Model name: model_name=MEAM_LAMMPS_KimLee_2006_PtFe__MO_343168101490_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.9173715934157367
cohesive_energy=5.770453839558936
mass=195.084
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=[2.14132509310734e-19, 3.08380549805784e-19, 3.8430609831440997e-19, 4.49251930350234e-19, 5.0637593605887e-19, 5.573812292022599e-19, 6.03317235475674e-19, 6.4488731042143805e-19, 6.8258652661945795e-19, 7.16788191225456e-19, 7.477758895036499e-19, 7.757771305360679e-19, 8.009729602823519e-19, 8.235187898759999e-19, 8.435411912710979e-19, 8.61150714655392e-19, 8.764402862736539e-19, 8.89493219310852e-19, 9.0038321389215e-19, 9.09175959259542e-19, 9.15929133771852e-19, 9.20694007081368e-19, 9.235218488403779e-19, 9.24455917818e-19, 9.234321269488739e-19, 9.20075566900644e-19, 9.13894369446672e-19, 9.04282911819306e-19, 8.905041927669059e-19, 8.71654584667896e-19, 8.46610961701842e-19, 8.139826345504319e-19, 7.720296393891419e-19, 7.185585964060259e-19, 6.50784922611192e-19, 5.651565924070619e-19, 4.57083369737226e-19, 3.20577920520426e-19, 1.4776778964783957e-19, -7.18573015995732e-20, -3.5247245077346394e-19, -7.1353737483507e-19, -1.182138792394122e-18, -1.79677700796564e-18, -2.6132301988857e-18, -3.71447028649926e-18, -5.2271813772567e-18, -7.35149135451096e-18, -1.041594255883008e-17, -1.498552655842782e-17, -2.20893694706214e-17, -3.3741839912039996e-17, -5.4270208688155195e-17, -9.422352719254979e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018953245616164783
Energy: 1.224601767031875
Energy: 0.020714853188453362
Energy: 0.022319275216379726
Energy: 0.6648591766560497
Energy: 0.019905417941933404
Energy: 1.2246017670313405
Energy: 0.11263214072363517
Energy: 0.11185640250157934
Energy: 0.11190583074472983
Energy: 0.11187057157522755
Energy: 0.1119120623267681
Energy: 0.020714853188987487
Energy: 0.11185640250288496
Energy: 0.1125230998779867
Energy: 0.020988600716834283
Energy: 0.11196462084061408
Energy: 0.11331987511089149
Energy: 0.022319275216379726
Energy: 0.11190583074499691
Energy: 0.020988600716567215
Energy: 0.019417539119643556
Energy: 0.11193802618302084
Energy: 0.019946905184675536
Energy: 0.6648591766537054
Energy: 0.11187057157626612
Energy: 0.11196462084007996
Energy: 0.11193802618198227
Energy: 0.11194603808130008
Energy: 0.11187908537601546
Energy: 0.019905417941933404
Energy: 0.11191206232831112
Energy: 0.11331987510931879
Energy: 0.019946905184675536
Energy: 0.11187908537628251
Energy: 0.020149863071078165

minimum gb energy = 0.018953245616164783 eV
minimum distance =  2.7634711027669 Angstroms
sigma value = 1


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

Energy: 2.1160732725846487
Energy: 1.5003893094556628
Energy: 1.4436952923338702
Energy: 2.1130019199809653
Energy: 1.974492924950582
Energy: 2.018377186584036
Energy: 1.9095893192598754
Energy: 1.2798331417304
Energy: 1.2758713342749268
Energy: 1.4841647729453757
Energy: 1.2774364247012726
Energy: 1.358528318403078
Energy: 1.9632757292073795
Energy: 1.3239822850360408
Energy: 1.325312938054643
Energy: 1.9647816216575522
Energy: 1.3587377203825006
Energy: 1.295644361776467
Energy: 2.037953337333091
Energy: 1.597662415307796
Energy: 1.61268670072412
Energy: 1.795196271653956
Energy: 1.5684203085659894
Energy: 1.610947660393096
Energy: 1.9056182641464459
Energy: 1.3387553380937764
Energy: 1.3403887674239894
Energy: 1.4580536735503973
Energy: 1.3999160040067253
Energy: 1.3317162469077086
Energy: 1.7122408585411533
Energy: 1.309262327285362
Energy: 1.3095580214341835
Energy: 1.7157672814758604
Energy: 1.400732203698656
Energy: 1.31310866637482
Energy: 1.7864788641024307
Energy: 1.591436405161982
Energy: 1.4034299266980401
Energy: 1.7569491789842806
Energy: 1.7909539379085149
Energy: 1.3862348710994967
Energy: 1.9086369971137638
Energy: 1.4238758131595164
Energy: 1.5008829043972416
Energy: 1.7909535473460862
Energy: 1.61145314811631
Energy: 1.493297908924584
Energy: 1.4889518702190168
Energy: 1.3245551341774924
Energy: 1.3105317524977662
Energy: 1.4220430793789665
Energy: 1.609879643503803
Energy: 1.2806126515264127
Energy: 1.5214362552840945
Energy: 1.521837318880403
Energy: 1.4484232763683802
Energy: 1.5242948980033646
Energy: 1.4956484095372278
Energy: 1.4346438940025954
Energy: 1.7533736182918558
Energy: 1.6315755160409096
Energy: 1.6206152427994511
Energy: 1.7868539504165164
Energy: 1.6378687620263812
Energy: 1.8769414563291495
Energy: 1.3150944104765339
Energy: 1.4967806538321329
Energy: 1.2931438606300885
Energy: 1.3169753225729859
Energy: 1.549895985766744
Energy: 1.2941379031767015
Energy: 1.275855962254905
Energy: 1.4289287370097656
Energy: 1.2077197878497745
Energy: 1.2758437446115025
Energy: 1.424282682712368
Energy: 1.246065153635226
Energy: 1.3440051852583421
Energy: 1.7446644829091296
Energy: 1.8226919583124046
Energy: 1.3436434311750933
Energy: 1.7494074492061449
Energy: 1.6270807564366063
Energy: 1.3262214117024438
Energy: 1.4050616725417382
Energy: 1.291320698766441
Energy: 1.3279062730298286
Energy: 1.654634290147001
Energy: 1.291656890587352
Energy: 1.4055558496643559
Energy: 1.4353906019588192
Energy: 1.2941779768509176
Energy: 1.407223652940552
Energy: 1.5760031746874466
Energy: 1.2997619191907652
Energy: 1.8205260614424177
Energy: 1.4998946555366577
Energy: 1.5339838291270853
Energy: 1.7318330107562663
Energy: 1.7016303363334182
Energy: 1.5254947497998506
Energy: 1.5881147986225623
Energy: 1.4476416408935613
Energy: 1.4427604882011968
Energy: 1.5581269758403744
Energy: 1.7035710539483335
Energy: 1.3306339237199476
Energy: 1.5924906326939947
Energy: 1.2789898360052092
Energy: 1.272986992316871
Energy: 1.6125528598051273
Energy: 1.5557128582405981
Energy: 1.2816672836693284
Energy: 1.8592101037977447
Energy: 1.5200832569190514
Energy: 1.4453522165584294
Energy: 1.7050243466933754
Energy: 1.613336250427085
Energy: 1.4420991331493034
Energy: 2.074845613094966
Energy: 1.7447407010706106
Energy: 1.7220062603616189
Energy: 2.069170734979529
Energy: 1.8526254269388855
Energy: 1.6187594639635423
Energy: 1.8207090373238797
Energy: 1.3436156942508939
Energy: 1.3362011984059974
Energy: 1.8235282782250137
Energy: 1.3701647427412955
Energy: 1.3057578766240483
Energy: 1.9095990964311484
Energy: 1.3150298567959264
Energy: 1.316724220040551
Energy: 1.6876540072387456
Energy: 1.3483105442931178
Energy: 1.3946473278166978

minimum gb energy = 1.2077197878497745 eV
minimum distance =  2.48433265857656 Angstroms
sigma value = 33


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

Energy: 2.4628545968745237
Energy: 1.4972381167016409
Energy: 1.7719581923968568
Energy: 2.310494734715887
Energy: 1.8217495372282428
Energy: 1.875511723411929
Energy: 2.0719251436194197
Energy: 1.381401189447436
Energy: 1.2532972496869468
Energy: 1.867577736433027
Energy: 1.236886176145627
Energy: 1.4553439636908363
Energy: 1.8702321263244424
Energy: 1.3276093207589141
Energy: 1.312580919044477
Energy: 1.8683237989275638
Energy: 1.310583836142122
Energy: 1.346714911078171
Energy: 2.0015333631032792
Energy: 1.459497665673494
Energy: 1.4564918604104211
Energy: 1.747465032914957
Energy: 1.453076366069054
Energy: 1.4971787749603538
Energy: 1.9518247237618231
Energy: 1.4338339260829704
Energy: 1.4433685088632984
Energy: 1.9523218456471545
Energy: 1.428959499705483
Energy: 1.4667212469389357
Energy: 1.8493098603400127
Energy: 1.5454980199635175
Energy: 1.4494981869604115
Energy: 1.8596258071309582
Energy: 1.5442322172898801
Energy: 1.4249396449896599
Energy: 1.8316685076466979
Energy: 1.795129701610127
Energy: 1.6153970254474042
Energy: 1.806784965581708
Energy: 1.8095784532976886
Energy: 1.5821004753491454
Energy: 1.863762977360373
Energy: 1.438982375456421
Energy: 1.4276733653306344
Energy: 1.6467738020365013
Energy: 1.5828372527502905
Energy: 1.415396270673689
Energy: 1.455506650484496
Energy: 1.4444675475587394
Energy: 1.4093941937098935
Energy: 1.4462618509919722
Energy: 1.475613969952313
Energy: 1.4218898900057884
Energy: 1.4963496821944127
Energy: 1.5618288519060557
Energy: 1.5444176519396564
Energy: 1.4950853730438796
Energy: 1.5416152226600681
Energy: 1.4453351034618416
Energy: 1.6975395558422792
Energy: 1.8216868370411965
Energy: 1.8206345270739626
Energy: 1.6969541033837339
Energy: 1.7660229673033205
Energy: 1.7721629144957527
Energy: 1.4006245113406006
Energy: 1.5783483032975514
Energy: 1.4283347873407093
Energy: 1.2929620242131208
Energy: 1.9682768383761362
Energy: 1.3897640732522276
Energy: 1.332600172011995
Energy: 1.42873024564126
Energy: 1.4290341757246787
Energy: 1.3270300909670523
Energy: 1.5050024739484038
Energy: 1.3642397954346683
Energy: 1.6005931542730383
Energy: 1.659553891373121
Energy: 1.6541938047853226
Energy: 1.6149986392080418
Energy: 1.7457575705085466
Energy: 1.481598486893416
Energy: 1.489591127172797
Energy: 1.4433598621678638
Energy: 1.4585723075318535
Energy: 1.4776480215988688
Energy: 1.859006679289206
Energy: 1.4461204465766029
Energy: 1.6062302377658815
Energy: 1.6204667650860582
Energy: 1.5017414382659822
Energy: 1.5745550558944923
Energy: 1.8146357022868265
Energy: 1.4458564508866896
Energy: 1.905113521653147
Energy: 1.6043642294806006
Energy: 1.6173477563897578
Energy: 1.8929494995554506
Energy: 1.616460597000893
Energy: 1.573887943914818
Energy: 1.5726730132835272
Energy: 1.6053458622930883
Energy: 1.6049064333499854
Energy: 1.573065259593917
Energy: 1.6141274936592993
Energy: 1.4271347857865833
Energy: 1.6973003722342797
Energy: 1.4042797179885982
Energy: 1.4260598315273614
Energy: 1.6999647824026918
Energy: 1.536041285135688
Energy: 1.4372391652536955
Energy: 1.9541254523411653
Energy: 1.4758619314948476
Energy: 1.512734968368801
Energy: 1.785160138101805
Energy: 1.5442146363676392
Energy: 1.4404923387864912
Energy: 2.3134367019023845
Energy: 1.7402250953243792
Energy: 1.7082690553395454
Energy: 2.3065871979040695
Energy: 1.7392982738100793
Energy: 1.7652751425180413
Energy: 1.9655853121574722
Energy: 1.3437317674171816
Energy: 1.3895565618824997
Energy: 1.9677492761580517
Energy: 1.3454978505372441
Energy: 1.4021706611157698
Energy: 2.13332370964497
Energy: 1.342631917809999
Energy: 1.375117929828989
Energy: 1.7922149255387894
Energy: 1.3452424889468724
Energy: 1.3903014390796875
Energy: 1.997929493871217
Energy: 1.676466996255257
Energy: 1.678287616780474
Energy: 1.9939002715680818
Energy: 1.6825979529509558
Energy: 1.8608112526534417
Energy: 1.9775519571623785
Energy: 1.4396394757386561
Energy: 1.438191439399304
Energy: 1.8675185499623093
Energy: 1.4430811960237377
Energy: 1.436093409038785
Energy: 1.872939412782825
Energy: 1.4256024878696476
Energy: 1.443938264666914
Energy: 1.8570696725646791
Energy: 1.5183760721749202
Energy: 1.4342648610813244
Energy: 1.8288197915780349
Energy: 1.8298672393556639
Energy: 1.5797241188307718
Energy: 1.8126139179332366
Energy: 1.856165061149368
Energy: 1.709288732715776
Energy: 1.901899490569087
Energy: 1.4326860868257414
Energy: 1.525624721732181
Energy: 1.6728662931664764
Energy: 1.6204292454914158
Energy: 1.5128688028778576
Energy: 1.5129547666311784
Energy: 1.440763494367116
Energy: 1.463952994216398
Energy: 1.5229614595156127
Energy: 1.6476570801801613
Energy: 1.4360950561104309
Energy: 1.443324338729923
Energy: 1.525509433742099
Energy: 1.5574218624896363
Energy: 1.4544948624879632
Energy: 1.5762144002236298
Energy: 1.417250005736304
Energy: 1.697178717802155
Energy: 1.620019006020942
Energy: 1.6835347274241423
Energy: 1.7136209811959693
Energy: 1.7179588889060173
Energy: 1.5812018678605064
Energy: 1.4478505512776692
Energy: 1.533805854832773
Energy: 1.366990045175408
Energy: 1.4479151075589685
Energy: 1.9563093386774202
Energy: 1.3818200726802061
Energy: 1.33594763362678
Energy: 1.3957894551507883
Energy: 1.4119166198815158
Energy: 1.3377824340998044
Energy: 1.5755859610618999
Energy: 1.3596654825026842
Energy: 1.3325727165510104
Energy: 1.658150763554005
Energy: 1.6551287354133102
Energy: 1.3343718584212065
Energy: 1.7471584406137408
Energy: 1.4692651994013004
Energy: 1.4861433303900906
Energy: 1.390937021025802
Energy: 1.3871943211502762
Energy: 1.4706706086204975
Energy: 1.5862024950349605
Energy: 1.445404100674502
Energy: 1.562135579266054
Energy: 1.6371266118126941
Energy: 1.434737286977019
Energy: 1.5568591251015989
Energy: 1.8226324641484388
Energy: 1.4376837449306354
Energy: 1.9013768255714611
Energy: 1.713660350830577
Energy: 1.6971528972719283
Energy: 1.8892470977578277
Energy: 1.6943945913651686
Energy: 1.7090634127220978
Energy: 1.687242223355058
Energy: 1.6208705703907036
Energy: 1.5776403401579822
Energy: 1.671375465407156
Energy: 1.596704638307703
Energy: 1.6030300024346056
Energy: 1.6446544737816904
Energy: 1.3820985742726168
Energy: 1.3422328689621068
Energy: 1.6448600167225418
Energy: 1.358149503758444
Energy: 1.4612072184225908
Energy: 1.9770498286007874
Energy: 1.3890999201074765
Energy: 1.3890839721189283
Energy: 1.5228360086223236
Energy: 1.4323173349896505
Energy: 1.5150736924828254
Energy: 2.0269109770177534
Energy: 1.5360297154329752
Energy: 1.4636634489200544
Energy: 1.8859293349213135
Energy: 1.4865975423300533
Energy: 1.414698373633397

minimum gb energy = 1.236886176145627 eV
minimum distance =  2.467402124587 Angstroms
sigma value = 51


