energy: 0.504677329803841
Energy: 0.5629996882188447
Energy: 0.5140110330346375
Energy: 0.5148952158541527
Energy: 0.5162752571677585
Energy: 0.5167050038535387
Energy: 0.5146432067442144
Energy: 0.5313607182802994
Energy: 0.5155665686508133
Energy: 0.5353930383217187
Energy: 0.518283264786348
Energy: 0.5162773571976795
Energy: 0.5343567386931678

minimum gb energy = 0.4308964383574456 eV
minimum distance =  2.65002176422217 Angstroms
sigma value = 11


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

Energy: 0.7393736524524311
Energy: 0.5780494902257095
Energy: 0.6496409807994309
Energy: 0.6000553911347362
Energy: 0.5779630272089337
Energy: 0.5988053318102381
Energy: 0.6256140067470917
Energy: 0.5061003034111087
Energy: 0.5060320550162165
Energy: 0.5260080385508729
Energy: 0.5061174414452799
Energy: 0.5064349532522363
Energy: 0.5992612730933566
Energy: 0.532175953785965
Energy: 0.5218197038070387
Energy: 0.5999610487164514
Energy: 0.5491755872287334
Energy: 0.5229269880446473
Energy: 0.5222792635351525
Energy: 0.5521484804946736
Energy: 0.5367616677613245
Energy: 0.5224400070612368
Energy: 0.498841935892241
Energy: 0.5236199245729751
Energy: 0.5244106257460269
Energy: 0.5061831024556985
Energy: 0.505981085847856
Energy: 0.5243644369623502
Energy: 0.5111624196291594
Energy: 0.5062457333748636
Energy: 0.5246585922818452
Energy: 0.5115936293947302
Energy: 0.5114895583419224
Energy: 0.5556730967233837
Energy: 0.5112672354011032
Energy: 0.5560802431887854
Energy: 0.5111612031269351
Energy: 0.5565371225321853
Energy: 0.5568149060354336
Energy: 0.5111838208676094
Energy: 0.5503769280983699
Energy: 0.5113444456240014
Energy: 0.511387714194532
Energy: 0.5250133695350312
Energy: 0.5386902727069888
Energy: 0.5068340821243188
Energy: 0.5245748256271643
Energy: 0.5060565129826027
Energy: 0.5086899667289104
Energy: 0.5223950865543343
Energy: 0.5233464951507462
Energy: 0.5159438806467559
Energy: 0.525979126832365
Energy: 0.5231179441219409
Energy: 0.5088761486564529
Energy: 0.5542046238075723
Energy: 0.5194753346147809
Energy: 0.5403425639392959
Energy: 0.5995298581241965
Energy: 0.528295217780245
Energy: 0.5426235087946254
Energy: 0.5162507156334261
Energy: 0.5393216952724355
Energy: 0.5423966894653948
Energy: 0.5158975457904038
Energy: 0.506165404044533
Energy: 0.5355727219069238
Energy: 0.5213876955393737
Energy: 0.524661522801492
Energy: 0.5359077665380753
Energy: 0.5216071799416013
Energy: 0.5215241352814816
Energy: 0.5353828542259741
Energy: 0.5224640139088479
Energy: 0.5247176106558065
Energy: 0.5359365818146296
Energy: 0.5252594559878053
Energy: 0.5060272493474035
Energy: 0.515885555544182
Energy: 0.5991460450152126
Energy: 0.525204377074043
Energy: 0.5308187136604747
Energy: 0.6005342826295841
Energy: 0.5231648059606311
Energy: 0.4993438600162127
Energy: 0.5306098555115677
Energy: 0.5328170032354304
Energy: 0.49939588304247734
Energy: 0.5303815089678029
Energy: 0.5337453982227667
Energy: 0.49987474769491624
Energy: 0.5446360135366227
Energy: 0.5000260376144999
Energy: 0.5006176533476416
Energy: 0.5304900481341419
Energy: 0.49944827756538474
Energy: 0.49906761767259844
Energy: 0.5417709811211409
Energy: 0.544644577409632
Energy: 0.49905394979415263
Energy: 0.5422021665525874
Energy: 0.5441754252991393
Energy: 0.5928640894070095
Energy: 0.5458321383344354
Energy: 0.5408933730819383
Energy: 0.5636091171546875
Energy: 0.5456696311479678
Energy: 0.5172473582232543
Energy: 0.5168279251028515
Energy: 0.5123007073938004
Energy: 0.5128381903281728
Energy: 0.5168481300403139
Energy: 0.5130762285326901
Energy: 0.516759113038057
Energy: 0.5271694519429388
Energy: 0.5263189656015642
Energy: 0.5253938660639883
Energy: 0.5279372776810025
Energy: 0.5416363713627748
Energy: 0.5180452764891933
Energy: 0.5464189369657644
Energy: 0.5300552127520658
Energy: 0.5138689286883523
Energy: 0.5462435718627788
Energy: 0.5264570195886201
Energy: 0.5124137280364953
Energy: 0.5102160745731191
Energy: 0.5125137876633881
Energy: 0.5124883801910438
Energy: 0.5051031242319974
Energy: 0.5391721692337852
Energy: 0.5124334567925211
Energy: 0.5333682992372845
Energy: 0.5411789416188482
Energy: 0.5255765352264326
Energy: 0.5519203373010894
Energy: 0.5420027373287388
Energy: 0.526554097935893
Energy: 0.5560850002411822
Energy: 0.5164709604866214
Energy: 0.5167230106455676
Energy: 0.5177626945557372
Energy: 0.5165908766133411
Energy: 0.5164459676786114
Energy: 0.5468990865548174
Energy: 0.5278600068103383
Energy: 0.5266738740249819
Energy: 0.5470532820175591
Energy: 0.5546730205648557
Energy: 0.5266137102401305
Energy: 0.5281455554366589
Energy: 0.4993972028195837
Energy: 0.5445299603033033
Energy: 0.5375681497343074
Energy: 0.49928355183691514
Energy: 0.5450939250401261
Energy: 0.5239826950170516
Energy: 0.49967283070269436
Energy: 0.4996231396471517
Energy: 0.5247104475336306
Energy: 0.5009678704331414
Energy: 0.4992252801838678
Energy: 0.5266221961622518
Energy: 0.4998108476021811
Energy: 0.5329350469139422
Energy: 0.5266052071258297
Energy: 0.49924879237592756
Energy: 0.5354378569824818
Energy: 0.5990441867379506
Energy: 0.5157195523097934
Energy: 0.5147080344829138
Energy: 0.5999744583870505
Energy: 0.5084073455874507
Energy: 0.5144864802606306
Energy: 0.6240657644960363
Energy: 0.5060263654991503
Energy: 0.5065582809739901
Energy: 0.5270390156318546
Energy: 0.5058521882264644
Energy: 0.5244673898112996
Energy: 0.7381428846979193
Energy: 0.5673816002358121
Energy: 0.5220275260952356
Energy: 0.5240054720689813
Energy: 0.5677080614818066
Energy: 0.5219327803654904