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

Energy: 2.129811623605654
Energy: 1.3565449644964436
Energy: 2.073733608308947
Energy: 2.124015403079761
Energy: 1.4519092668588158
Energy: 1.7619302831885855
Energy: 1.9523341994128298
Energy: 1.2594453120652038
Energy: 1.2596856308661657
Energy: 1.848044094303356
Energy: 1.2586983869285369
Energy: 1.3815389871115824
Energy: 1.8800360947149268
Energy: 1.2531806293438639
Energy: 1.2528135401186824
Energy: 1.856614203463636
Energy: 1.253368637416052
Energy: 1.1951033254963948
Energy: 1.8804882934722402
Energy: 1.7080735373015283
Energy: 1.555653410824798
Energy: 1.7560611667833705
Energy: 1.6401001040374186
Energy: 1.594214877916107
Energy: 1.8787853380129882
Energy: 1.462794712433323
Energy: 1.4688851953758826
Energy: 1.8784698828648518
Energy: 1.5541035721776748
Energy: 1.4709733613371438
Energy: 1.611365801441754
Energy: 1.475239250907187
Energy: 1.4163209042516058
Energy: 1.613816188617082
Energy: 1.5622943740527593
Energy: 1.3310825121693293
Energy: 1.6194568125443005
Energy: 1.5956251588388735
Energy: 1.4383177395611697
Energy: 1.6219407072072392
Energy: 1.5889556833344631
Energy: 1.4967222073338835
Energy: 1.7996235394410394
Energy: 1.7144587181309214
Energy: 1.6599409307906519
Energy: 1.799747351459466
Energy: 1.7953314331182564
Energy: 1.6469141751196401
Energy: 1.3111730042285719
Energy: 1.6903928587693209
Energy: 1.540582380164665
Energy: 1.3118756673023715
Energy: 1.7784310425914562
Energy: 1.253459579372345
Energy: 1.259440567934522
Energy: 1.4664984092164288
Energy: 1.322883503185063
Energy: 1.2598557305221667
Energy: 1.653490871153444
Energy: 1.261162308151551
Energy: 1.2607120441650717
Energy: 1.8993436815940306
Energy: 1.8891265739191345
Energy: 1.2603123306934214
Energy: 1.8904395385173085
Energy: 1.9069486393347554
Energy: 1.3660672207640385
Energy: 1.4522431033724885
Energy: 1.3385825342690671
Energy: 1.3657764372480932
Energy: 1.6059026964376968
Energy: 1.3384222772665026
Energy: 1.3640271979675012
Energy: 1.4794502868239467
Energy: 1.2208640288800658
Energy: 1.3662023117854527
Energy: 1.7199397845345843
Energy: 1.2804279926155022
Energy: 1.8128355185579792
Energy: 1.5773737275027524
Energy: 1.5782233920028599
Energy: 1.454604622418155
Energy: 1.630352745318743
Energy: 1.5718803203085032
Energy: 1.780779746191862
Energy: 1.6779454304604615
Energy: 1.6135950557032692
Energy: 1.7188995739928228
Energy: 1.7242884668889296
Energy: 1.6156042227621183
Energy: 1.6725185642650697
Energy: 1.4050059685967389
Energy: 1.318987947361792
Energy: 1.6716404560248062
Energy: 1.4930956095492713
Energy: 1.4223767192474739
Energy: 1.9092555982473505
Energy: 1.313131729208401
Energy: 1.2862240749739777
Energy: 1.8097048854891238
Energy: 1.3455448547631819
Energy: 1.3761297951740619
Energy: 2.011065149417369
Energy: 1.4699559263985766
Energy: 1.3833207723605896
Energy: 2.011512119048432
Energy: 1.4691235372199416
Energy: 1.280345376403726

minimum gb energy = 1.1951033254963948 eV
minimum distance =  2.5108850638296 Angstroms
sigma value = 19


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

Energy: 1.9357948567166734
Energy: 1.445062233646692
Energy: 1.4541718152431118
Energy: 1.7393224055706762
Energy: 1.705423298172809
Energy: 1.6068315284703092
Energy: 1.9051144039426708
Energy: 1.1994353664045976
Energy: 1.2600709834051174
Energy: 1.7488156410675997
Energy: 1.2061428785817347
Energy: 1.4853879760581767
Energy: 1.9083939449715983
Energy: 1.34197695379498
Energy: 1.328839679240854
Energy: 1.721263803645603
Energy: 1.3333838737883243
Energy: 1.4728016037959522
Energy: 1.5307756525825746
Energy: 1.602868834677601
Energy: 1.6433012333573342
Energy: 1.5258232657516388
Energy: 1.5687348899895188
Energy: 1.4998885831269246
Energy: 1.9580154071348865
Energy: 1.4846102214001249
Energy: 1.4926943365157492
Energy: 1.8033289299638315
Energy: 1.5080392071023994
Energy: 1.4944735265074192
Energy: 1.612362501334519
Energy: 1.2841503592803416
Energy: 1.5251328812008167
Energy: 1.6128189946482814
Energy: 1.2849243477991632
Energy: 1.5502147471177004
Energy: 1.62636659648269
Energy: 1.8436802909152972
Energy: 1.6178654667010073
Energy: 1.6373454387274193
Energy: 1.7698896327030633
Energy: 1.5376735737540066
Energy: 1.7227964552589607
Energy: 1.5309924168369076
Energy: 1.5306892883741787
Energy: 1.6647668561619997
Energy: 1.7422489543276174
Energy: 1.4258728748390022
Energy: 1.317696269933716
Energy: 1.5271373124098306
Energy: 1.5239796336629097
Energy: 1.3177870016646167
Energy: 1.752009986126176
Energy: 1.3408776262268733
Energy: 1.4179093630797168
Energy: 1.5167566502027814
Energy: 1.5107923354493633
Energy: 1.3567051914189165
Energy: 1.684375986385302
Energy: 1.3968342149895945
Energy: 1.3559588698733622
Energy: 1.531679099352723
Energy: 1.4291594689616118
Energy: 1.3565765457404455
Energy: 1.5272181749391003
Energy: 1.6478357988339911
Energy: 1.6842280726705081
Energy: 1.483882491062794
Energy: 1.4837255604723876
Energy: 1.5249324702452816
Energy: 1.8063675328308626
Energy: 1.4883875436848235
Energy: 1.2093907327206235
Energy: 1.5471075651534945
Energy: 1.5000305395243025
Energy: 1.2114580416528498
Energy: 1.639601396120827
Energy: 1.5010227273955943
Energy: 1.931885242029826
Energy: 1.516847600930854
Energy: 1.5664526498832836
Energy: 1.8304920935850548
Energy: 1.6579720335378734
Energy: 1.5811068429089956
Energy: 1.7436642405830478
Energy: 1.8474616110048079
Energy: 1.6268510277142478
Energy: 1.7477337238192612
Energy: 1.8216882384333222
Energy: 1.420190689425626
Energy: 1.7410022817835193
Energy: 1.531526375010361
Energy: 1.3660893020397509
Energy: 1.741148435109155
Energy: 1.5055987732007587
Energy: 1.4544049695985692
Energy: 1.8958608639371686
Energy: 1.354564837328624
Energy: 1.4162266676925472
Energy: 1.7930211644406922
Energy: 1.373413783205889
Energy: 1.413088333818222
Energy: 1.740204064652694
Energy: 1.4014258546830682
Energy: 1.4451942427079156
Energy: 1.7417692827847375
Energy: 1.3557419748377475
Energy: 1.5179239357826115
Energy: 1.6447000565328826
Energy: 1.4931418859187684
Energy: 1.5522702336555283
Energy: 1.645937673666916
Energy: 1.4992325047102582
Energy: 1.4802504814984634
Energy: 1.9033819012676052
Energy: 1.20951987885581
Energy: 1.473635588026346
Energy: 1.843433785116903
Energy: 1.209495133983136
Energy: 1.4669099303137672
Energy: 1.63004615074216
Energy: 1.5104208159643255
Energy: 1.5016584675173148
Energy: 1.6458298927042347
Energy: 1.5335394690253696
Energy: 1.5627851719602668
Energy: 1.5783195476831193
Energy: 1.5676228655450406
Energy: 1.5175966526020854
Energy: 1.5790906382438525
Energy: 1.8561453419372846
Energy: 1.6290081616125769
Energy: 1.6274476467225922
Energy: 1.4537845751390666
Energy: 1.453883243298411
Energy: 1.4221865323995486
Energy: 1.837450678944634
Energy: 1.5305009115245813
Energy: 1.3047130466831411
Energy: 1.5240720739016285
Energy: 1.3495051908538132
Energy: 1.2894506183442382
Energy: 1.826822357362684
Energy: 1.3521320862474258
Energy: 1.3472547006141344
Energy: 1.4413300940297744
Energy: 1.4414206155078333
Energy: 1.371418830849893
Energy: 1.5207000420563286
Energy: 1.426164446316493
Energy: 1.6483637844976677
Energy: 1.5266907299809918
Energy: 1.5009767693587235
Energy: 1.6057816641371574
Energy: 1.5280152489684597
Energy: 1.6420077093855472
Energy: 1.5609003385789029
Energy: 1.4963559273099467
Energy: 1.5047421101325262
Energy: 1.493514761958349
Energy: 1.7869126461457512
Energy: 1.510960649098675
Energy: 1.284761887015966
Energy: 1.590869223563513
Energy: 1.4689691738148571
Energy: 1.2863470830368717
Energy: 1.4638520996059972
Energy: 1.5424993744483675
Energy: 1.9710538427396114
Energy: 1.50435136645763
Energy: 1.4739404222123056
Energy: 1.8125872294803402
Energy: 1.6007684130825144
Energy: 1.677669492056773
Energy: 1.936798603139171
Energy: 1.448960507018688
Energy: 1.4260959742376973
Energy: 1.7414438038242084
Energy: 1.69246818477538
Energy: 1.6053656630046491

minimum gb energy = 1.1994353664045976 eV
minimum distance =  2.48430324239453 Angstroms
sigma value = 27


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

Energy: 1.475272943332944
Energy: 1.633666056221332
Energy: 1.7964608877940014
Energy: 1.4769820293409102
Energy: 1.9187154613932613
Energy: 1.7939115057869162
Energy: 1.9158201859222046
Energy: 1.2675747828673665
Energy: 1.3591313685421658
Energy: 1.7649974903235983
Energy: 1.269040901790585
Energy: 1.3590440476414418
Energy: 1.9390111868880935
Energy: 1.169199912939731
Energy: 1.1673016127085085
Energy: 1.4462728942278091
Energy: 1.172599189526594
Energy: 1.167487625808624
Energy: 1.7696041803069855
Energy: 1.568996066605224
Energy: 1.616324072448279
Energy: 1.4469145990890566
Energy: 1.2109837210289351
Energy: 1.4036201210278816
Energy: 1.5532039107580964
Energy: 1.4325155239519372
Energy: 1.394507437461445
Energy: 1.3294043699213063
Energy: 1.6142811355277107
Energy: 1.400942241813743
Energy: 1.2074459114616924
Energy: 1.3391395384127207
Energy: 1.3381226591510822
Energy: 1.20733384053351
Energy: 1.4873437008244008
Energy: 1.4392867642746296
Energy: 1.2577864220502437
Energy: 1.289392775319964
Energy: 1.277014435102511
Energy: 1.2591540001239392
Energy: 1.3242883720357266
Energy: 1.3045648670761916
Energy: 1.2914954945368466
Energy: 1.568551281566381
Energy: 1.57242883092832
Energy: 1.2913453977134897
Energy: 1.6522484900088743
Energy: 1.5894413256411066
Energy: 1.5349356492824213
Energy: 1.4491495351333639
Energy: 1.5283201462517815
Energy: 1.29358884654108
Energy: 1.54907981330588
Energy: 1.2925783115924607
Energy: 1.1585149740368126
Energy: 1.3240712090488387
Energy: 1.2992836007538229
Energy: 1.2802062569400285
Energy: 1.3137274140816566
Energy: 1.232340599391516
Energy: 1.4946377022988624
Energy: 1.2311486444653756
Energy: 1.2341150703617163
Energy: 1.4081645890876746
Energy: 1.300860902338604
Energy: 1.230939052400675
Energy: 1.915820186078426
Energy: 1.2712141880677985
Energy: 1.4625916679544255
Energy: 1.7688923262057556
Energy: 1.5274720053096018
Energy: 1.5170371350463496

minimum gb energy = 1.1585149740368126 eV
minimum distance =  2.529790845048 Angstroms
sigma value = 9


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

Energy: 2.2387777350629166
Energy: 1.5910809075237924
Energy: 1.4744786154371794
Energy: 2.2114800819641225
Energy: 2.2450018301755383
Energy: 1.682692252244515
Energy: 1.6029431981379554
Energy: 1.1529020517711555
Energy: 1.2424442095967378
Energy: 1.3882551490574946
Energy: 1.1542192009209684
Energy: 1.1351597452092823
Energy: 1.51827576951564
Energy: 1.0377494662379283
Energy: 1.0301372902141226
Energy: 1.273868658951027
Energy: 1.0345283203707079
Energy: 1.1684486672711885
Energy: 1.4575086785717466
Energy: 1.2210796996164228
Energy: 1.2599986009674449
Energy: 1.461084158626688
Energy: 1.2351255326475907
Energy: 1.2549022013775526
Energy: 1.611849591001287
Energy: 1.387681729711868
Energy: 1.37536537321701
Energy: 1.4233400480629346
Energy: 1.407292176816818
Energy: 1.3740218384302048
Energy: 1.1782888034489771
Energy: 1.398061835592591
Energy: 1.5380102017544692
Energy: 1.178220674842813
Energy: 1.3926219519325258
Energy: 1.40303459240243
Energy: 1.1810868098380427
Energy: 1.3350327861189142
Energy: 1.2505174386832294
Energy: 1.1837511011379866
Energy: 1.576447736325511
Energy: 1.2525758855371165
Energy: 1.1418059360059152
Energy: 1.26764868935988
Energy: 1.4328029262013324
Energy: 1.1427333537299285
Energy: 1.3066023511572498
Energy: 1.2864693953291748
Energy: 1.6279293042774796
Energy: 1.3318354813777586
Energy: 1.3278793803244566
Energy: 1.58212866246844
Energy: 1.3449648876486644
Energy: 1.318709136197048
Energy: 1.7025503781111313
Energy: 1.238301498154455
Energy: 1.3240632490585516
Energy: 1.7044535836348198
Energy: 1.4246610583851682
Energy: 1.4012214144949744
Energy: 1.7176092781269618
Energy: 1.0964605625881911
Energy: 1.0962680227921964
Energy: 1.4681045862707778
Energy: 1.100875385470068
Energy: 1.1455484882432285
Energy: 1.6938845045275428
Energy: 1.1354944771180326
Energy: 1.1455756543855071
Energy: 1.3831351146568018
Energy: 1.1357631287625216
Energy: 1.1612199034393265
Energy: 1.9693358012864757
Energy: 1.3871011883248654
Energy: 1.374410451854275
Energy: 1.9584804238329399
Energy: 1.7830338844299711
Energy: 1.5365659008437178
Energy: 1.5886537751328875
Energy: 1.335087781597985
Energy: 1.330821934824235
Energy: 1.3400018035440908
Energy: 1.5515583083889883
Energy: 1.314863333702603
Energy: 1.2530258282070863
Energy: 1.130439293244453
Energy: 1.1360365121561977
Energy: 1.2545063295830112
Energy: 1.2102277371168841
Energy: 1.3074151112431662
Energy: 1.0992395231621688
Energy: 1.2351348545864447
Energy: 1.1531606807094799
Energy: 1.034214959371086
Energy: 1.1324111293261454
Energy: 1.0893788964889095
Energy: 1.1527527353121243
Energy: 1.4027295553785788
Energy: 1.402441757646394
Energy: 1.1536220524463647
Energy: 1.4486464842403686
Energy: 1.3575111029653517
Energy: 1.3845945338411958
Energy: 1.5428906489176044
Energy: 1.5703003886997198
Energy: 1.3848801546168066
Energy: 1.5475033650919676
Energy: 1.5077305189811716
Energy: 1.3160886434289467
Energy: 1.1540696180570746
Energy: 1.23818092531946
Energy: 1.2800691543742833
Energy: 1.2059927126023036
Energy: 1.274582517525486
Energy: 1.1261749884067964
Energy: 1.1426558202259725
Energy: 1.207070820320006
Energy: 1.1281759436495744
Energy: 1.130318677558695
Energy: 1.2553596720009927
Energy: 1.3144843348807087
Energy: 1.2066004171250013
Energy: 1.2793068232562024
Energy: 1.25679723534529
Energy: 1.2880174338675026
Energy: 1.3908967533204049
Energy: 2.2361527919327213
Energy: 1.3951744949563696
Energy: 1.3704832091914119
Energy: 1.679576035526149
Energy: 1.3808792340309552
Energy: 1.6852720446597946
Energy: 2.2381892218652673
Energy: 1.1523189005193712
Energy: 1.343787910681006
Energy: 1.5059402391473122
Energy: 1.1515962870973113
Energy: 1.3311654460737083
Energy: 1.5104561087130246
Energy: 1.0301527173446927
Energy: 1.03647356557298
Energy: 1.410912072774099
Energy: 1.0779433974755197
Energy: 1.1177848497896108
Energy: 1.4536023331840877
Energy: 1.2026728224282577
Energy: 1.352569517319854
Energy: 1.458822032125295
Energy: 1.1480194060195157
Energy: 1.2910967834401543
Energy: 1.5530164797804462
Energy: 1.454766121616106
Energy: 1.4215244599382135
Energy: 1.5543848231466526
Energy: 1.5334196869580137
Energy: 1.39407087517578
Energy: 1.396010354251095
Energy: 1.3947972252556362
Energy: 1.388934963544639
Energy: 1.3960334046362837
Energy: 1.6987238222130012
Energy: 1.7352100779346034
Energy: 1.1478424343351838
Energy: 1.3590412184830565
Energy: 1.30334059237898
Energy: 1.1496626041436642
Energy: 1.3998122142351395
Energy: 1.1458154038484591
Energy: 1.1392321550888849
Energy: 1.3624454514009148
Energy: 1.3472462345121865
Energy: 1.1382127538210989
Energy: 1.4012956486431927
Energy: 1.1890086041085042
Energy: 1.5036164030693533
Energy: 1.2686257076664913
Energy: 1.432014671288792
Energy: 1.435891982454083
Energy: 1.3060846851547279
Energy: 1.3751828451862596
Energy: 1.7827505025972397
Energy: 1.242625192661858
Energy: 1.3442097703492235
Energy: 1.5430313460237575
Energy: 1.4808481953470878
Energy: 1.3276246380484822
Energy: 1.698661083067626
Energy: 1.1993120572263765
Energy: 1.2533926987436392
Energy: 1.7116115394105291
Energy: 1.1996020778440462
Energy: 1.4253475107620674
Energy: 1.7292632224192608
Energy: 1.176791338366232
Energy: 1.1770892304826375
Energy: 1.3461066866717497
Energy: 1.2170536237714105
Energy: 1.277105496338181
Energy: 1.9689854111610643
Energy: 1.1406341044839539
Energy: 1.1419888297679512
Energy: 1.9591467429513794
Energy: 1.1477704871873236
Energy: 1.5601486465969323
Energy: 2.023841134197755
Energy: 1.3413049893481923
Energy: 1.4660998653238784
Energy: 1.3672325988936926
Energy: 1.2736907478179136
Energy: 1.4685695875144344
Energy: 1.3172872558194857
Energy: 1.1395135126947016
Energy: 1.1949112518645557
Energy: 1.3131257585400196
Energy: 1.2168020041363243
Energy: 1.2259459882994124
Energy: 1.048037618682721
Energy: 1.241786071057521
Energy: 1.2555619545045837
Energy: 1.0499138924483447
Energy: 1.21194186245769
Energy: 1.1036991450581248
Energy: 1.1610414950952916
Energy: 1.3643226469940124
Energy: 1.3390373088396796
Energy: 1.1632481468877092
Energy: 1.346778913890457
Energy: 1.2997825224174395
Energy: 1.5193112101561959
Energy: 1.5398651716941865
Energy: 1.539210118248592
Energy: 1.716439622169529
Energy: 1.9521360826886163
Energy: 1.9026556895451643
Energy: 1.3481389543720659
Energy: 1.5148458981017408
Energy: 1.3105847978443885
Energy: 1.3455398205132343
Energy: 1.5291409336454609
Energy: 1.3124426998242686
Energy: 1.1250967105499274
Energy: 1.1425725648126506
Energy: 1.23596660464436
Energy: 1.127016208305964
Energy: 1.0911189699581318
Energy: 1.1805503404496003
Energy: 1.2237743725715815
Energy: 1.0794265888908834
Energy: 1.0858100565442301
Energy: 1.1236195161678204
Energy: 1.1150088344862725
Energy: 1.1387573680310485
Energy: 2.216868825004656
Energy: 1.3513534748636726
Energy: 1.3591870615221484
Energy: 1.5144734150655255
Energy: 1.365738319317791
Energy: 1.3105279626504345