minimum gb energy = 0.498841935892241 eV
minimum distance =  2.55827408537064 Angstroms
sigma value = 57


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

Energy: 0.6568014445225472
Energy: 0.6913562302502686
Energy: 0.558112547784016
Energy: 0.5950896139764327
Energy: 0.6953088886433308
Energy: 0.5947758696650881
Energy: 0.5736507474743555
Energy: 0.5018021937426151
Energy: 0.5017190873154128
Energy: 0.501625080665391
Energy: 0.501018113845919
Energy: 0.5098214388805381
Energy: 0.5383891041113881
Energy: 0.5314499040951128
Energy: 0.5311896077152997
Energy: 0.5387874554414102
Energy: 0.5306776486464588
Energy: 0.5253902609986167
Energy: 0.5257179239286787
Energy: 0.49720835137651453
Energy: 0.4989743950969797
Energy: 0.5264904645542804
Energy: 0.5000564216642632
Energy: 0.49786852354769506
Energy: 0.5791306663056619
Energy: 0.4954441915212855
Energy: 0.4983465974658372
Energy: 0.49802722440708774
Energy: 0.5328790199561776
Energy: 0.49952382807610785
Energy: 0.5790615506648108
Energy: 0.5310790947916441
Energy: 0.531519800902733
Energy: 0.5381177184370419
Energy: 0.5331369151958018
Energy: 0.5383792625580073
Energy: 0.5316322526079662
Energy: 0.4921916995886262
Energy: 0.49225248306782327
Energy: 0.5324334120832638
Energy: 0.4940218800304537
Energy: 0.5397367129703237
Energy: 0.531031786177425
Energy: 0.5094931548315265
Energy: 0.4982290440919745
Energy: 0.4981954152355055
Energy: 0.5029681881170867
Energy: 0.5131979627985074
Energy: 0.6588729092125445
Energy: 0.5254133875334557
Energy: 0.5506922269005655
Energy: 0.488672346539514
Energy: 0.5259732768674249
Energy: 0.5511303357112325
Energy: 0.6591737148381726
Energy: 0.5261504383713631
Energy: 0.5507717206314316
Energy: 0.487805760504721
Energy: 0.5416671144280854
Energy: 0.5235691664274963
Energy: 0.5318842697883992
Energy: 0.4985510111524779
Energy: 0.49779708617129365
Energy: 0.49829696441872245
Energy: 0.5016527993612387
Energy: 0.5106952559474971
Energy: 0.5264304361740022
Energy: 0.5302946132374101
Energy: 0.5352817222542879
Energy: 0.5266013586638185
Energy: 0.5311857547040543
Energy: 0.5255461168417166
Energy: 0.5028130449552837
Energy: 0.5013085458510117
Energy: 0.5009267260906455
Energy: 0.5036374613513469
Energy: 0.5024633509444987
Energy: 0.5105163431288005
Energy: 0.5796242861965332
Energy: 0.5321390115751773
Energy: 0.5266666465674442
Energy: 0.5382267017241055
Energy: 0.5324276513165057
Energy: 0.5257477733261332
Energy: 0.5307644733102354
Energy: 0.48720655035614296
Energy: 0.49546573959797163
Energy: 0.5308147018000682
Energy: 0.48800432312936826
Energy: 0.5081016811242134
Energy: 0.5385915981320596
Energy: 0.48849927460451076
Energy: 0.48958665627244247
Energy: 0.5391823199360561
Energy: 0.49044020579555564
Energy: 0.5254602400453522
Energy: 0.4956927998068909
Energy: 0.5014691780094317
Energy: 0.5010386128521821
Energy: 0.49577103347902074
Energy: 0.5005493363914683
Energy: 0.5102522155703044

minimum gb energy = 0.48720655035614296 eV
minimum distance =  2.6254020491744 Angstroms
sigma value = 9


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

Energy: 0.7577967435747117
Energy: 0.6019564713524777
Energy: 0.6572252921555632
Energy: 0.6563002371787099
Energy: 0.6017910531776565
Energy: 0.6525545733905576
Energy: 0.5850980106459021
Energy: 0.5434072585775735
Energy: 0.5476585823116393
Energy: 0.5287488309275145
Energy: 0.5450367980665309
Energy: 0.5556967254239302
Energy: 0.6079848265285801
Energy: 0.5648056569224149
Energy: 0.5814273324508584
Energy: 0.6086252382585529
Energy: 0.5637816271212629
Energy: 0.5581286169201137
Energy: 0.5602290992627215
Energy: 0.5651533090812478
Energy: 0.5656122046007617
Energy: 0.573586634268536
Energy: 0.5276139517967282
Energy: 0.5650693984472918
Energy: 0.524223613159235
Energy: 0.5467679358154355
Energy: 0.5321121817514963
Energy: 0.523561322621842
Energy: 0.5496976509135965
Energy: 0.5523325178130398
Energy: 0.5343356161731448
Energy: 0.5304572837774937
Energy: 0.5491373176953009
Energy: 0.5351365463811966
Energy: 0.5316982996561117
Energy: 0.549234879706503
Energy: 0.5369166703703752
Energy: 0.5960994803645978
Energy: 0.5398380545026642
Energy: 0.5374480473035556
Energy: 0.598545398198088
Energy: 0.5403909299704197
Energy: 0.5489598713455462
Energy: 0.5389052060116629
Energy: 0.556188858606272
Energy: 0.548913739360423
Energy: 0.5400383992036366
Energy: 0.556698809288382
Energy: 0.6006260339304847
Energy: 0.5427787858614344
Energy: 0.5364315369628639
Energy: 0.5653257361338823
Energy: 0.5731187585633709
Energy: 0.5714213763072228
Energy: 0.6010112461566562
Energy: 0.5366845345268457
Energy: 0.5363894239845419
Energy: 0.5651917086222692
Energy: 0.5378648706840546
Energy: 0.5561477872628532
Energy: 0.5491773149889928
Energy: 0.5455732526235563
Energy: 0.5509560487464619
Energy: 0.5492277558915885
Energy: 0.5222960100108843
Energy: 0.5578336086965289
Energy: 0.5494573357684387
Energy: 0.5386436943315924
Energy: 0.5414955702216708
Energy: 0.5494201852234191
Energy: 0.5330699552798043
Energy: 0.5418784560103448
Energy: 0.6076272191440527
Energy: 0.5627162708034703
Energy: 0.5596680442209018
Energy: 0.6009718440308938
Energy: 0.5616332473435642
Energy: 0.6003154582673785
Energy: 0.6118892840773641
Energy: 0.5595834637871051
Energy: 0.5604692047354847
Energy: 0.5961525227752943
Energy: 0.5669154604001942
Energy: 0.5831371927871841
Energy: 0.5796690530049672
Energy: 0.5224152647167598
Energy: 0.5495428021620036
Energy: 0.5806774005252564
Energy: 0.5219888273370061
Energy: 0.5665030673185116
Energy: 0.5743692631328323
Energy: 0.5806032838667877
Energy: 0.5361085236519452
Energy: 0.5749235337773406
Energy: 0.5649208714817728
Energy: 0.5385611961939162
Energy: 0.5697746696550113
Energy: 0.5613136482814339
Energy: 0.527861440434895
Energy: 0.528322735887179
Energy: 0.5637604074085613
Energy: 0.5640245414982153
Energy: 0.5673018334702158
Energy: 0.5701956070783657
Energy: 0.5797510069759981
Energy: 0.5646120484472202
Energy: 0.567422937223902
Energy: 0.5685554576562616
Energy: 0.5674400779936075
Energy: 0.5274667580775305
Energy: 0.5278811767327778
Energy: 0.5675995778485298
Energy: 0.5303439990433388
Energy: 0.5739658865480947
Energy: 0.5672255253376042
Energy: 0.5282174566170543
Energy: 0.5281801333557764
Energy: 0.56725090996209
Energy: 0.529199548802856
Energy: 0.5589688611799353
Energy: 0.5925021337130093
Energy: 0.5453973217327341
Energy: 0.5337165705997906
Energy: 0.5386198422539366
Energy: 0.5453611282114945
Energy: 0.5428097738043103