minimum gb energy = 1.0301372902141226 eV
minimum distance =  2.56836089587702 Angstroms
sigma value = 57


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

Energy: 0.9002659337270994
Energy: 0.7753774426824348
Energy: 0.6591895315588757
Energy: 0.5273661578619417
Energy: 0.9866877710294935
Energy: 0.8882983621004389
Energy: 0.9007387956759184
Energy: 0.8496839088944318
Energy: 0.8971642391189785
Energy: 0.8876865455626857
Energy: 0.8318244334301931
Energy: 1.2717418091211763
Energy: 1.216164445079171
Energy: 1.1894640026454069
Energy: 1.2439695144573333
Energy: 1.2109185629807042
Energy: 1.237787671196544
Energy: 1.1922068390004918
Energy: 2.4686623804796657
Energy: 1.2359341336237022
Energy: 1.3091802869597235
Energy: 2.6755672573540417
Energy: 1.8175715557606218
Energy: 1.250813170436282
Energy: 1.102074882889127
Energy: 0.649281928931484
Energy: 0.689394596987759
Energy: 1.0943642419293926
Energy: 0.6493502262975601
Energy: 1.1057632428586182
Energy: 1.0953746514008835
Energy: 0.6493707574712355
Energy: 0.6491291487442314
Energy: 1.1709984014417543
Energy: 0.6586797188318991
Energy: 0.6907536732690519
Energy: 1.1041845120398563
Energy: 1.2418273408407192
Energy: 1.1627326606011246
Energy: 1.096856365200501
Energy: 1.1695976517608708
Energy: 1.2423555928741399
Energy: 1.1978918640646252
Energy: 1.1918784897550976
Energy: 1.8927544683241726
Energy: 1.23079806462828
Energy: 1.9337736418032312
Energy: 1.1737477181057165
Energy: 1.219650594051663
Energy: 1.2214537856895102
Energy: 1.2859846102663586
Energy: 1.1764425155425433
Energy: 1.3105778990269126
Energy: 1.2333000973039434
Energy: 0.7821794772073205
Energy: 1.173390398430372
Energy: 0.7505696074981087
Energy: 0.5241308074185291
Energy: 1.1762344120698212
Energy: 0.8092422631500613
Energy: 0.7735855163879779
Energy: 1.1955375672503166
Energy: 1.288944958013382
Energy: 0.5243106811911021
Energy: 1.2162540496818535
Energy: 0.8135486166954667
Energy: 1.1704183102979397
Energy: 1.212766443813108
Energy: 1.266038025966673
Energy: 1.2678641784186726
Energy: 1.3364217190804508
Energy: 1.2326421130455614
Energy: 2.4081275878532273
Energy: 1.8219399622008643
Energy: 1.8686244684865112
Energy: 2.44942158315391
Energy: 1.9337930023252636
Energy: 1.8207384440161194
Energy: 1.1430317745541103
Energy: 1.0491316333882414
Energy: 0.9591616225565548
Energy: 1.1123336605054894
Energy: 1.113501228753519
Energy: 1.1069117223566194
Energy: 1.0882216935949665
Energy: 0.6491874687788743
Energy: 0.6493441472564818
Energy: 1.0063437537871145
Energy: 0.6534570345821832
Energy: 0.8457871109224974
Energy: 1.0548470790891855
Energy: 1.1020271070427745
Energy: 1.1270029044884682
Energy: 1.061912375895205
Energy: 0.6494145627821925
Energy: 1.1028259014684347
Energy: 1.2089733708690695
Energy: 1.1872407765388695
Energy: 1.257640607030958
Energy: 1.2716731526287115
Energy: 1.2761443628129432
Energy: 1.1837552961188131
Energy: 1.2170792186711912
Energy: 1.2275002339833851
Energy: 1.1424085741906325
Energy: 1.0363996813377694
Energy: 1.8688755900084542
Energy: 1.225424213419416
Energy: 0.9011945326691777
Energy: 0.8446485739639118
Energy: 0.8959274604123746
Energy: 0.5244346842133882
Energy: 0.8454973505077508
Energy: 0.9847977720528663

minimum gb energy = 0.5241308074185291 eV
minimum distance =  2.53350783502035 Angstroms
sigma value = 11


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

Energy: 1.7781277007422176
Energy: 1.7871432721229468
Energy: 1.5236873029109081
Energy: 1.7814212349592355
Energy: 2.101058895865301
Energy: 1.638291383054421
Energy: 1.4989724601023093
Energy: 0.9475849904027626
Energy: 0.973667634685707
Energy: 1.010124747920056
Energy: 0.9058549924021614
Energy: 0.9829504906405222
Energy: 0.9262641595825845
Energy: 0.9463150626772996
Energy: 0.990684937327706
Energy: 0.924798046042599
Energy: 0.9545918820785394
Energy: 1.0314228134703158
Energy: 0.9494182846546789
Energy: 0.9905859264246205
Energy: 1.0213123200788825
Energy: 0.9516318118505477
Energy: 0.9088776332683808
Energy: 1.007979727845815
Energy: 1.1682021264080564
Energy: 1.4079108314522388
Energy: 1.387708598005849
Energy: 1.1151588637551397
Energy: 1.4239937140984522
Energy: 1.1547588974136176
Energy: 1.2901218211745031
Energy: 1.5827911761454734
Energy: 1.5608867497516232
Energy: 1.3929501826178214
Energy: 1.5810607152528382
Energy: 1.6779212705957596
Energy: 1.1649662434107155
Energy: 1.1798440599029587
Energy: 1.0811244968102154
Energy: 0.9560634290070807
Energy: 1.1803283610384359
Energy: 0.9388995027681605
Energy: 1.036157443294349
Energy: 1.0083385873923476
Energy: 1.063453482746732
Energy: 1.0391137684315666
Energy: 0.94788766411955
Energy: 1.1393607699532797
Energy: 1.4871379081232936
Energy: 0.9746190836143634
Energy: 1.0172661870972937
Energy: 1.1740254473955254
Energy: 0.9714650231600258
Energy: 1.0097676422073811
Energy: 1.5623029367975212
Energy: 1.5359370697326182
Energy: 1.4237842619988559
Energy: 1.5654679402927714
Energy: 1.5428885331043656
Energy: 1.5156972862741749
Energy: 1.9497721609576804
Energy: 1.5336801792205954
Energy: 1.3836645441688993
Energy: 1.5220502722982805
Energy: 1.7205524735966955
Energy: 1.4585574400280488
Energy: 1.3233917668053947
Energy: 1.191538989927913
Energy: 1.2552251377011472
Energy: 1.3241904793509363
Energy: 1.2415925452196936
Energy: 1.298095525579029
Energy: 1.1263542078009006
Energy: 1.1855114798671569
Energy: 1.1908825004253025
Energy: 1.1060338864475003
Energy: 1.23684086115458
Energy: 1.1677019221153124
Energy: 1.1406872153977394
Energy: 1.1465031313821878
Energy: 1.1262575029166813
Energy: 1.140946638551686
Energy: 1.4891651236123986
Energy: 1.0659123370273416
Energy: 1.398157315951868
Energy: 1.4004073056350521
Energy: 1.3106727297518033
Energy: 1.3987977707875774
Energy: 1.4188278084344788
Energy: 1.5211970965338395
Energy: 1.5950861074651945
Energy: 1.3480523370153796
Energy: 1.3449210220697532
Energy: 1.5917971026652609
Energy: 1.3998513031714295
Energy: 1.3940158315655526
Energy: 1.3527291270864512
Energy: 1.456921174265485
Energy: 1.3869436097880645
Energy: 1.3554309810172285
Energy: 1.4356753651971526
Energy: 1.4465483731815356
Energy: 1.7987681255041956
Energy: 1.237183362294566
Energy: 1.2054767431340625
Energy: 1.3544161945035273
Energy: 1.2348763729656704
Energy: 1.16950802840816
Energy: 1.6573958703845932
Energy: 1.1098820956995896
Energy: 1.134635067254492
Energy: 1.1762588874948539
Energy: 1.108908805370327
Energy: 1.185718900880652
Energy: 1.1848552687633425
Energy: 1.2246838655352517
Energy: 1.2848241738665231
Energy: 1.1807891323685151
Energy: 1.1719042318055783
Energy: 1.331327156683202
Energy: 1.5965359953801301
Energy: 1.3080892502780122
Energy: 1.3739806684241056
Energy: 1.5984783154674023
Energy: 1.409719809798247
Energy: 1.4030025026345763
Energy: 1.6852393086635942
Energy: 1.5028868601279606
Energy: 1.4117382553613305
Energy: 1.6859357927995209
Energy: 1.512057565818407
Energy: 1.6128012450513254
Energy: 0.9725675143048798
Energy: 1.1340010042787645
Energy: 1.0686947827544298
Energy: 0.9708852182796059
Energy: 1.5165695294137094
Energy: 0.9915740462329193
Energy: 0.9673564075083085
Energy: 1.0963188224989746
Energy: 1.1301786388348651
Energy: 0.9701600640830472
Energy: 1.1227858657340912
Energy: 1.0345662484329547
Energy: 0.9580424632890825
Energy: 1.0800381473992127
Energy: 1.0947630032474658
Energy: 0.9601679985407477
Energy: 1.1206779555077013
Energy: 1.1274842591136958
Energy: 2.148678100670506
Energy: 1.3168367556838163
Energy: 1.1645387312111368
Energy: 1.7254250915713534
Energy: 1.353745717100124
Energy: 1.3789417511302378

minimum gb energy = 0.9058549924021614 eV
minimum distance =  2.52891877403298 Angstroms
sigma value = 41


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

Energy: 1.698482345032445
Energy: 1.6094209631820395
Energy: 1.6099569929302637
Energy: 1.7014291335276646
Energy: 1.8443146085398383
Energy: 1.3973838155004776
Energy: 1.3550037542918842
Energy: 1.0170088417501455
Energy: 1.0177182486190728
Energy: 1.1313293420864081
Energy: 0.985685685492779
Energy: 1.0849621795466107
Energy: 1.023807237436056
Energy: 1.0234938501127928
Energy: 1.0807094138837812
Energy: 1.0257043834601902
Energy: 1.0491573972955088
Energy: 1.0989050276432373
Energy: 1.0476363605538552
Energy: 1.0547054188682623
Energy: 1.0943594536214871
Energy: 1.0494441416818938
Energy: 0.9637879246425378
Energy: 1.0586042762238965
Energy: 1.2473315039579393
Energy: 1.4729884078425548
Energy: 1.4731146080074053
Energy: 0.9841360583121075
Energy: 1.2689481830973917
Energy: 1.1947623307209116
Energy: 1.21554902372849
Energy: 1.6436621311153063
Energy: 1.4572482854979723
Energy: 1.3755019552290593
Energy: 1.643602806209562
Energy: 1.458050794551744
Energy: 1.3698851220969488
Energy: 1.1919254385327462
Energy: 1.2822148629547434
Energy: 1.047452175012002
Energy: 1.2444994653618493
Energy: 1.2788140006810294
Energy: 1.1869750020774963
Energy: 1.0782912521203671
Energy: 1.1458145237439965
Energy: 1.1899243589131934
Energy: 1.0916734727311677
Energy: 1.196826301357931
Energy: 1.6757435933614317
Energy: 1.0358105977489513
Energy: 1.0343076571362013
Energy: 1.4951439113818485
Energy: 1.0377854288623753
Energy: 1.1192390120739588
Energy: 1.4347318630364623
Energy: 1.3754304568026803
Energy: 1.4370522274519069
Energy: 1.4375750011026678
Energy: 1.3748323297642948
Energy: 1.4138252157353788
Energy: 1.431936087935401
Energy: 1.4573285948156065
Energy: 1.3446776347568796
Energy: 1.4282455182620792
Energy: 1.4748248407617002
Energy: 1.3460271598830298
Energy: 1.4795283892046034
Energy: 1.3660555699511105
Energy: 1.3120434063468251
Energy: 1.4802620881875588
Energy: 1.4700428888614336
Energy: 1.3547574501658564
Energy: 1.3032800772925508
Energy: 1.366053606234493
Energy: 1.3117684480013951
Energy: 1.3114596946781845
Energy: 1.4703672216691277
Energy: 1.3042804464572262
Energy: 1.0354994136026552
Energy: 1.1529111716355365
Energy: 1.1039135071800525
Energy: 1.036648814442209
Energy: 1.0565282850229114
Energy: 1.0715501793874114
Energy: 1.0484922929249298
Energy: 1.395822812750187
Energy: 1.2774213723464305
Energy: 1.0493401905950772
Energy: 1.385491059505902
Energy: 1.2137799555463393
Energy: 1.2964393172419344
Energy: 1.0207592161640444
Energy: 1.0252365537997445
Energy: 1.284697501090385
Energy: 1.3553759429854992
Energy: 1.061898812179486
Energy: 1.7016735113547363
Energy: 1.5016687533533766
Energy: 1.6282343781877502
Energy: 1.704034461740918
Energy: 1.5015070687580911
Energy: 1.3328065351487717
Energy: 2.2115694235109986
Energy: 1.1359516858093195
Energy: 1.1707554081962832
Energy: 1.5540220809647454
Energy: 0.9857133504758406
Energy: 1.2842134207429807
Energy: 1.0247007235027228
Energy: 1.025192354353662
Energy: 1.0821074274974276
Energy: 0.9993900566719818
Energy: 1.0477431961737305
Energy: 1.0798972745339235
Energy: 1.057583105097779
Energy: 1.0722130619252734
Energy: 1.0615637883289082
Energy: 1.0505412230510605
Energy: 1.0039354020086804
Energy: 1.0437786707180177
Energy: 1.04473261198317
Energy: 1.1811439786548736
Energy: 1.0474810829298586
Energy: 0.9839461427972493
Energy: 1.1339944703007192
Energy: 1.0477024813531564
Energy: 1.51311798562586
Energy: 1.643719781131475
Energy: 1.6109409329496203
Energy: 1.5280507899363964
Energy: 1.7272865716646482
Energy: 1.4542001730889638
Energy: 1.4566751474032
Energy: 1.140319954927322
Energy: 1.2822187530278402
Energy: 1.0446951648852163
Energy: 1.306963940160993
Energy: 1.28022536033313
Energy: 1.1850353473559863
Energy: 1.1146698608827876
Energy: 1.146361671933886
Energy: 1.187674420439425
Energy: 1.0694872801894264
Energy: 1.1054530121975061
Energy: 1.7321048530403484
Energy: 1.0359698964267259
Energy: 1.073208092762067
Energy: 1.0540808200972582
Energy: 1.0365500579401765
Energy: 1.1039031872388507
Energy: 1.4301826392243593
Energy: 1.3119349496703507
Energy: 1.380525076435435
Energy: 1.4282863439381355
Energy: 1.036265574801289
Energy: 1.3548090861555484
Energy: 1.435388723172538
Energy: 1.4531157200061986
Energy: 1.4019100432721594
Energy: 1.4291295156749977
Energy: 1.4085563014123677
Energy: 1.5471518202183796
Energy: 1.7395956327370556
Energy: 1.1094027601830407
Energy: 1.0965250102534159
Energy: 1.7202666470096546
Energy: 0.9507656054361643
Energy: 1.258608417658316
Energy: 1.3917045959997887
Energy: 1.4820873109302044
Energy: 1.3538332490572162
Energy: 1.3935815268360003
Energy: 1.4762461543823628
Energy: 1.28647985396824
Energy: 1.0369816425915002
Energy: 1.2504245468494244
Energy: 1.071820949857158
Energy: 1.0361085158477723
Energy: 1.1738575143118353
Energy: 1.0718823317397148
Energy: 1.0318328118494144
Energy: 1.2829776100893975
Energy: 1.1872789535413029
Energy: 1.0284912923062048
Energy: 1.3189208445325142
Energy: 1.1873594112390284
Energy: 1.0563666354696395
Energy: 1.0348489430411443
Energy: 1.03662036743396
Energy: 1.0528127684947666
Energy: 0.9861514671092269
Energy: 1.0623918485646966
Energy: 1.7139045462969194
Energy: 1.3016686909133417
Energy: 1.455667728044997
Energy: 1.7156248703031494
Energy: 1.2925598084512704
Energy: 1.576859833580523

minimum gb energy = 0.9507656054361643 eV
minimum distance =  2.50691007024462 Angstroms
sigma value = 33