minimum gb energy = 0.5219888273370061 eV
minimum distance =  2.53593592376794 Angstroms
sigma value = 27


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

Energy: 0.643235672219648
Energy: 0.6956947393582773
Energy: 0.580300262840204
Energy: 0.6016295970391098
Energy: 0.7027133272814832
Energy: 0.610371145989322
Energy: 0.5919167850026673
Energy: 0.5632258786311705
Energy: 0.5151250171132696
Energy: 0.5889016736682313
Energy: 0.6102127039157401
Energy: 0.5155860287221699
Energy: 0.6516170556894061
Energy: 0.5874705959524197
Energy: 0.5451714982118722
Energy: 0.5690052727940657
Energy: 0.5093548045687766
Energy: 0.6082070048016724
Energy: 0.5984842056718829
Energy: 0.5892548774536983
Energy: 0.5563326276857239
Energy: 0.6029856338497938
Energy: 0.5396743538894948
Energy: 0.5570122298989738
Energy: 0.5114600821023353
Energy: 0.5900129500115877
Energy: 0.5792612718591137
Energy: 0.5121168419695264
Energy: 0.583344345605015
Energy: 0.5451072848721649
Energy: 0.5916506423178595
Energy: 0.5659889673124869
Energy: 0.5372282231017015
Energy: 0.5368260184759427
Energy: 0.5835540523937407
Energy: 0.5369133268910067
Energy: 0.6036427499523765
Energy: 0.5721146327917958
Energy: 0.56522483052372
Energy: 0.5428704328209082
Energy: 0.5740366741484507
Energy: 0.5662847004365364
Energy: 0.606205842787959
Energy: 0.5412980115064513
Energy: 0.5700098847278442
Energy: 0.6122351266899858
Energy: 0.5357714791909626
Energy: 0.5667599614299482
Energy: 0.660050861249533
Energy: 0.5528937752311558
Energy: 0.55118524196589
Energy: 0.5375810086343704
Energy: 0.5694738317742687
Energy: 0.5492478064752178
Energy: 0.6584116617244864
Energy: 0.5396712244707753
Energy: 0.5398644922346649
Energy: 0.5375739425923953
Energy: 0.539673522369177
Energy: 0.5528748616614294
Energy: 0.5518584055635523
Energy: 0.4914984235794771
Energy: 0.5215800757475376
Energy: 0.551889881751404
Energy: 0.5072733719949901
Energy: 0.5132340831524808
Energy: 0.5518609611288553
Energy: 0.5132017471731359
Energy: 0.5133915800206962
Energy: 0.5518025072522543
Energy: 0.513123178597487
Energy: 0.5140112488094757
Energy: 0.555023096801091
Energy: 0.5573801523934638
Energy: 0.5511761434348962
Energy: 0.5564022782441631
Energy: 0.5580892979611987
Energy: 0.552010383565949
Energy: 0.5522937488360413
Energy: 0.5514798642039762
Energy: 0.5519390376116555
Energy: 0.5523380931811496
Energy: 0.5572670926314433
Energy: 0.5525147243648694
Energy: 0.5347403583773273
Energy: 0.5135219259464883
Energy: 0.5136379481639172
Energy: 0.5354480966576235
Energy: 0.5147860553059348
Energy: 0.5248809867682807
Energy: 0.575064875898855
Energy: 0.5325813602043926
Energy: 0.5520983014623428
Energy: 0.5536117450178513
Energy: 0.5234029311909726
Energy: 0.5608407698446842
Energy: 0.5152233826150135
Energy: 0.5684475462858724
Energy: 0.5667812967352422
Energy: 0.5157824658907352
Energy: 0.592795336915237
Energy: 0.5519727676536238
Energy: 0.5631687140852527
Energy: 0.5692630436070715
Energy: 0.5362817490164072
Energy: 0.5377317172373163
Energy: 0.5851588291524911
Energy: 0.5364536348578065
Energy: 0.610398681030199
Energy: 0.5755126757663113
Energy: 0.5752786581970697
Energy: 0.6121730845752013
Energy: 0.5755075822303861
Energy: 0.5680989037388117
Energy: 0.6037620963726621
Energy: 0.5759101183294147
Energy: 0.57550207122385
Energy: 0.5419878280657072
Energy: 0.5759357284494752
Energy: 0.5682086680548932
Energy: 0.6858707387549557
Energy: 0.5671914027732251
Energy: 0.5364854437413527
Energy: 0.537963789000542
Energy: 0.5869162802211247
Energy: 0.5364468379156234
Energy: 0.5082028141496397
Energy: 0.5754461727751694
Energy: 0.6417973822704723
Energy: 0.5086272160998275
Energy: 0.5930156888945237
Energy: 0.5084556866011725
Energy: 0.6353770190765138
Energy: 0.5689648624588276
Energy: 0.5279816293641675
Energy: 0.5855525827879677
Energy: 0.49094396126928735
Energy: 0.6456244751224325
Energy: 0.5879753442018285
Energy: 0.5179497680988893
Energy: 0.513954433493227
Energy: 0.5839112963131025
Energy: 0.5566596216995536
Energy: 0.5616790860081993
Energy: 0.5614016646035899
Energy: 0.6119593158334351
Energy: 0.603294103618509
Energy: 0.5116197163371659
Energy: 0.608435174244886
Energy: 0.542063874519506

minimum gb energy = 0.49094396126928735 eV
minimum distance =  2.46218961812691 Angstroms
sigma value = 19


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

Energy: 0.7340785963428923
Energy: 0.516287499826683
Energy: 0.5439346264556864
Energy: 0.6920604471280286
Energy: 0.5164084254056179
Energy: 0.5358573534439175
Energy: 0.5468363962918026
Energy: 0.4848919027958216
Energy: 0.4848096301083952
Energy: 0.5424481636775891
Energy: 0.4986744345076751
Energy: 0.48508133710222906
Energy: 0.5479969963300053
Energy: 0.4844711267815247
Energy: 0.4845161446198464
Energy: 0.54658478115607
Energy: 0.4844535317382238
Energy: 0.48477304614648015
Energy: 0.5519897051792825
Energy: 0.4850150019518238
Energy: 0.48525966081414906
Energy: 0.5408033805361593
Energy: 0.4849825019987559
Energy: 0.48518243123114124
Energy: 0.4934138563181015
Energy: 0.5461508552865842
Energy: 0.48544703052332655
Energy: 0.4948972022089317
Energy: 0.5437803151703854
Energy: 0.48449555776539344
Energy: 0.4984727205731121
Energy: 0.484665941932728
Energy: 0.5382603345739457
Energy: 0.4986067800320142
Energy: 0.5346575264387061
Energy: 0.5367317944629861
Energy: 0.5831641778234599
Energy: 0.5090218616762122
Energy: 0.47121839457605397
Energy: 0.5817342389460136
Energy: 0.5094285892627022
Energy: 0.5233301843750343
Energy: 0.5809003955550778
Energy: 0.48389192943917786
Energy: 0.4849201213472805
Energy: 0.5805418220770888
Energy: 0.496713753848619
Energy: 0.4850046280493799
Energy: 0.48437751293010606
Energy: 0.48518586787604223
Energy: 0.4855002837135109
Energy: 0.4843726779335261
Energy: 0.5431163358708283
Energy: 0.4850058521936547
Energy: 0.4844336030500815
Energy: 0.48497952140777945
Energy: 0.4849827737854939
Energy: 0.4844539954414104
Energy: 0.543058126408014
Energy: 0.48512001104538177
Energy: 0.6425329490538281
Energy: 0.473899461854668
Energy: 0.47388123336744375
Energy: 0.5693557732292882
Energy: 0.47387728814013086
Energy: 0.6183009154374638
Energy: 0.5361741365849249
Energy: 0.4729671433184264
Energy: 0.4735475130086946
Energy: 0.5362629359441645
Energy: 0.49787549722407687
Energy: 0.4730082106542798
Energy: 0.5204055323079542
Energy: 0.5378595476999228
Energy: 0.537576308963239
Energy: 0.47142705894418996
Energy: 0.5378073722910852
Energy: 0.5096389229997594
Energy: 0.5626919892182738
Energy: 0.5413204972947036
Energy: 0.48452705078446795
Energy: 0.4947930785799841
Energy: 0.5418761752566595
Energy: 0.4846580590701868
Energy: 0.5364262887209308
Energy: 0.47240974741985886
Energy: 0.47258051014348024
Energy: 0.5363220398222268
Energy: 0.47246180588404024
Energy: 0.47321774554944424
Energy: 0.5359865169166735
Energy: 0.472652612771784
Energy: 0.4725951956520525
Energy: 0.5359550093798783
Energy: 0.4727329572761972
Energy: 0.4725801632376196
Energy: 0.5005969510818851
Energy: 0.5421418201504423
Energy: 0.49396520684414214
Energy: 0.47476445874271306
Energy: 0.5403800306534218
Energy: 0.494014367566693
Energy: 0.5403835344406352
Energy: 0.5294791972498939
Energy: 0.4724541161797868
Energy: 0.4932201309977386
Energy: 0.5360999185099293
Energy: 0.47274116891432694
Energy: 0.5582666801868703
Energy: 0.4718582627677432
Energy: 0.5256680706042031
Energy: 0.5580862162118392
Energy: 0.47180121216785365
Energy: 0.47267587812273204
Energy: 0.5420941173936329
Energy: 0.47180489908299905
Energy: 0.4720240380893876
Energy: 0.542656166995823
Energy: 0.47175362920148967
Energy: 0.4963167117595774
Energy: 0.4725573522668605
Energy: 0.47262508196149566
Energy: 0.47261557699429796
Energy: 0.47243037615801503
Energy: 0.5362424382621686
Energy: 0.47301592142424026
Energy: 0.4809750631159885
Energy: 0.47293061351268806
Energy: 0.4732565600811785
Energy: 0.48113726801635753
Energy: 0.5361014646743665
Energy: 0.47332219687853805
Energy: 0.5384354468214657
Energy: 0.4933737098263074
Energy: 0.49409546165192497
Energy: 0.5140804109831677
Energy: 0.46916346034375334
Energy: 0.4708498262153907
Energy: 0.5475281470997512
Energy: 0.46928830287514994
Energy: 0.4738782592561224
Energy: 0.5476637316549587
Energy: 0.46915816464971466
Energy: 0.47382593664575856
Energy: 0.5215366886315193
Energy: 0.5265798714922102
Energy: 0.4733125405921642
Energy: 0.49787729509838313
Energy: 0.5361994454567272
Energy: 0.4731165339121447
Energy: 0.49782092101538883
Energy: 0.5324551329517784
Energy: 0.4850009908610836
Energy: 0.48367844748882344
Energy: 0.5433779852602743
Energy: 0.48459683192408665
Energy: 0.546714891822102
Energy: 0.48457281404066177
Energy: 0.4849425606355017
Energy: 0.5468532453234567
Energy: 0.4845060077025959
Energy: 0.484659033075567
Energy: 0.5469796014304812
Energy: 0.4847907893219539
Energy: 0.4853296782797649
Energy: 0.5464695464807904
Energy: 0.4843913244851572
Energy: 0.4853097542109545
Energy: 0.5405322670711404
Energy: 0.5789060510969335
Energy: 0.5818059696513426
Energy: 0.4688687771111302
Energy: 0.5772083678949687
Energy: 0.4733960073413939