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

Energy: 1.3328673924859382
Energy: 1.3724263663353224
Energy: 1.3725230823872399
Energy: 1.3354278713070575
Energy: 1.7715569496214782
Energy: 1.6311801732492148
Energy: 1.8814793819905962
Energy: 1.1059506629139306
Energy: 1.1038662478017232
Energy: 1.513084590261748
Energy: 1.071108645193973
Energy: 1.1459627135031103
Energy: 1.1312950264525492
Energy: 1.1049937952457678
Energy: 1.0959372296114258
Energy: 1.1331655195171901
Energy: 1.1602046078350245
Energy: 1.2161195146863304
Energy: 1.1519059095896933
Energy: 1.1729999228394652
Energy: 1.082259252544475
Energy: 1.153435422691406
Energy: 1.0360897193500656
Energy: 1.1364808375994864
Energy: 1.0647311197539553
Energy: 1.3974837665403403
Energy: 1.1430540048043087
Energy: 1.072151405995205
Energy: 1.4468110360513606
Energy: 1.1336219969281367
Energy: 1.3770613545628867
Energy: 1.5295863036751418
Energy: 1.342979872540055
Energy: 1.310297538056364
Energy: 1.7215333220695312
Energy: 1.186434309674572
Energy: 1.2856781812908997
Energy: 1.09689219815458
Energy: 1.3641516720795914
Energy: 1.1589882919009769
Energy: 1.1562083077104488
Energy: 1.3628527604137068
Energy: 1.3341968598784004
Energy: 1.1545943788112456
Energy: 1.1598565143901505
Energy: 1.3374478645618733
Energy: 1.2119096641822906
Energy: 1.306468212032181
Energy: 1.4897254291387119
Energy: 1.0320756188093683
Energy: 1.0250565697556595
Energy: 1.565839692586458
Energy: 1.0264678095329083
Energy: 1.0710758711565882
Energy: 1.7023209890396465
Energy: 1.211335774563809
Energy: 1.1906401248857936
Energy: 1.5135332731751776
Energy: 1.149900212195381
Energy: 1.1887083088174644
Energy: 1.5076552825387397
Energy: 1.309090309159363
Energy: 1.4029113434339455
Energy: 1.0560808502311196
Energy: 1.237495505580087
Energy: 1.364677744622927
Energy: 1.2495886028899668
Energy: 1.6153857787489672
Energy: 1.4165291342403161
Energy: 1.2514689486397348
Energy: 1.3537273399578902
Energy: 1.415946555700651
Energy: 1.2576765582490257
Energy: 1.688693060772896
Energy: 1.6155090577639457
Energy: 1.2583222065096495
Energy: 1.6885673698741968
Energy: 1.4183079451068867
Energy: 1.0647944101448212
Energy: 1.091029436627508
Energy: 1.1705655888588267
Energy: 1.0664049736930885
Energy: 1.093822638669068
Energy: 1.1085400679944655
Energy: 0.9537725654312366
Energy: 1.2296879415241244
Energy: 1.2427384533553627
Energy: 1.1991761341557672
Energy: 1.154704368052304
Energy: 1.1741567891517575
Energy: 1.0278431579291052
Energy: 1.1056885851078184
Energy: 1.108436487720168
Energy: 1.0196238086172515
Energy: 1.1643765135439774
Energy: 1.1487187510884542
Energy: 1.7179462466020676
Energy: 1.6814620497874737
Energy: 1.3210073467089232
Energy: 1.7198117684564591
Energy: 1.6726266368487048
Energy: 1.4816377568142767
Energy: 1.8703054482883454
Energy: 1.2590696429828547
Energy: 1.1295931005214646
Energy: 1.6573510979732256
Energy: 1.324608930084281
Energy: 1.1267900240218123
Energy: 1.0349140354969362
Energy: 1.3401818602855555
Energy: 1.2236065561664609
Energy: 1.0365139242770394
Energy: 1.3112938800372123
Energy: 1.2497955168502919
Energy: 1.1288214752489216
Energy: 1.1845407819562155
Energy: 1.1488739478366756
Energy: 1.130396073729882
Energy: 1.3116656379577913
Energy: 1.1913240994565784
Energy: 1.0274275541872675
Energy: 1.2664327230644217
Energy: 1.0618079046888778
Energy: 1.0291472939911224
Energy: 1.168423696964839
Energy: 1.0631677942114253
Energy: 1.1977484457749379
Energy: 1.553128654603762
Energy: 1.5098524238876874
Energy: 1.1992106636732498
Energy: 1.537215804817809
Energy: 1.262745549427542
Energy: 1.4039261198071187
Energy: 1.1080517094168718
Energy: 1.3574732946817514
Energy: 1.4683514095224304
Energy: 1.0684279983653509
Energy: 1.4028172049419723
Energy: 1.3348065961763418
Energy: 1.3124979965258934
Energy: 1.3474933135240788
Energy: 2.104524800522129
Energy: 1.3180575649002289
Energy: 1.3481732583682975
Energy: 1.886621268451406
Energy: 1.0652330161095485
Energy: 1.1033422428975597
Energy: 1.4528191568024358
Energy: 1.075642520108517
Energy: 1.1415773769492705
Energy: 1.1261271679221097
Energy: 1.099961207177162
Energy: 1.1008241516914576
Energy: 1.1279604659820388
Energy: 1.0997981470101028
Energy: 1.1969436986426294
Energy: 1.153204422256494
Energy: 1.1814011734403247
Energy: 1.083432348710125
Energy: 1.1551086088397187
Energy: 1.0713392558198258
Energy: 1.1341325725429148
Energy: 1.2264425565464938
Energy: 1.3678214328230254
Energy: 1.1341834878641188
Energy: 1.0760393449989265
Energy: 1.4983674485531966
Energy: 1.1372830775673903
Energy: 1.7210400468015992
Energy: 1.6403417022086109
Energy: 1.3735472436876617
Energy: 1.723008543993444
Energy: 1.7200748973031783
Energy: 1.2235254494866288
Energy: 1.284078995942592
Energy: 1.1507567495318614
Energy: 1.363961192979254
Energy: 1.3071433299638338
Energy: 1.153472232577805
Energy: 1.3623639345301406
Energy: 1.333748394697927
Energy: 1.1805573825258378
Energy: 1.0875551820693024
Energy: 1.3369896177295029
Energy: 1.1832651266547702
Energy: 1.120992298002964
Energy: 1.8763122495760947
Energy: 1.0258489345575956
Energy: 1.0237405562106459
Energy: 1.1822374910087754
Energy: 1.0292652578510082
Energy: 1.0982008839212858
Energy: 1.4829695128538636
Energy: 1.1246133335157102
Energy: 1.188084970524638
Energy: 1.43618566750755
Energy: 1.131657687454076
Energy: 1.1879273677258229
Energy: 1.5999217734860391
Energy: 1.2413121777852854
Energy: 1.4207659288611878
Energy: 1.529525054518552
Energy: 1.1735226970154036
Energy: 1.3673731181911608
Energy: 1.4631340992149786
Energy: 1.0284809370917056
Energy: 1.3568226307091658
Energy: 1.260015032603929
Energy: 1.0236167583631723
Energy: 1.2744021554750156
Energy: 1.29600025954999
Energy: 1.690428527416225
Energy: 1.2918663245425956
Energy: 1.298319114861374
Energy: 1.7084225087398062
Energy: 1.4219493386571533
Energy: 1.0637197855079379
Energy: 1.1749693512216846
Energy: 1.1805328833307915
Energy: 1.065166063428802
Energy: 1.0922432345264743
Energy: 1.1087653930283563
Energy: 0.9709905567808815
Energy: 1.2264727253166852
Energy: 1.2241373008626963
Energy: 0.9703788582061069
Energy: 1.1539752418458653
Energy: 1.3478871729770616
Energy: 1.025616473352744
Energy: 1.1669788809427797
Energy: 1.1334670375024671
Energy: 1.0272322486599694
Energy: 1.1614659236220335
Energy: 1.1379902795557706
Energy: 1.7011237200968623
Energy: 1.338901491532396
Energy: 1.2173316620989834
Energy: 1.7036698007629465
Energy: 1.3444569168701226
Energy: 1.4073343784834016
Energy: 1.703526292317939
Energy: 1.1660104601031915
Energy: 1.2310193763343322
Energy: 1.510119965093833
Energy: 1.3377590387738618
Energy: 1.2978706329653227
Energy: 1.0324227527675343
Energy: 1.342415748995342
Energy: 1.1406261390260877
Energy: 1.0339550204383217
Energy: 1.3130785725422114
Energy: 1.1296401738873851
Energy: 1.2093905097641175
Energy: 1.360501005313135
Energy: 1.2406596803287377
Energy: 1.211101243863904
Energy: 1.3289475051994926
Energy: 1.0980511132739754
Energy: 1.023617664826809
Energy: 1.09487312453212
Energy: 1.0617531963058418
Energy: 1.0252894794335443
Energy: 1.1730205174293085
Energy: 1.0646853427732579
Energy: 1.2218639039092523
Energy: 1.6190128977179687
Energy: 1.3895037135881694
Energy: 1.2238938580270842
Energy: 1.6169132288024881
Energy: 1.2357622456130395
Energy: 1.4016834996696999
Energy: 1.1044289922848733
Energy: 1.2972554426619503
Energy: 1.4020500044760689
Energy: 1.0672036283991828
Energy: 1.3609250729910167
Energy: 2.1172230238715897
Energy: 1.3147908849717835
Energy: 1.3518569607103008
Energy: 1.911497605218196
Energy: 1.3111482872716766
Energy: 1.4175315257351955

minimum gb energy = 0.9537725654312366 eV
minimum distance =  2.55039980535298 Angstroms
sigma value = 67


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

Energy: 1.540999507479974
Energy: 0.9842957079143307
Energy: 1.1357267385748913
Energy: 1.5460095366348692
Energy: 1.472057422654279
Energy: 1.52821629919957
Energy: 1.4895737796532327
Energy: 0.9762026231910269
Energy: 1.0315861505904655
Energy: 1.1836048886332955
Energy: 0.9862246852306886
Energy: 0.8840154938930701
Energy: 1.2597684715824697
Energy: 0.9537793156251897
Energy: 1.1191219861337287
Energy: 1.2613485580516095
Energy: 0.953676405472181
Energy: 1.394655124680394
Energy: 1.2742894731252095
Energy: 1.1201870121644208
Energy: 1.2497939240397686
Energy: 1.2328783707134265
Energy: 1.0884644453156045
Energy: 1.1208024477213574
Energy: 1.2905228003392133
Energy: 1.252849841385058
Energy: 1.2494049749521046
Energy: 1.3079979091281255
Energy: 1.0296228757351045
Energy: 1.121823906986858
Energy: 1.307045085107832
Energy: 1.2543728304887507
Energy: 1.4598993886392653
Energy: 1.3077353142817507
Energy: 1.1806784942013637
Energy: 1.4595981761960448
Energy: 1.4885451905159075
Energy: 1.2225629766267736
Energy: 1.2512608693898675
Energy: 1.4907809672536707
Energy: 1.068952899598382
Energy: 1.0317537713864453

minimum gb energy = 0.8840154938930701 eV
minimum distance =  2.5954606645366 Angstroms
sigma value = 3


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

Energy: 2.004979528750446
Energy: 1.6937847032454987
Energy: 1.3876459767541276
Energy: 2.02625961752164
Energy: 1.7464662399734858
Energy: 1.5497100899370029
Energy: 1.523537182130442
Energy: 1.4354141590195637
Energy: 1.4322457599670604
Energy: 1.3038269263708198
Energy: 1.432875403084397
Energy: 1.465914680945905
Energy: 1.4649422268745511
Energy: 1.5108834474646577
Energy: 1.4954493754190132
Energy: 1.3735200474951708
Energy: 1.638981132291341
Energy: 1.5276838284654035
Energy: 1.0384907676248802
Energy: 1.4785357598617934
Energy: 1.278877360053829
Energy: 0.9892277627416524
Energy: 1.5979820859236062
Energy: 1.0391326859036014
Energy: 1.169344341593577
Energy: 1.4169834668192418
Energy: 1.3077535209144948
Energy: 1.0961558717714848
Energy: 1.4031677081064304
Energy: 1.1693225800733793
Energy: 1.374380228411972
Energy: 1.4156524698285275
Energy: 1.4107951218654378
Energy: 1.3093943829211026
Energy: 1.4885988508348351
Energy: 1.4670026639523959
Energy: 1.5929239610738701
Energy: 1.2933629931384107
Energy: 1.2352055745362591
Energy: 1.194356346898099
Energy: 1.2896189332144712
Energy: 1.3072403867367621
Energy: 1.860011298489308
Energy: 1.6411633610890601
Energy: 1.3665471663492363
Energy: 1.8818179286004648
Energy: 1.6358966414446208
Energy: 1.5441772231467306
Energy: 1.5009887746443977
Energy: 1.504781773928435
Energy: 1.540327042251248
Energy: 1.3022183648612555
Energy: 1.5394153705135152
Energy: 1.5403725097469068
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Energy: 1.621636760945759
Energy: 1.4946635850802577
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Energy: 1.6431585907671047
Energy: 1.2618633935353856
Energy: 1.4926655714182846
Energy: 1.293851747413941
Energy: 1.2363729786715631
Energy: 1.4453746152247384
Energy: 1.2008357101150224
Energy: 1.5055302508464645
Energy: 1.4332806626370123
Energy: 1.4344719439895541
Energy: 1.4640023765014356
Energy: 1.420995768897591
Energy: 1.4004573680150054
Energy: 1.4937949724028226
Energy: 1.1906369321838235
Energy: 1.208756050526317
Energy: 1.4600563519279446
Energy: 1.1684023413074358
Energy: 1.434198791540903
Energy: 1.5924997852027887
Energy: 0.9851335545159848
Energy: 1.0061880386785655
Energy: 1.56706052766677
Energy: 0.982588924047321
Energy: 1.006472715096721
Energy: 1.6287508502381594
Energy: 1.32875689521303
Energy: 1.494747906097201
Energy: 1.6263732461349696
Energy: 1.1264300687954543
Energy: 1.5190274635280558
Energy: 1.5779097356891014
Energy: 1.1160661687871203
Energy: 1.4809450824644106
Energy: 1.4716650897770094
Energy: 1.3289425810806759
Energy: 1.542097383038513
Energy: 1.6223789116908727
Energy: 1.6432936251582166
Energy: 1.5411549247206813
Energy: 1.5973870868448117
Energy: 1.9931140189958636
Energy: 1.6383270037813924
Energy: 1.5501221151726017
Energy: 1.3937735529508937
Energy: 1.1411973652333731
Energy: 1.5516209480397332
Energy: 1.1309801040604088
Energy: 1.4359761380272689
Energy: 1.9722457011793497
Energy: 1.5574482468397541
Energy: 1.5638671182041706
Energy: 1.7404941140460701
Energy: 1.4711987594049463
Energy: 1.533572783144553
Energy: 1.9002803455395025
Energy: 1.0954361071642953
Energy: 1.0826734555013657
Energy: 1.6560486255709748
Energy: 1.0916602815903667
Energy: 1.2684596834394608
Energy: 1.5756632496400156
Energy: 1.113426868878046
Energy: 1.187043775213298
Energy: 1.3979411820435699
Energy: 1.1738957338538931
Energy: 1.1896641925876843
Energy: 1.3632412777307523
Energy: 1.438984697791189
Energy: 1.5097816454443052
Energy: 1.365567880728108
Energy: 1.4299033825462042
Energy: 1.4673903762972764
Energy: 1.136722926333212
Energy: 1.2488943854832908
Energy: 1.1352312094460102
Energy: 1.0963512015046137
Energy: 1.1191205895958982
Energy: 1.1452762799545033
Energy: 1.2345970758004892
Energy: 1.6154377986368762
Energy: 1.5155662059895718
Energy: 1.2364575495418964
Energy: 1.7824421059299707
Energy: 1.4857432432270772
Energy: 1.5282803334463901
Energy: 1.4196830763677897
Energy: 1.4962537557419375
Energy: 1.5384721599836606
Energy: 1.432372350661635
Energy: 1.4903919382422564
Energy: 2.008558555156549
Energy: 1.5099664650076225
Energy: 1.5262025826656436
Energy: 1.5541710536700002
Energy: 1.5057535829908109
Energy: 1.494595577895973
Energy: 1.7662740579369507
Energy: 1.4374887040615891
Energy: 1.4261721662405016
Energy: 1.603405749538968
Energy: 1.4364254608616205
Energy: 1.3897659438964045
Energy: 1.5124743053157799
Energy: 1.4531894602414825
Energy: 1.4241884890659977
Energy: 1.5153812385031147
Energy: 1.5095465510779853
Energy: 1.426424865486864
Energy: 1.1745165710408936
Energy: 1.5130640634696502
Energy: 1.5729164861279625
Energy: 1.1578181628680306
Energy: 1.6548555468177273
Energy: 1.4375851381919817
Energy: 1.034305511473471
Energy: 1.3138839630915051
Energy: 1.0214951185977783
Energy: 1.0368286830169968
Energy: 1.4368559885251404
Energy: 1.021326293018943
Energy: 1.218115523032661
Energy: 1.4397444018723857
Energy: 1.5396156642950494
Energy: 1.2199053782056593
Energy: 1.5804479795433115
Energy: 1.445801396079231
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Energy: 1.354709270729521
Energy: 1.3294887896787186
Energy: 1.5214954611341347
Energy: 1.2954590675007591
Energy: 1.3569610983558849
Energy: 1.963241635514873
Energy: 1.2878007143306118
Energy: 1.3040093208615005
Energy: 1.8202954948691485
Energy: 1.3010051337258424
Energy: 1.5472907882802314
Energy: 1.6767176810435995
Energy: 1.5569800122895012
Energy: 1.5837087232069988
Energy: 1.6031932807906628
Energy: 1.5175406924966592
Energy: 1.583538104876393
Energy: 1.5539521289257634
Energy: 1.469871128364916
Energy: 1.5094284031603526
Energy: 1.537007398617225
Energy: 1.4453503921597137
Energy: 1.539836097964927
Energy: 1.3805605211939247
Energy: 1.6139241505846478
Energy: 1.5564654219072769
Energy: 1.3817575931411663
Energy: 1.714337261644894
Energy: 1.3755822023295685
Energy: 1.3536604428855428
Energy: 1.3606093761042757
Energy: 1.3060308711211424
Energy: 1.3298918790927552
Energy: 1.294066684798907
Energy: 1.3146119285115
Energy: 1.5107187447451005
Energy: 1.2062955915813078
Energy: 1.4018771967096781
Energy: 1.5134142555026302
Energy: 1.2296044269462327
Energy: 1.5246098659022291
Energy: 1.6067185810401672
Energy: 0.985929504557741
Energy: 1.0828190882065252
Energy: 1.6092717241303722
Energy: 0.9832462190443881
Energy: 1.0860770037329004
Energy: 1.6083610403419077
Energy: 1.1155611553434055
Energy: 1.1121979845972785
Energy: 1.6251204577729392
Energy: 1.132456451611716
Energy: 1.4228296856672802
Energy: 1.7224298349883256
Energy: 1.4925500247433816
Energy: 1.5356734758036887
Energy: 1.6642540913980113
Energy: 1.424145454409629
Energy: 1.4960791109440523
Energy: 1.5825114634030728
Energy: 1.550041861321615
Energy: 1.4844436214907966
Energy: 1.4845901888059652
Energy: 1.9424838485198208
Energy: 1.3046231595765991
Energy: 1.696971391530838
Energy: 1.6410067738100993
Energy: 1.5408689560514182
Energy: 1.669714530022242
Energy: 1.7964356488075373
Energy: 1.6601714341000382
Energy: 1.654517015218061
Energy: 1.6163980066309405
Energy: 1.5454713636377417
Energy: 1.5408788359601686
Energy: 1.557523853745232
Energy: 1.5495555760570303
Energy: 1.7436337291318504
Energy: 1.20437831096879
Energy: 1.2853569748024871
Energy: 1.7518971769555387
Energy: 1.2040416103529874
Energy: 1.475361702240161
Energy: 1.5997063286030782
Energy: 1.0928229370360265
Energy: 1.089228144376692
Energy: 1.4162219280994874
Energy: 1.089895067514651
Energy: 1.088049935762315
Energy: 1.415358009627533
Energy: 1.3206570561492312
Energy: 1.3819836228177944
Energy: 1.4113899045854805
Energy: 1.3335692398104302
Energy: 1.4887366349755844
Energy: 1.2464871174804517
Energy: 1.3548274523666253
Energy: 1.3162072140815004
Energy: 1.1650503399884422
Energy: 1.330537545370037
Energy: 1.2640080194218124
Energy: 1.1203424031448035
Energy: 1.5918891353779114
Energy: 1.2985877451177243
Energy: 1.1223766277791474
Energy: 1.6307838824065908
Energy: 1.0631063619188987
Energy: 1.6046977302918142
Energy: 1.5564696716661963
Energy: 1.4601314287038294
Energy: 1.4721312184152167
Energy: 1.6446248007736863
Energy: 1.616335102570844
Energy: 1.6421479693824863
Energy: 1.5436489954974448
Energy: 1.4375383337192997
Energy: 1.0688205606347672
Energy: 1.5073280670137121
Energy: 1.5167881404382242

minimum gb energy = 0.982588924047321 eV
minimum distance =  2.53622555657305 Angstroms
sigma value = 81


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

Energy: 1.943293590097625
Energy: 0.9771780926499483
Energy: 0.97446741407657
Energy: 1.9501235187608015
Energy: 1.516155749155389
Energy: 1.6023695225516577
Energy: 1.6409137024160347
Energy: 0.9613474707335042
Energy: 0.9609989782355828
Energy: 0.9617770892308237
Energy: 0.9613349434597783
Energy: 0.9795285883064955
Energy: 1.2736212576534176
Energy: 1.2505560022871942
Energy: 1.3128310901615745
Energy: 1.244193673530196
Energy: 1.2565365736243372
Energy: 1.5349306741918824
Energy: 1.1171268289669145
Energy: 1.0816903629159564
Energy: 1.0707011415212444
Energy: 0.9789299422141263
Energy: 1.2660347095510802
Energy: 0.9504055278322214
Energy: 0.9601863271796989
Energy: 1.3412199442745019
Energy: 1.3074773230940393
Energy: 0.9602221766193175
Energy: 1.3401245184587154
Energy: 1.0614754840617187
Energy: 1.3136654995349561
Energy: 1.341017097160539
Energy: 1.341371505513394
Energy: 1.3159044954336228
Energy: 1.3401899825711747
Energy: 1.3415961505450928
Energy: 1.2266991705667
Energy: 0.9613924899686809
Energy: 0.9617644622243788
Energy: 1.0999840039570523
Energy: 0.9622841985569923
Energy: 1.2359388042885733
Energy: 1.6551901477695115
Energy: 1.5631974244102775
Energy: 1.752793582304248
Energy: 1.656208925222078
Energy: 1.5618672483225111
Energy: 1.2100388892679426
Energy: 1.2244634667540997
Energy: 0.9612358610316654
Energy: 1.2313851804677445
Energy: 1.22592406591123
Energy: 0.9637472505706564
Energy: 1.4872430177147398
Energy: 1.2179706136442505
Energy: 1.4997966983528332
Energy: 1.4995844519262418
Energy: 1.1909161949028415
Energy: 1.4989686892074354
Energy: 1.2274249521358183
Energy: 0.9687227208591432
Energy: 1.482443190510458
Energy: 1.2079945544188166
Energy: 0.9617492381166106
Energy: 1.649041232688912
Energy: 1.0610576337449533
Energy: 1.289704208414839
Energy: 1.3187437639677013
Energy: 1.317624617654356
Energy: 1.292822863565185
Energy: 1.2936676265678109
Energy: 1.314683477167193
Energy: 1.253954564660022
Energy: 1.1023428440803866
Energy: 1.0622976655941898
Energy: 1.2560782472041754
Energy: 1.1399765138259081
Energy: 1.3194147375929148
Energy: 1.3163401875620617
Energy: 0.9551157522675298
Energy: 1.0627600980101912
Energy: 1.311907113026199
Energy: 0.9611942345673755
Energy: 1.0573570435725095
Energy: 1.6083654551909172
Energy: 1.4046572324675033
Energy: 1.4813017274547513
Energy: 1.6102329910363338
Energy: 1.3606037024856443
Energy: 1.3415364659952542
Energy: 1.2965308293338542
Energy: 1.0710760421082828
Energy: 1.3252984832331087
Energy: 1.2987759770480105
Energy: 1.1846707460741521
Energy: 1.3293786263307945
Energy: 1.5443795758729821
Energy: 1.6078713592273721
Energy: 1.473705611879424
Energy: 1.5437863486804502
Energy: 1.6569167459856355
Energy: 1.212548626210579
Energy: 1.171600376319959
Energy: 1.2320315859083049
Energy: 1.490405595846999
Energy: 1.1841417490163315
Energy: 1.1017023043933794
Energy: 1.232875045719894
Energy: 1.6501286108636681
Energy: 1.1932316293586662
Energy: 1.228348021746662
Energy: 1.6432241279253426
Energy: 1.1934129958606896
Energy: 1.2266603374572933
Energy: 1.6440006662312883
Energy: 1.0668130553510558
Energy: 1.2288214955422678
Energy: 1.5913462296575458
Energy: 0.9687542193924258
Energy: 1.228364432966424
Energy: 1.313074862530184
Energy: 0.9613811522425197
Energy: 1.230493816287809
Energy: 1.2777362161421542
Energy: 0.964871829617772
Energy: 1.2557441035033365
Energy: 1.244297562257919
Energy: 1.3741348178995498
Energy: 1.4313384944730403
Energy: 1.2440933489518249
Energy: 1.3101223891797116
Energy: 1.4463629172829497
Energy: 0.9431931585249701
Energy: 1.170990257417127
Energy: 1.061593611272622
Energy: 0.9451613116544119
Energy: 0.9725634963392166
Energy: 1.061628686222059
Energy: 1.103188396598449
Energy: 1.3414002877186175
Energy: 1.3362660047340156
Energy: 1.1029682770661087
Energy: 1.4964133141001978
Energy: 1.061825094445964
Energy: 1.1825573704830044
Energy: 1.0700400939789925
Energy: 1.321857056273088
Energy: 1.1829759343618318
Energy: 1.3155608985934493
Energy: 1.3192829166239615
Energy: 1.6334668048081218
Energy: 1.245425010055643
Energy: 1.2425942264473957
Energy: 1.6341864013226026
Energy: 1.2443783921289109
Energy: 1.2470122726872455
Energy: 1.6976656708503497
Energy: 1.5003455651743542
Energy: 1.4989356749779723
Energy: 1.4965094542614195
Energy: 1.4276087991525892
Energy: 1.5803726596056957
Energy: 1.1834665869256165
Energy: 1.4637917251318897
Energy: 1.240930258972979
Energy: 1.1715650520143248
Energy: 1.64703208373383
Energy: 1.324100644140719
Energy: 0.9685635430812245
Energy: 1.4994576858687183
Energy: 1.4997969963157916
Energy: 0.9687135940233316
Energy: 1.5005397523363833
Energy: 1.227516572787127
Energy: 0.9611726587755025
Energy: 1.0614217981556648
Energy: 0.9785079450522193
Energy: 0.9627037999485905
Energy: 0.9628876132572814
Energy: 0.9776153394599585
Energy: 1.3021434162116965
Energy: 1.4165724175358958
Energy: 1.5350336098535748
Energy: 1.305597658184383
Energy: 1.4204688783280413
Energy: 1.320876311230262
Energy: 0.9745837648419463
Energy: 0.9443672491804588
Energy: 0.9445372918372077
Energy: 0.9748304289093922
Energy: 0.9453860992320682
Energy: 0.94423160507177
Energy: 1.111181645209171
Energy: 1.0622173914136102
Energy: 1.061680370356393
Energy: 1.3969176142453332
Energy: 1.061111220533643
Energy: 1.3350974787806913
Energy: 1.3122243817405002
Energy: 1.2866818449329789
Energy: 1.3528304272017224
Energy: 1.4154025783286497
Energy: 1.26416760938239
Energy: 1.3429960241337067
Energy: 0.9687261048054563
Energy: 1.227115888991649
Energy: 1.2018600708234017
Energy: 0.9685726333952369
Energy: 1.4847819121426808
Energy: 0.9692094229487475
Energy: 1.528537442568387
Energy: 1.4157749157221553
Energy: 1.2079996217674138
Energy: 1.4106442107029553
Energy: 1.6575682991006686
Energy: 1.5772590878613821
Energy: 1.560693526942962
Energy: 0.9608429050191717
Energy: 1.2322301807552176
Energy: 1.2996074719378505
Energy: 1.1833081153993907
Energy: 1.2304489310753581
Energy: 1.9444980425484892
Energy: 1.127039320241778
Energy: 0.9748586282674674
Energy: 1.950272282492813
Energy: 1.1245023470730962
Energy: 1.4995186834236656

minimum gb energy = 0.9431931585249701 eV
minimum distance =  2.53567293053328 Angstroms
sigma value = 43