minimum gb energy = 0.4688687771111302 eV
minimum distance =  2.55380866392004 Angstroms
sigma value = 101


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

Energy: 0.6867771648863057
Energy: 0.496978586113471
Energy: 0.5690646265631276
Energy: 0.6641340854101477
Energy: 0.5999013494541598
Energy: 0.6647341579401125
Energy: 0.5930197367536143
Energy: 0.5229680863940187
Energy: 0.46270579265059225
Energy: 0.5471707664813521
Energy: 0.4872390881665226
Energy: 0.46235927556989964
Energy: 0.5452153254801533
Energy: 0.46217106137763514
Energy: 0.46208131614370107
Energy: 0.5458789851147317
Energy: 0.46231510438140827
Energy: 0.4622453602156637
Energy: 0.48727295197859
Energy: 0.4630705849129189
Energy: 0.4623210033785447
Energy: 0.4873454477766078
Energy: 0.46247498263445463
Energy: 0.4742756346882327
Energy: 0.4739595205825263
Energy: 0.5163881497563213
Energy: 0.5103218373661641
Energy: 0.4748823104830383
Energy: 0.5381406950750246
Energy: 0.47349080955811834
Energy: 0.5021749904811065
Energy: 0.47326807448256025
Energy: 0.46299765796590564
Energy: 0.5016411525108291
Energy: 0.5448259921935454
Energy: 0.4618280229847677
Energy: 0.5178064889678743
Energy: 0.46082397085931287
Energy: 0.46084504747651894
Energy: 0.5181030688432803
Energy: 0.46127555820423943
Energy: 0.46088755648497726
Energy: 0.47733551579008915
Energy: 0.4623785097054123
Energy: 0.46234430247031155
Energy: 0.47752734131817876
Energy: 0.4620151456365182
Energy: 0.5211972007238692
Energy: 0.46325298328295783
Energy: 0.46226431214336616
Energy: 0.4622150686675729
Energy: 0.4620751298175767
Energy: 0.5155678888260434
Energy: 0.46195490994344224
Energy: 0.4617702576957204
Energy: 0.4620739788365284
Energy: 0.4619228235822382
Energy: 0.4618084223054131
Energy: 0.46171482087104143
Energy: 0.4618610474918666
Energy: 0.5973484136112812
Energy: 0.4475350411851819
Energy: 0.4477043593848654
Energy: 0.5980799251070226
Energy: 0.44768940771238996
Energy: 0.6683521587556086
Energy: 0.5521106473220118
Energy: 0.46294002358214015
Energy: 0.4623298193893132
Energy: 0.5527070628267566
Energy: 0.5089675479455229
Energy: 0.46207546769081065
Energy: 0.4864380608097498
Energy: 0.5367172822910795
Energy: 0.46246035076226244
Energy: 0.4618782379435589
Energy: 0.534975073237007
Energy: 0.46229457690757103
Energy: 0.48593461404357025
Energy: 0.462634094845356
Energy: 0.4627056842738456
Energy: 0.48592155004369053
Energy: 0.49981184229519293
Energy: 0.46202561873173803
Energy: 0.5440028180576084
Energy: 0.462289152734297
Energy: 0.46188921616771217
Energy: 0.5449493654919374
Energy: 0.4637361056777707
Energy: 0.4617951513588759
Energy: 0.5439349889469742
Energy: 0.4618657368156144
Energy: 0.462830021207124
Energy: 0.515070326890008
Energy: 0.4617696633158763
Energy: 0.46245808694183893
Energy: 0.49612609902830507
Energy: 0.5972140787279226
Energy: 0.4748430475878674
Energy: 0.4484634914646705
Energy: 0.4656820498057097
Energy: 0.44694370063336636
Energy: 0.5857181140176358
Energy: 0.4620022588346524
Energy: 0.4624224681388321
Energy: 0.518421529230617
Energy: 0.5437788807074382
Energy: 0.4737901087449006
Energy: 0.544568993022085
Energy: 0.4620496591095258
Energy: 0.46190751434744515
Energy: 0.5444645240803745
Energy: 0.4619672407538352