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

Energy: 2.0690547317300743
Energy: 1.5030345738303026
Energy: 1.3225816791448013
Energy: 2.0706805130145534
Energy: 1.7832688798821215
Energy: 1.2171781700345525
Energy: 1.4731161963947788
Energy: 1.1280699442425945
Energy: 1.1285912366954376
Energy: 1.4161089296956526
Energy: 1.4383020202976242
Energy: 1.2446147168212096
Energy: 1.4860344580192668
Energy: 1.4867443773864564
Energy: 1.4407235383889565
Energy: 1.3968672946007625
Energy: 1.5348174465404103
Energy: 1.472458830793787
Energy: 0.9981353790445077
Energy: 1.4684264017137134
Energy: 1.087864979477198
Energy: 0.9994305913958574
Energy: 1.4528104042578542
Energy: 0.9969527066480738
Energy: 1.0525262086057354
Energy: 1.3223103224643207
Energy: 1.2412511203543515
Energy: 1.0582650631203603
Energy: 1.321554902140534
Energy: 1.105913170845991
Energy: 1.4601041115914233
Energy: 1.287703246036969
Energy: 1.1564618385633731
Energy: 1.4240264033706418
Energy: 1.2992932263767116
Energy: 1.3154753135155608
Energy: 1.453772529734373
Energy: 0.9974076598489694
Energy: 0.9976205212691428
Energy: 1.3611989797095887
Energy: 1.0061206089018104
Energy: 0.9981135555754739
Energy: 1.7250775269714766
Energy: 1.0777046707330644
Energy: 1.4624507023903748
Energy: 1.7277778071685441
Energy: 1.0782787645307828
Energy: 1.4860537831965086
Energy: 1.433544234703912
Energy: 1.2392643905710259
Energy: 1.3322638975333663
Energy: 1.4354024042958837
Energy: 1.4730683513050957
Energy: 1.5023132968532522
Energy: 1.547173741708561
Energy: 1.6137814110016746
Energy: 1.5325256445775306
Energy: 1.5451298538070457
Energy: 1.6137970911275616
Energy: 1.332295673925441
Energy: 1.3718045302276343
Energy: 1.406916429019103
Energy: 1.6106796463725266
Energy: 1.3770284886784794
Energy: 1.5648484929141104
Energy: 1.3142600434831577
Energy: 1.478730508733815
Energy: 1.4088481562420945
Energy: 1.503055262278662
Energy: 1.6096060701841903
Energy: 1.450333258784068
Energy: 1.5032847109706122
Energy: 1.9159976429071308
Energy: 1.1150264719487875
Energy: 1.0917316082452662
Energy: 1.5434881773437827
Energy: 1.115318269489967
Energy: 1.4397180267015024
Energy: 1.5940915340583393
Energy: 1.1911013650940414
Energy: 1.2160510267081444
Energy: 1.231426536734466
Energy: 1.1503461872999927
Energy: 1.2478539885758084
Energy: 1.2496186553595077
Energy: 1.4832475192552337
Energy: 1.5045124521013444
Energy: 1.2497485986904011
Energy: 1.4456868970391985
Energy: 1.4984856021043906
Energy: 0.9587384280934887
Energy: 1.3098890704938537
Energy: 1.0553227062189432
Energy: 0.9611326306201341
Energy: 1.3890685629863604
Energy: 0.9572227867018531
Energy: 1.1351983924798996
Energy: 1.3886439978261365
Energy: 1.3882022985840679
Energy: 1.135257291355039
Energy: 1.4616262780721712
Energy: 1.3569060765530843
Energy: 1.48414087115333
Energy: 1.4080590839021263
Energy: 1.3825833870010287
Energy: 1.373183679774269
Energy: 1.3465939015769568
Energy: 1.3843585261675464
Energy: 1.7259924256130306
Energy: 1.340242907480387
Energy: 1.3324004932766724
Energy: 1.6013263807866853
Energy: 1.33646840239079
Energy: 1.2602566755663027
Energy: 1.6497455814609558
Energy: 1.4526734832792891
Energy: 1.5598138720428971
Energy: 1.5975656950548176
Energy: 1.4774246765140848
Energy: 1.4452448200837145
Energy: 1.4262502650534659
Energy: 1.262568474372532
Energy: 1.4030920515770546
Energy: 1.4282511400270628
Energy: 1.416562402434331
Energy: 1.1683621080119448
Energy: 1.354820497917195
Energy: 1.531925595537179
Energy: 1.471052624810913
Energy: 1.3544865276660454
Energy: 1.8820909911321746
Energy: 1.2125421947129207
Energy: 1.2217966735322878
Energy: 1.196067427084481
Energy: 1.170112526649149
Energy: 1.2183659160886755
Energy: 1.3227476931829814
Energy: 1.4105964407760094
Energy: 1.5900992891750951
Energy: 1.4006518430610089
Energy: 1.4620289775916284
Energy: 1.46362152044332
Energy: 1.3921757074705485
Energy: 1.427250490381224
Energy: 1.362257669079742
Energy: 0.9573309157603247
Energy: 0.9639083241651304
Energy: 1.345105874532458
Energy: 0.9573959942610222
Energy: 1.0052496561923034
Energy: 1.5625322180990893
Energy: 1.0208915317535012
Energy: 1.094738018293338
Energy: 1.3857811076783246
Energy: 1.02045710735541
Energy: 1.2099708185039535
Energy: 1.3915107139263891
Energy: 1.2783021792127474
Energy: 1.3787371412330633
Energy: 1.365945062295653
Energy: 1.3283378810418502
Energy: 1.3591963745397284
Energy: 1.108944336794033
Energy: 1.317391739290618
Energy: 1.2030987504756552
Energy: 1.11034544552169
Energy: 1.2178049615501798
Energy: 1.1049965469704435
Energy: 1.4285671927853665
Energy: 1.5278707188151728
Energy: 1.4058932746049326
Energy: 1.4302644711918142
Energy: 1.7518844387711279
Energy: 1.4210605396267493
Energy: 1.3981929904640265
Energy: 1.1288225475205989
Energy: 1.3520312279415694
Energy: 1.373131578202489
Energy: 1.177433811740486
Energy: 1.4179777864342147
Energy: 2.0723578542633585
Energy: 1.6507449919713488
Energy: 1.432167307911701
Energy: 1.5518854573834409
Energy: 1.6038720609948143
Energy: 1.587153487364577

minimum gb energy = 0.9572227867018531 eV
minimum distance =  2.54266565533694 Angstroms
sigma value = 57


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

Energy: 1.5888665796355947
Energy: 1.0852328867365797
Energy: 1.086427802538156
Energy: 1.5914071773992418
Energy: 1.5744695375872741
Energy: 1.6738235259145344
Energy: 1.477896639648282
Energy: 1.0946501997690932
Energy: 1.1698916396609593
Energy: 1.3184279312703162
Energy: 1.0945671825485768
Energy: 1.1650653814813812
Energy: 1.3607271079837802
Energy: 1.3015143083123042
Energy: 1.3083427449440446
Energy: 1.3610764550306593
Energy: 1.3989501409394847
Energy: 1.3978358419588568
Energy: 0.997177208751241
Energy: 1.3221839559722999
Energy: 1.3087553240454448
Energy: 0.9986961101051959
Energy: 1.356725976299097
Energy: 0.9957817217358396
Energy: 1.1186685369285863
Energy: 1.307811724778435
Energy: 1.2999711567519945
Energy: 1.1185713606933385
Energy: 1.2746095566834146
Energy: 1.0928013589699292
Energy: 1.4138906809946639
Energy: 1.2239255107472793
Energy: 1.2240616042668857
Energy: 1.3481867348976615
Energy: 1.0213924300061172
Energy: 1.223445677558367
Energy: 1.4075010973732371
Energy: 1.016245297869361
Energy: 1.0178266245005916
Energy: 1.4088823541274311
Energy: 1.0209067846875013
Energy: 1.0174817913683334
Energy: 1.5888749673152602
Energy: 1.434261104591932
Energy: 1.443824904877438
Energy: 1.4237574757199014
Energy: 1.3253224429536345
Energy: 1.3643634910859035
Energy: 1.4125194068314006
Energy: 1.1653647159595801
Energy: 1.1659178362732268
Energy: 1.407650998314104
Energy: 1.30155952758704
Energy: 1.342330502656138
Energy: 1.3528857743048708
Energy: 1.448474865846063
Energy: 1.450984044527807
Energy: 1.35286140426197
Energy: 1.44853109216651
Energy: 1.3734820732563735
Energy: 1.3471538557828397
Energy: 1.1807682003183535
Energy: 1.3362592315404904
Energy: 1.2244478154240637
Energy: 1.3188798235237005
Energy: 1.281889353345966
Energy: 1.4784199588348357
Energy: 1.3342542861027515
Energy: 1.3467088744523341
Energy: 1.4804339470505954
Energy: 1.2614114932762175
Energy: 1.2757879076191003
Energy: 1.4837335751825202
Energy: 1.1623110457466035
Energy: 1.2707977063720304
Energy: 1.6168370344183343
Energy: 1.1555276884385444
Energy: 1.270821333404073
Energy: 1.5278654626777215
Energy: 1.0934095503643182
Energy: 1.1656581674407904
Energy: 1.2959032327063922
Energy: 1.095333123327023
Energy: 1.2075969582379178
Energy: 1.2856432541461102
Energy: 1.3610592199274045
Energy: 1.3591955180355857
Energy: 1.3834463116849116
Energy: 1.5955741845547113
Energy: 1.401437046651841
Energy: 1.016165932773665
Energy: 1.215340656367226
Energy: 1.0484634902195655
Energy: 1.0181658284511583
Energy: 1.1843300084456256
Energy: 1.0121748004898192
Energy: 1.2907213620504991
Energy: 1.3059846982192143
Energy: 1.3058665587498803
Energy: 1.261036228106944
Energy: 1.4998590257511157
Energy: 1.299201892884878
Energy: 1.298505657314737
Energy: 1.0178330131650806
Energy: 1.2579150992670092
Energy: 1.2868942370765661
Energy: 1.0816430264318126
Energy: 1.2266030416928138
Energy: 1.4160618051703442
Energy: 0.9954441244762492
Energy: 0.9994919114407104
Energy: 1.4072519383718969
Energy: 0.999622800667166
Energy: 1.138326213692643
Energy: 1.4083272710131747
Energy: 1.3464104638324794
Energy: 1.3639352171182724
Energy: 1.407582464875075
Energy: 1.4004035172523759
Energy: 1.3647794948239593
Energy: 1.2183745265458028
Energy: 1.166865096581252
Energy: 1.1660659478637887
Energy: 1.0942406077777047
Energy: 1.2683342111772633
Energy: 1.0964669176827784
Energy: 1.5436420425165185
Energy: 1.4536745453922646
Energy: 1.4539797415305589
Energy: 1.5454025153157989
Energy: 1.8814896468153162
Energy: 1.2724823147271476
Energy: 1.3478113343869988
Energy: 1.093102623019401
Energy: 1.165586898263544
Energy: 1.4487012255435132
Energy: 1.2975065908450487
Energy: 1.0924000005028807
Energy: 1.4841199212006198
Energy: 1.402136411715842
Energy: 1.3126483556260318
Energy: 1.5453413687597615
Energy: 1.3365213589857854
Energy: 1.4548951123845555

minimum gb energy = 0.9954441244762492 eV
minimum distance =  2.5427390705219 Angstroms
sigma value = 17


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

Energy: 1.8190853393707547
Energy: 1.275200254714516
Energy: 1.2718942590837259
Energy: 1.8217175345695578
Energy: 1.5905276508972677
Energy: 1.2868790163819497
Energy: 1.3097680036097061
Energy: 1.290500032377033
Energy: 1.3021419175631357
Energy: 1.2762751255917826
Energy: 1.2293442520370632
Energy: 1.2532324145876266
Energy: 1.3881010409255168
Energy: 1.2645962015763539
Energy: 1.2642457119344621
Energy: 1.3902607838085421
Energy: 1.2664605194834995
Energy: 1.2641044797889014
Energy: 1.1031687549332756
Energy: 1.2647394125231322
Energy: 1.2644988946346407
Energy: 1.1036626719194835
Energy: 1.372288374317335
Energy: 1.1619421270056702
Energy: 1.1380568545140262
Energy: 1.2663764986395945
Energy: 1.2365845257608667
Energy: 1.1384881443152515
Energy: 1.1295924618835287
Energy: 1.229766502407229
Energy: 1.5713490492942899
Energy: 0.9487196204779443
Energy: 1.0761965570130152
Energy: 1.5734187703857996
Energy: 0.963208233049774
Energy: 1.2398698276514872
Energy: 1.3661967963263417
Energy: 0.944399507276917
Energy: 0.9443944678963797
Energy: 1.2661887596183126
Energy: 0.9505365610239256
Energy: 1.0582987984090715
Energy: 1.4964450795814732
Energy: 1.3351251999445237
Energy: 1.30092009431386
Energy: 1.49888834040193
Energy: 1.336048352382815
Energy: 1.1976521656988308
Energy: 0.9483552570431101
Energy: 1.2694450207873917
Energy: 1.201216239294847
Energy: 0.9504428388598215
Energy: 1.266530574254474
Energy: 0.9459384389792135
Energy: 0.9628459971207448
Energy: 1.2477932566216994
Energy: 1.2479614052934926
Energy: 0.9629184915288124
Energy: 1.2484045621219775
Energy: 1.2161458595802381
Energy: 1.5779318419138049
Energy: 1.2904454700137424
Energy: 1.2220805878065877
Energy: 1.314664086735545
Energy: 1.2277188753136237
Energy: 1.2227660834704148
Energy: 1.3956406673018689
Energy: 1.0993850766870197
Energy: 1.09929326480933
Energy: 1.3967048649129072
Energy: 1.106571871357505
Energy: 1.100106912363127
Energy: 1.4451674386765594
Energy: 1.362111577955269
Energy: 1.3591165073645863
Energy: 1.4475020488811519
Energy: 1.4261304598860043
Energy: 1.4104612172432451
Energy: 1.3594848541773998
Energy: 1.266337668452618
Energy: 1.2309405943150022
Energy: 1.3593865972792296
Energy: 1.3569383629098324
Energy: 1.3103068091295422
Energy: 1.4773754616485237
Energy: 1.3710446740157574
Energy: 1.4194850986975112
Energy: 1.47838595399121
Energy: 1.3717697868030718
Energy: 1.3558704516962692
Energy: 1.3722766513024827
Energy: 1.3185914897166462
Energy: 1.267447368357303
Energy: 1.3716339650262748
Energy: 1.5409035127564867
Energy: 1.229590234435015
Energy: 1.3648290600698805
Energy: 1.4157114798411101
Energy: 1.3544246416856838
Energy: 1.3649497783189248
Energy: 1.4158580937923801
Energy: 1.3429498119346748

minimum gb energy = 0.9443944678963797 eV
minimum distance =  2.549278627473 Angstroms
sigma value = 17


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

Energy: 1.9546924798435268
Energy: 1.2292182481195115
Energy: 1.2196013417518654
Energy: 1.9582395038442333
Energy: 1.5130661119771316
Energy: 1.224175921981679
Energy: 1.5165128554600673
Energy: 1.2578093265979158
Energy: 1.2078597090995078
Energy: 1.3818272456725076
Energy: 1.3168862791080043
Energy: 1.309265675145791
Energy: 1.338838264123714
Energy: 1.1904847034606632
Energy: 1.1860142185404825
Energy: 1.3390024952147257
Energy: 1.1172796338164763
Energy: 1.1978099382585412
Energy: 1.100204769378617
Energy: 1.186623841124056
Energy: 1.1857405440148865
Energy: 1.1019507379698033
Energy: 1.1436124901509734
Energy: 1.121782831458014
Energy: 1.1941590815504062
Energy: 1.1549961356095046
Energy: 1.1563142203948764
Energy: 1.196073559751192
Energy: 1.3951137439570849
Energy: 1.1607899161768662
Energy: 1.7160255505732995
Energy: 0.9695698236684985
Energy: 1.0865549746913057
Energy: 1.4467967535135173
Energy: 0.9692890022073181
Energy: 1.1402168873519647
Energy: 1.3119494354704253
Energy: 0.9425175504403247
Energy: 0.9334154335949507
Energy: 1.313880956146744
Energy: 0.936491353477762
Energy: 1.028316068539127
Energy: 1.3811413979342524
Energy: 1.1607300659944384
Energy: 1.186327323089731
Energy: 1.3811485860520436
Energy: 1.2081060553770397
Energy: 1.1839060315934322
Energy: 0.8897198512277728
Energy: 1.1599333425849252
Energy: 1.0261111041362914
Energy: 0.8913517743412473
Energy: 1.1398523361544324
Energy: 0.9020270666091749
Energy: 0.922530454468274
Energy: 1.1159928749270205
Energy: 1.113075971130666
Energy: 0.9361986668102462
Energy: 1.143861394460632
Energy: 1.0879123660022585
Energy: 1.3159174395068622
Energy: 0.9357742886384569
Energy: 1.0858187206438865
Energy: 1.1427758108859853
Energy: 0.9362712397179208
Energy: 1.0864602913946477
Energy: 1.134490822674965
Energy: 0.9143472694347102
Energy: 0.9022138792822966
Energy: 1.1367295850780532
Energy: 0.9079681126177994
Energy: 1.01847369605848
Energy: 1.2723781954943876
Energy: 1.2887315325237167
Energy: 1.134056540392861
Energy: 1.1866666987216845
Energy: 1.3543714099141346
Energy: 1.146162691200204
Energy: 0.9334414579628019
Energy: 1.1801856719273343
Energy: 1.1611821149604862
Energy: 0.9335211093846865
Energy: 1.2245925943584186
Energy: 0.9334492022504836
Energy: 0.9701480028703707
Energy: 1.1472209977439765
Energy: 1.148009653128022
Energy: 0.9697622339855156
Energy: 1.1465375602402808
Energy: 1.1717352826055922
Energy: 1.3764648218988103
Energy: 1.1599409195614898
Energy: 1.1524502596658128
Energy: 1.334900622900691
Energy: 1.099947534451915
Energy: 1.1475729366277403
Energy: 1.212439612054334
Energy: 1.0973960628072559
Energy: 1.098014113920366
Energy: 1.2443300388602392
Energy: 1.1065976625761362
Energy: 1.09804033262186
Energy: 1.201755621595326
Energy: 1.2902659139169523
Energy: 1.2667916547874487
Energy: 1.1061453410433337
Energy: 1.3403928903819116
Energy: 1.2141660184217742
Energy: 1.3639173593078082
Energy: 1.2011324226223847
Energy: 1.409699286013863
Energy: 1.3642895357248346
Energy: 1.4790855441307371
Energy: 1.3220872849133407
Energy: 1.4766540372368377
Energy: 1.1901502591308952
Energy: 1.1915028063485675
Energy: 1.476598353391465
Energy: 1.4706732212820985
Energy: 1.2617600160920723
Energy: 1.414710675648267
Energy: 1.3324979757660715
Energy: 1.1875162562606987
Energy: 1.414466199451293
Energy: 1.516704171730487
Energy: 1.269134951786598
Energy: 1.2541933968333108
Energy: 1.3513813360204432
Energy: 1.2830781593962115
Energy: 1.2318317799364749
Energy: 1.3422033422778332
Energy: 1.1970813962463573
Energy: 1.2243418798570047
Energy: 1.2567368224358404
Energy: 1.252821513769451
Energy: 1.2266083971841022
Energy: 1.2529720126354293
Energy: 1.2808088691917927
Energy: 1.347938238453144
Energy: 1.4131818004858356
Energy: 1.2707874632031422
Energy: 1.349471279089456
Energy: 1.2748708898048227
Energy: 1.276796731141501
Energy: 1.0984562343669935
Energy: 1.1934571140626713
Energy: 1.1863735403734863
Energy: 1.0987861696856014
Energy: 1.4584844095729037
Energy: 1.1983648279096564
Energy: 1.175408690193722
Energy: 1.1966346211520202
Energy: 1.1810033962232813
Energy: 1.1318387687765135
Energy: 1.1243987873730246
Energy: 1.162470752367485
Energy: 1.4249998701606028
Energy: 1.3108575614016158
Energy: 1.242617011387681
Energy: 1.4467789325251177
Energy: 1.3107060046501071
Energy: 1.139785932540581
Energy: 1.2292171575773034
Energy: 0.9420499063769394
Energy: 0.9470347127527097
Energy: 1.2300715051446747
Energy: 0.9362807957264329
Energy: 0.9460359379451908
Energy: 1.4393690690318737
Energy: 1.1112901253594574
Energy: 1.1179066968028428
Energy: 1.3960721108665737
Energy: 0.9809999431769091
Energy: 1.1378364131978493
Energy: 0.935967253949898
Energy: 1.1609194361338375
Energy: 1.139743187995772
Energy: 0.9373068774637604
Energy: 1.2074075118680836
Energy: 1.0876786862982388
Energy: 0.9084427085478627
Energy: 1.172330424933406
Energy: 1.145721068019775
Energy: 0.9101270927958331
Energy: 1.159335998858165
Energy: 1.0265631393207288
Energy: 1.4594550157302204
Energy: 1.187365645395368
Energy: 1.184968232864128
Energy: 1.4589896774040372
Energy: 1.1921554160816323
Energy: 1.1799656820113122
Energy: 1.2907843866014683
Energy: 0.8964273303380705
Energy: 0.8884935452128132
Energy: 1.2182240387303613
Energy: 0.8898382094815155
Energy: 0.8884624564014393
Energy: 1.6200060499835645
Energy: 1.0130028928376908
Energy: 1.1076165290635995
Energy: 1.6226533298881625
Energy: 1.0119429490969865
Energy: 1.1340293154885095
Energy: 0.9842428822259832
Energy: 1.1964037858167316
Energy: 1.1413444911389348
Energy: 0.9859481867995472
Energy: 1.2237449829699825
Energy: 1.157776318863303
Energy: 0.9722729137444643
Energy: 1.1638890395791344
Energy: 1.1711963257418836
Energy: 0.9740141159925803
Energy: 1.1635563459310192
Energy: 0.9627937640892731
Energy: 1.3297304354881618
Energy: 1.1509756849794688
Energy: 1.1424479791414313
Energy: 1.3303325121511467
Energy: 1.1893250887390294
Energy: 1.1606906337190868
Energy: 1.3903110735886122
Energy: 1.0899020081775312
Energy: 1.081935082787583
Energy: 1.188599063355595
Energy: 1.0839518549462681
Energy: 1.0818762375690316
Energy: 1.432676444745059
Energy: 1.3450387084634134
Energy: 1.2374672051965019
Energy: 1.4707208761523094
Energy: 1.3403952267637513
Energy: 1.1705752132111933
Energy: 1.3795184517935184
Energy: 1.1796365273626894
Energy: 1.1737281704508833
Energy: 1.366813046289259
Energy: 1.188160513690518
Energy: 1.2920964555394516
Energy: 1.3997684115615572
Energy: 1.2313193106418039
Energy: 1.2956303030780791
Energy: 1.401423004975753
Energy: 1.2610343352921525
Energy: 1.2908061950270964
Energy: 1.4179700492694363
Energy: 1.3169439111861125
Energy: 1.1866633246938214
Energy: 1.417268106611578
Energy: 1.3681784164241029
Energy: 1.3639569925513468
Energy: 1.2739394941356055
Energy: 1.3442665670460807
Energy: 1.3440125327213968
Energy: 1.274137101445159
Energy: 1.3532928876679393
Energy: 1.2809192449913567

minimum gb energy = 0.8884624564014393 eV
minimum distance =  2.5422333671834 Angstroms
sigma value = 57


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

Energy: 1.8022838651400799
Energy: 1.1697743364323392
Energy: 1.1563286237479744
Energy: 1.8049243427610369
Energy: 1.4556733963610708
Energy: 1.1596840538029842
Energy: 1.4218602588911906
Energy: 1.197642532408146
Energy: 1.1525339479629317
Energy: 1.3104831087967614
Energy: 1.1863427163084588
Energy: 1.1786233198569016
Energy: 1.2613292618664982
Energy: 1.129069239801351
Energy: 1.1128232833198122
Energy: 1.2641057721080085
Energy: 1.081301504886573
Energy: 1.1321891658979553
Energy: 1.0615708920870761
Energy: 1.1309684863787497
Energy: 1.1197902813066343
Energy: 1.1346563024384135
Energy: 1.158697425335436
Energy: 1.0711009042795507
Energy: 1.2032717140490883
Energy: 1.1047537186167662
Energy: 1.0961873521702032
Energy: 1.203648607679932
Energy: 1.2409588348000402
Energy: 1.1021485258866155
Energy: 1.3291668279154698
Energy: 0.9360785968524031
Energy: 1.024898603537395
Energy: 1.3672932216074962
Energy: 0.9558017723619179
Energy: 1.0757327671509709
Energy: 1.2290639334397173
Energy: 0.9179021737604544
Energy: 0.9228947715789341
Energy: 1.2120319655071292
Energy: 0.9159108586362293
Energy: 1.0636064804383711
Energy: 1.2684027885955573
Energy: 1.0835220164297419
Energy: 1.1036005259336459
Energy: 1.270954324336863
Energy: 1.0895493529552662
Energy: 1.1134171005287667
Energy: 0.8581343694802349
Energy: 1.0727200406591482
Energy: 0.8722887676150339
Energy: 0.8585420776704915
Energy: 1.1906372362730866
Energy: 0.8724536668328168
Energy: 0.908920566986892
Energy: 1.0427795775839461
Energy: 1.0405811308619515
Energy: 0.9092199993945759
Energy: 1.0777340658324857
Energy: 1.0253471788885993
Energy: 1.262167789373061
Energy: 0.8585632962656322
Energy: 1.0050370481932862
Energy: 1.1104164362149729
Energy: 0.8739401198541734
Energy: 1.0486658025251367
Energy: 1.0553798268290655
Energy: 0.8473561768287108
Energy: 0.8545190675513582
Energy: 1.0560829886939331
Energy: 0.832621708721981
Energy: 1.0403837852801994
Energy: 1.3419212716430504
Energy: 1.0826915851138834
Energy: 1.0762151770558512
Energy: 1.1470712136227839
Energy: 1.217405670186175
Energy: 1.1172217830859756
Energy: 0.8280304143764435
Energy: 1.0792376400923887
Energy: 0.8264024881814036
Energy: 0.8303799808739598
Energy: 1.1669814467030784
Energy: 0.8446266082958382
Energy: 0.8580295981667249
Energy: 1.057867934246341
Energy: 1.0536186285907414
Energy: 0.8586036453961251
Energy: 1.041769517276515
Energy: 1.0311565049099678
Energy: 1.2094799524895994
Energy: 0.8869970801676303
Energy: 1.0223939425498743
Energy: 1.1105094953039512
Energy: 0.9179542827283388
Energy: 1.0207391487316533
Energy: 1.2038700778507896
Energy: 0.8853119464452521
Energy: 0.8918560821143331
Energy: 1.1085948823020113
Energy: 0.8799960610347538
Energy: 0.9713858382623075
Energy: 1.0770678071119586
Energy: 1.0610430603237422
Energy: 1.0641364468877401
Energy: 1.2282330413339222
Energy: 1.2906472007490302
Energy: 1.1115249251741754
Energy: 0.9098467856115525
Energy: 1.1344361147143922
Energy: 0.9088192183334073
Energy: 0.9126686257761633
Energy: 1.2250026209060665
Energy: 0.9212799765804065
Energy: 1.2160309570649377
Energy: 1.0808038427270135
Energy: 1.0787893811342137
Energy: 1.2116616372465623
Energy: 1.3691935193980058
Energy: 1.109423115535978
Energy: 1.296934402995284
Energy: 1.0597800377665825
Energy: 1.1637009899894035
Energy: 1.3589202793938915
Energy: 1.0681793063768774
Energy: 1.0812998850711781
Energy: 1.4159575491706269
Energy: 1.0722699115063536
Energy: 0.9392122771782329
Energy: 1.0905311596257754
Energy: 1.0684379496788514
Energy: 1.1082983003922022
Energy: 1.1880822230005739
Energy: 1.2165147232998659
Energy: 1.2004332332246044
Energy: 1.281230407417366
Energy: 1.2640877888219828
Energy: 1.1997201484236935
Energy: 1.2882133191300258
Energy: 1.2837610860352815
Energy: 1.290851810488124
Energy: 1.2903407506843563
Energy: 1.3628059598326896
Energy: 1.2567661528895764
Energy: 1.381201825981593
Energy: 1.1061695732219419
Energy: 1.1046418009835148
Energy: 1.3811511827685468
Energy: 1.108636829157867
Energy: 1.125882347629031
Energy: 1.3851861534666552
Energy: 1.1582542194598369
Energy: 1.146297167158292
Energy: 1.332381611196771
Energy: 1.33458600556344
Energy: 1.2388600547442405
Energy: 1.4733773076854304
Energy: 1.27574700844894
Energy: 1.0518771181021471
Energy: 1.525299740240044
Energy: 1.3394816593362582
Energy: 1.1203192297070967

minimum gb energy = 0.8264024881814036 eV
minimum distance =  2.54897735165054 Angstroms
sigma value = 43


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

Energy: 1.7210941034092693
Energy: 1.0425622600277638
Energy: 1.0243959753432714
Energy: 1.7229434415147513
Energy: 1.1546029026371745
Energy: 0.9722141930474177
Energy: 1.1985527961517113
Energy: 1.0384875475517443
Energy: 1.0239138284504705
Energy: 1.106756699272167
Energy: 0.9964128078516419
Energy: 1.0161957090725149
Energy: 1.0932394741169449
Energy: 0.9374596010349102
Energy: 0.9564998288337717
Energy: 1.0955768063616331
Energy: 0.9332816390829379
Energy: 0.9464322501085229
Energy: 0.9987747477700546
Energy: 0.9558907365118019
Energy: 0.9596704664648655
Energy: 0.9996281633920209
Energy: 1.008303270861409
Energy: 0.8714246748155378
Energy: 1.0473917126839605
Energy: 0.9037500940766117
Energy: 0.9517594243682158
Energy: 1.0101525064921544
Energy: 1.0764138150597315
Energy: 0.9666125867141393
Energy: 1.2520840494460832
Energy: 0.8409529828786849
Energy: 0.8086143453444722
Energy: 1.2628949518237198
Energy: 0.8406526519377199
Energy: 0.9498683244818255
Energy: 1.1232298664834734
Energy: 0.8236227493179314
Energy: 0.8944900057729203
Energy: 1.0501833901315487
Energy: 0.8292586417988281
Energy: 1.0197650584226758
Energy: 1.0968226533066674
Energy: 0.9047267668519845
Energy: 0.916571790661289
Energy: 1.084272497122266
Energy: 0.9045780739037211
Energy: 0.9101380357611375
Energy: 0.7734799497307766
Energy: 0.9042541810115361
Energy: 0.7822148458020803
Energy: 0.7752909574299709
Energy: 1.0224411112104839
Energy: 0.7825556837074037
Energy: 0.9004179385094087
Energy: 0.9196282004682493
Energy: 0.9008773424552406
Energy: 0.7822103878560906
Energy: 0.9378773363748334
Energy: 0.9019347195843127
Energy: 1.1554036292654355
Energy: 0.7541228360171793
Energy: 0.8770607656521098
Energy: 1.2040396017956514
Energy: 0.753956768727496
Energy: 0.8955699996496161
Energy: 1.0238441946724013
Energy: 0.7343088288590968
Energy: 0.7342285667920152
Energy: 0.997980176141228
Energy: 0.7343931745133768
Energy: 0.8972328425674215
Energy: 1.1504132352369592
Energy: 0.8841264048308064
Energy: 0.9117566120329007
Energy: 0.9848717437342293
Energy: 0.8847327844894379
Energy: 0.9178779428882737
Energy: 0.7128005282499986
Energy: 1.0221609257563666
Energy: 0.7248321538824408
Energy: 0.7149197443758624
Energy: 0.9926359569155128
Energy: 0.7123818495624871
Energy: 0.7294520547367743
Energy: 0.8867689488671806
Energy: 0.8791395757569099
Energy: 0.7347688111733265
Energy: 0.8877928652282419
Energy: 0.9054735238164695
Energy: 0.83575018553048
Energy: 0.72320178788427
Energy: 0.7192134547058793
Energy: 0.94005232668712
Energy: 0.7230323381316537
Energy: 0.8719739196825322
Energy: 0.8515650419307397
Energy: 0.7150584824661519
Energy: 0.7149943945911338
Energy: 0.8528846281048678
Energy: 0.7150699543520836
Energy: 0.8687821151895301
Energy: 0.9903932585616734
Energy: 0.9385849869720485
Energy: 0.9316971947301274
Energy: 0.9927938435924578
Energy: 1.3242348389701144
Energy: 0.9490072923738003
Energy: 0.702241857202708
Energy: 0.9786127506936233
Energy: 0.7020796107575203
Energy: 0.7038281856465918
Energy: 0.9833221036565839
Energy: 0.7021675181740953
Energy: 1.066312379638803
Energy: 0.9365373688579458
Energy: 0.9421704651611772
Energy: 1.0137838082976944
Energy: 1.4252075767354677
Energy: 0.9587533405073935
Energy: 0.8776645294524292
Energy: 0.7187056596814955
Energy: 0.7263830710590677
Energy: 0.8798638096710768
Energy: 0.7263369664218756
Energy: 0.8766266740350704
Energy: 0.832186331846298
Energy: 0.7329582829490289
Energy: 0.7247271953339764
Energy: 1.0299039853343985
Energy: 0.7330513863658198
Energy: 0.8888166396986381
Energy: 0.7546807294903407
Energy: 0.9076078853587664
Energy: 0.8760568879670775
Energy: 0.745301080367101
Energy: 0.9063626616991631
Energy: 0.9143727817564572
Energy: 0.7349321733643338
Energy: 1.0386823244336212
Energy: 0.7467680353443802
Energy: 0.7370428456106263
Energy: 1.0055932842937845
Energy: 0.7406757705405689
Energy: 1.1052942001015589
Energy: 0.8898420058803224
Energy: 0.9019106022263618
Energy: 1.033164364834507
Energy: 0.890247398507311
Energy: 0.9017977131328733
Energy: 1.1215583653654875
Energy: 0.770268314944215
Energy: 0.7700560064651042
Energy: 1.008168893021232
Energy: 0.7701503612674265
Energy: 0.9273475924053597
Energy: 1.252240402587989
Energy: 0.7887450137173692
Energy: 0.8481268448177858
Energy: 1.2633164591375947
Energy: 0.7887069665506343
Energy: 0.9082410380594286
Energy: 0.9235384775732051
Energy: 0.9282137989599424
Energy: 0.9318849659757928
Energy: 0.9647149916425158
Energy: 1.003411979645384
Energy: 0.9120545934113284
Energy: 0.8347862379643822
Energy: 0.9211758124647516
Energy: 0.8380952452080392
Energy: 0.8364433610945617
Energy: 1.0740176034644917
Energy: 0.8383424767968268
Energy: 1.0743984397046242
Energy: 0.9152898574268719
Energy: 0.9327369136430824
Energy: 1.0763721699163837
Energy: 0.9145314939655381
Energy: 0.9262500583662484
Energy: 1.2238460506861129
Energy: 0.9266810051473751
Energy: 1.0309339664609485
Energy: 0.960457632015015
Energy: 0.9327954266170285
Energy: 1.0624434734427661
Energy: 1.319199868630121
Energy: 0.9389913075958009
Energy: 0.9018102623570493
Energy: 1.33107650052724
Energy: 0.9392607491668367
Energy: 0.9689711550120256
Energy: 1.087207370372174
Energy: 0.992072520449655
Energy: 0.9814540075717774
Energy: 1.0598493887731848
Energy: 1.0989955576518475
Energy: 0.981966056110507
Energy: 1.1436459913872894
Energy: 0.9887064272672235
Energy: 0.9863856855148632
Energy: 1.1435014473885554
Energy: 1.0379261234785826
Energy: 0.98745922202766
Energy: 1.155114531470993
Energy: 0.9403111336186308
Energy: 0.9864826262720775
Energy: 1.1510276960636128
Energy: 0.9268664264622934
Energy: 0.9087245633852837
Energy: 1.1985528590527312
Energy: 1.034588139551152
Energy: 0.9899546241464365
Energy: 1.0998300685809859
Energy: 1.1054063262972207
Energy: 0.9770332469464486

minimum gb energy = 0.7020796107575203 eV
minimum distance =  2.56876895818974 Angstroms
sigma value = 81