Energy: 0.4623845972196165
Energy: 0.5450987978601791
Energy: 0.4621182968693863
Energy: 0.4622011123658735
Energy: 0.5453617888925213
Energy: 0.46210439682792237
Energy: 0.46243593439341996
Energy: 0.475496089720506
Energy: 0.4624066128131636
Energy: 0.46225089884767134
Energy: 0.4750792420458634
Energy: 0.537663025935277
Energy: 0.4737363313383466
Energy: 0.4870079903663463
Energy: 0.4619648163834783
Energy: 0.46219636970698497
Energy: 0.48706142884468845
Energy: 0.5149387954959669
Energy: 0.46237989616567043
Energy: 0.5364459192017491
Energy: 0.46108964366341687
Energy: 0.46092576243115474
Energy: 0.5367769467289373
Energy: 0.46137884754924446
Energy: 0.4609680103636216
Energy: 0.5942054462715762
Energy: 0.4609782704127389
Energy: 0.46094904191692315
Energy: 0.5949361295687489
Energy: 0.4611799649175148
Energy: 0.510452632295786
Energy: 0.46182604315236536
Energy: 0.462795298741406
Energy: 0.4629213191527262
Energy: 0.4617816762774636
Energy: 0.5154476085045079
Energy: 0.4622663546622485
Energy: 0.46272224568686027
Energy: 0.46211848297010205
Energy: 0.46214661322944206
Energy: 0.4631029688189788
Energy: 0.5379740173787836
Energy: 0.4621732003964847
Energy: 0.5385925273446688
Energy: 0.4476261675183187
Energy: 0.44757264048060375
Energy: 0.5392505925672249
Energy: 0.4501682289567716
Energy: 0.44747852667591514
Energy: 0.5461906319419689
Energy: 0.447664659215251
Energy: 0.44767151689869966
Energy: 0.5445140572691107
Energy: 0.44756715698820687
Energy: 0.462397872240414
Energy: 0.486321051379366
Energy: 0.5083475140127305
Energy: 0.4626791091037346
Energy: 0.48607384989324204
Energy: 0.5308097363533922
Energy: 0.46184808028763535
Energy: 0.48743797766294233
Energy: 0.4738356370453582
Energy: 0.47441917917042664
Energy: 0.46092782307966335
Energy: 0.5026849463912322
Energy: 0.47434949909597773
Energy: 0.5452275217733209
Energy: 0.4619867902800457
Energy: 0.46220830732559365
Energy: 0.5448596953969115
Energy: 0.4618997479825154
Energy: 0.46229725619867085
Energy: 0.5437901509585993
Energy: 0.4619440573883953
Energy: 0.46263660599532047
Energy: 0.5441110200151871
Energy: 0.46167969344710735
Energy: 0.46276964852422137
Energy: 0.49765576469927303
Energy: 0.4666155613427722
Energy: 0.4481685219719129
Energy: 0.47359357648442674
Energy: 0.4663189410013977
Energy: 0.4820385428078647

minimum gb energy = 0.44694370063336636 eV
minimum distance =  2.52619288746974 Angstroms
sigma value = 33


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

Energy: 0.011885014640833375
Energy: 0.4252397245941296
Energy: 0.01216109689195179
Energy: 0.013246036699808986
Energy: 0.4246854818350882
Energy: 0.012139934585271095
Energy: 0.2767852338489442
Energy: 0.062422773049309044
Energy: 0.062426526260282514
Energy: 0.061855695935925346
Energy: 0.06168333695791014
Energy: 0.061892171166618444
Energy: 0.6423308398621423
Energy: 0.425136937828673
Energy: 0.4254161212796371
Energy: 0.42452392513626236
Energy: 0.4246832254342285
Energy: 0.4248366599670149
Energy: 0.2767852338499871
Energy: 0.062422773050706086
Energy: 0.06242652626099088
Energy: 0.06185569593732239
Energy: 0.06168333695688695
Energy: 0.06189217116626426

minimum gb energy = 0.011885014640833375 eV
minimum distance =  2.82421092646494 Angstroms
sigma value = 1