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

Energy: 0.07516205631118679
Energy: 0.12315395786025025
Energy: 0.07614056294079398
Energy: 0.07802724997694699
Energy: 0.07659836379098393
Energy: 0.07609895209622201
Energy: 0.12530663679441945
Energy: 0.07631347447391207
Energy: 0.07651455678728032
Energy: 0.12481182283340911
Energy: 0.08028355674671685
Energy: 0.07641820853251775
Energy: 0.12237366221657234
Energy: 0.07605903324599156
Energy: 0.07634143527165402
Energy: 0.1220560746053325
Energy: 0.07576924292174184
Energy: 0.12380128401050781
Energy: 0.07926427390421983
Energy: 0.07605691699472693
Energy: 0.07526326053464474
Energy: 0.07873486246287859
Energy: 0.0760184088063922
Energy: 0.12483088002601406
Energy: 0.124040873272016
Energy: 0.12210074177171648
Energy: 0.12246887699477903
Energy: 0.12540477755614787
Energy: 0.12211670340602801
Energy: 0.12432475140540321
Energy: 0.07678716404839007
Energy: 0.07617241201304481
Energy: 0.07626699166708278
Energy: 0.07887273243752045
Energy: 0.07646616316393674
Energy: 0.07622625915445057
Energy: 0.12212986195082119
Energy: 0.07642499655097967
Energy: 0.07700394268274716
Energy: 0.12239527674118417
Energy: 0.07617997895550181
Energy: 0.07650884823599513
Energy: 0.12215133978530315
Energy: 0.07681528730993949
Energy: 0.07599105142909482
Energy: 0.12208205048945146
Energy: 0.07569128776296384
Energy: 0.12663873049417634
Energy: 0.07731246715922799
Energy: 0.07607282996639121
Energy: 0.12751474454014125
Energy: 0.0784671051153531
Energy: 0.07587142439544797
Energy: 0.12591858955296734
Energy: 0.07524233358524232
Energy: 0.12209364059986659
Energy: 0.12218377981392933
Energy: 0.07524287040436432
Energy: 0.12211431832102804
Energy: 0.12253935426479715

minimum gb energy = 0.07516205631118679 eV
minimum distance =  2.74511279340911 Angstroms
sigma value = 3


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

Energy: 1.7736469939086945
Energy: 1.1436007491582971
Energy: 1.0354715954863407
Energy: 1.7758130139544483
Energy: 1.095268277587358
Energy: 1.0453429145011746
Energy: 1.0128631673665318
Energy: 1.0367756857003305
Energy: 1.0314403706949027
Energy: 1.0525339437760688
Energy: 1.040055691374316
Energy: 1.066369842110816
Energy: 1.035537519064847
Energy: 1.0408706730992157
Energy: 1.0410189322817276
Energy: 1.0355689010859361
Energy: 1.0412554481303504
Energy: 0.9692637843245878
Energy: 0.985016368061086
Energy: 1.0477778002391762
Energy: 1.0492403833120514
Energy: 0.9854211230516948
Energy: 1.0095084625282775
Energy: 1.1455599569217132
Energy: 0.962070995997189
Energy: 1.045139999003718
Energy: 1.0658460060265487
Energy: 0.9623058970233472
Energy: 1.0493673568220072
Energy: 1.0660299143455394
Energy: 1.7003695923664364
Energy: 1.0726942293341066
Energy: 1.0409216569118942
Energy: 1.3799182432172183
Energy: 1.0140722277751009
Energy: 1.0032704193075885
Energy: 0.9503613735596299
Energy: 0.9601507305658595
Energy: 0.8879556260574234
Energy: 0.9525756957911367
Energy: 0.9857611599162391
Energy: 1.0823147013426906
Energy: 0.9372895796454723
Energy: 0.9704984158398261
Energy: 0.9725444056267681
Energy: 0.9375951984824383
Energy: 0.9533780184639732
Energy: 0.9599348886365853
Energy: 1.1434301920759633
Energy: 0.9943854318387647
Energy: 1.0635280721011138
Energy: 1.145180866462207
Energy: 0.9008958370509978
Energy: 1.0416862327529506
Energy: 0.972341359693048
Energy: 0.8482960650168191
Energy: 0.8505268314367742
Energy: 0.9402790112196213
Energy: 0.8527545638303891
Energy: 0.9087318002581253
Energy: 1.3634534355381207
Energy: 0.9649985362073515
Energy: 0.9782814549189417
Energy: 0.9911736955721117
Energy: 0.9498163854667625
Energy: 0.9407871924618091
Energy: 0.7980705934852573
Energy: 1.006883707346841
Energy: 0.9898573085340724
Energy: 0.7980464951875699
Energy: 1.0399701822221303
Energy: 0.8475573236999618
Energy: 0.7939475123174716
Energy: 0.9392190596383108
Energy: 0.9322957418059341
Energy: 0.7940113836948791
Energy: 0.930063938669205
Energy: 0.9318343282931256
Energy: 1.236287808439579
Energy: 0.9600342050731335
Energy: 0.9464784919461446
Energy: 1.0388430402810824
Energy: 0.8840442874906432
Energy: 0.9403020874151391
Energy: 0.9697200061251514
Energy: 0.7601874379516216
Energy: 0.7603702765856888
Energy: 0.8483045067328704
Energy: 0.7644891151275527
Energy: 0.8436082472111066
Energy: 0.876234691686208
Energy: 0.9301440804384256
Energy: 0.9321994053676765
Energy: 0.8901401010612735
Energy: 0.8940045453766902
Energy: 0.9224582105336756
Energy: 0.7467736422438851
Energy: 0.9261540822509052
Energy: 0.9289629678755894
Energy: 0.7470079206339949
Energy: 0.8929491181069837
Energy: 0.7959059147660604
Energy: 0.7451417774153203
Energy: 0.9521644377707056
Energy: 0.9560955395797937
Energy: 0.7453267865392205
Energy: 1.2953319889205677
Energy: 0.9520558852900093
Energy: 1.297885054920889
Energy: 0.889788624358032
Energy: 0.9273038200743201
Energy: 1.0783331000293985
Energy: 0.8954787599968789
Energy: 0.9272448431500705
Energy: 0.9396937389197026
Energy: 0.7409780632917053
Energy: 0.7460031690433244
Energy: 0.8412790117929637
Energy: 0.7461666767519293
Energy: 0.7962380421897611
Energy: 0.8687081612569744
Energy: 0.9660378482731008
Energy: 0.969515546303184
Energy: 0.8906379148724484
Energy: 0.8784177379144997
Energy: 0.9678915729559456
Energy: 0.7635180873708021
Energy: 0.9066510620619891
Energy: 0.921888338806431
Energy: 0.765197852769746
Energy: 0.9085152160028832
Energy: 0.7603842076776415
Energy: 0.7681976450797091
Energy: 1.0248151599462907
Energy: 1.0233909905228131
Energy: 0.7680862282649258
Energy: 0.9328284971040316
Energy: 0.9551956754668455
Energy: 1.479016302319905
Energy: 0.7938814535080017
Energy: 0.9476358869692563
Energy: 1.4799933949054984
Energy: 0.7936297957969364
Energy: 0.9489012185554698
Energy: 0.9470549769258716
Energy: 0.7934904176606304
Energy: 0.8473913058585424
Energy: 0.9302160179947238
Energy: 0.7940199758791837
Energy: 0.8476656345397608
Energy: 0.9467590339672379
Energy: 0.9737989155569976
Energy: 0.9734477477704107
Energy: 0.9486786228331915
Energy: 0.9417038268899979
Energy: 1.015008015526116
Energy: 0.8508268921933757
Energy: 0.9746888412319475
Energy: 0.9787223184851171
Energy: 0.8529727251508239
Energy: 0.9023635292553152
Energy: 0.8499298556859731
Energy: 0.8186546934026335
Energy: 1.0396421365687152
Energy: 1.0426541951005113
Energy: 0.8194684963095459
Energy: 1.0564807700721257
Energy: 0.9549693960753924
Energy: 1.3436446267569044
Energy: 0.9365199003800462
Energy: 0.9904652290721565
Energy: 1.2986511470569682
Energy: 0.9364342253935728
Energy: 0.9703664432163018
Energy: 0.9859503636788204
Energy: 0.9725392876886492
Energy: 0.9922564329000156
Energy: 0.9865143617001076
Energy: 0.9790257066802134
Energy: 1.040258335828626
Energy: 0.9553390591248119
Energy: 0.9927547177532554
Energy: 0.9926975941270584
Energy: 0.955592923570401
Energy: 0.9695158704006096
Energy: 0.9959936805525298
Energy: 1.0449021125589304
Energy: 1.0121502594783711
Energy: 1.0552836726548496
Energy: 1.0470872957616053
Energy: 1.009538214379242
Energy: 1.0657681655491937
Energy: 1.0049303662168896
Energy: 0.9821584888586637
Energy: 0.9824359959514625
Energy: 1.0305004423198443
Energy: 0.985626127557909
Energy: 1.087954730091129

minimum gb energy = 0.7409780632917053 eV
minimum distance =  2.51995366526001 Angstroms
sigma value = 67


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

Energy: 1.6827338306467792
Energy: 1.4489584949097285
Energy: 1.1802009576399104
Energy: 1.678664453647712
Energy: 1.617919176447993
Energy: 1.2480817706196277
Energy: 1.167209551608496
Energy: 1.1887405363845254
Energy: 1.1946416001342832
Energy: 1.2363187339858042
Energy: 1.189918340299167
Energy: 1.2464433760724871
Energy: 1.2110682448187287
Energy: 1.2224894344574302
Energy: 1.3452831307200623
Energy: 1.2122157058651928
Energy: 1.1377893418535987
Energy: 1.2480447585670147
Energy: 1.0893528606064047
Energy: 1.3517714445057736
Energy: 1.3652524849097651
Energy: 1.0899769475195846
Energy: 1.156268053900288
Energy: 1.3686970411637853
Energy: 1.0467511193504018
Energy: 1.2353124164361637
Energy: 1.2399996533325406
Energy: 1.0470096388080548
Energy: 1.2129524066206874
Energy: 1.257387587073245
Energy: 1.4809375863302896
Energy: 1.2621294694044383
Energy: 1.2391250512454552
Energy: 1.5496563612629015
Energy: 1.280291909508517
Energy: 1.2434323791567827
Energy: 1.0603637275131292
Energy: 1.1991783769405506
Energy: 1.241634700685646
Energy: 1.0616769173594474
Energy: 1.188333309057043
Energy: 1.1449999021703825
Energy: 1.0620181765884698
Energy: 1.1350086468195284
Energy: 1.1324749485248549
Energy: 1.063701816116426
Energy: 1.1388308348940595
Energy: 1.186337064392613
Energy: 1.3637221245499098
Energy: 1.1791876680801243
Energy: 1.2080784783327727
Energy: 1.1987042502045138
Energy: 1.0148212046193505
Energy: 1.1963153280423977
Energy: 1.1411687195543585
Energy: 0.9599681268535548
Energy: 0.9542810174927908
Energy: 1.1384566482862333
Energy: 0.9559736331352845
Energy: 1.06129391938502
Energy: 1.0876583560846358
Energy: 1.1056172952049126
Energy: 1.1364766647280113
Energy: 1.1251880645809975
Energy: 1.0726027360625963
Energy: 1.137401270529974
Energy: 0.9156615876047746
Energy: 1.179837358835001
Energy: 1.1504685990052004
Energy: 0.9172495643666484
Energy: 1.2707122786735332
Energy: 0.9807677683985033
Energy: 0.9147533029583476
Energy: 1.1653959335978807
Energy: 1.152982744423562
Energy: 0.9163236981481717
Energy: 1.4072475537519642
Energy: 1.010826046919675
Energy: 1.0587654860949123
Energy: 1.11952419088907
Energy: 1.1111294404518992
Energy: 1.0940782632898598
Energy: 1.0463735617716916
Energy: 1.1063197070751147
Energy: 1.09478406574052
Energy: 0.9119053868685191
Energy: 0.9198016544043812
Energy: 1.0945781008983024
Energy: 0.9075360405321102
Energy: 0.991419566808158
Energy: 1.227844109386464
Energy: 1.1272997457052907
Energy: 1.1245150806736475
Energy: 1.062981065130854
Energy: 1.033689357736203
Energy: 1.1537456905834853
Energy: 0.9567506295333482
Energy: 1.1142042575342064
Energy: 1.1405971602733826
Energy: 0.9581710456525364
Energy: 1.1121289099929348
Energy: 1.0954304404124202
Energy: 0.95684179475176
Energy: 1.2118658583545021
Energy: 1.2053094893391816
Energy: 0.9572423184133796
Energy: 1.2116784045303268
Energy: 1.076527598872429
Energy: 1.4782933653217194
Energy: 1.139353671536729
Energy: 1.1863412428734394
Energy: 1.4324308465294318
Energy: 1.13484621077843
Energy: 1.1631481373970964
Energy: 1.1359728186613574
Energy: 1.105867051175414
Energy: 1.1473971137759074
Energy: 1.0721928877563482
Energy: 1.066093504145074
Energy: 1.1346964347499862
Energy: 1.2104526431101796
Energy: 1.2515102964359512
Energy: 1.2619728644414077
Energy: 1.2126888507647027
Energy: 1.1251250409772269
Energy: 1.2574289197453705
Energy: 1.2162772913367024
Energy: 1.1853857938396333
Energy: 1.2414666649378063
Energy: 1.2177923893447602
Energy: 1.1160345421718638
Energy: 1.1906361187719978
Energy: 1.1670260737908298
Energy: 1.14242794221542
Energy: 1.1945304393044651
Energy: 1.1002939218893684
Energy: 1.1384314758750356
Energy: 1.2459111362096145

minimum gb energy = 0.9075360405321102 eV
minimum distance =  2.49772155134651 Angstroms
sigma value = 33


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

Energy: 1.8269209405843154
Energy: 1.5547073916719805
Energy: 1.5702807220513368
Energy: 1.8310067162556145
Energy: 1.4402732032643801
Energy: 1.3086436022423347
Energy: 1.1515087447239631
Energy: 1.2601187082608283
Energy: 1.2663548355043628
Energy: 1.3048853926076855
Energy: 1.26078346155659
Energy: 1.316863996936581
Energy: 1.3014459106828848
Energy: 1.4406047198740322
Energy: 1.4306189616229772
Energy: 1.3033406213221859
Energy: 1.4302365760900497
Energy: 1.3348670724861138
Energy: 1.1486283719476431
Energy: 1.4691268788785827
Energy: 1.4729118203781584
Energy: 1.150442731850245
Energy: 1.1889347171409064
Energy: 1.4722010200393054
Energy: 1.093671271502229
Energy: 1.3134056778198022
Energy: 1.337770388181493
Energy: 1.0927404675626422
Energy: 1.338763585455452
Energy: 1.333676671651804
Energy: 1.6915996805885132
Energy: 1.3935940655100225
Energy: 1.422692861418193
Energy: 1.6938970969236915
Energy: 1.3962531059890235
Energy: 1.2973348952941253
Energy: 1.0935797487103482
Energy: 1.2932167111188304
Energy: 1.3207130640224387
Energy: 1.0929894759441943
Energy: 1.2925007469858583
Energy: 1.2135250882498292
Energy: 1.111170451859321
Energy: 1.2770514863796236
Energy: 1.2593376620181693
Energy: 1.1129734676262821
Energy: 1.2768641136119168
Energy: 1.1641188961676523
Energy: 1.3143261762587566
Energy: 1.2558923991079052
Energy: 1.252486637501387
Energy: 1.3167430497019594
Energy: 1.0722698074505412
Energy: 1.25120593735196
Energy: 1.239100384315676
Energy: 1.0107023839892817
Energy: 1.0101925560175786
Energy: 1.1797657239506536
Energy: 1.013539925871057
Energy: 1.1397137921162854
Energy: 1.186306405952089
Energy: 1.1861794931396834
Energy: 1.2187424009192898
Energy: 1.177501016600042
Energy: 1.1320896409273522
Energy: 1.2332726681447777
Energy: 1.0171698127236155
Energy: 1.2778955505159468
Energy: 1.2772515787239633
Energy: 1.0189206135314421
Energy: 1.3740987783253868
Energy: 1.1226544140576191
Energy: 1.0187604764070792
Energy: 1.3144750871778785
Energy: 1.3044009457858607
Energy: 1.0102044633702354
Energy: 1.338663391692475
Energy: 1.1516103607269488
Energy: 1.4257096015535757
Energy: 1.1944161825503146
Energy: 1.261636553463138
Energy: 1.4064211561390823
Energy: 1.1883600583741887
Energy: 1.2415600611186013
Energy: 1.1694562043276195
Energy: 1.177126499903158
Energy: 1.1752850040484406
Energy: 1.182313078773415
Energy: 1.1133654042175134
Energy: 1.224032045564658
Energy: 1.296790276651578
Energy: 1.3013731186128754
Energy: 1.3041965233782933
Energy: 1.2991744333325608
Energy: 1.031466516700848
Energy: 1.252219416232043
Energy: 1.3119193557293922
Energy: 1.3152449944644735
Energy: 1.3227968943600104
Energy: 1.3051473352387026
Energy: 1.3150970244017823
Energy: 1.25452502923325
Energy: 1.3085323336250292
Energy: 1.199107318094749
Energy: 1.2586843378586479
Energy: 1.3104575672907057
Energy: 1.2147246879137292
Energy: 1.297373185893933
Energy: 1.8282072450532798
Energy: 1.3697842643713942
Energy: 1.5431243849754184
Energy: 1.830941883803946
Energy: 1.3669013494163333
Energy: 1.3326290162778036
Energy: 1.15169053981258
Energy: 1.259773455840936
Energy: 1.258920322882034
Energy: 1.1517565736404671
Energy: 1.2604734284884318
Energy: 1.258629308863333
Energy: 1.2979120964685535
Energy: 1.3390636088107524
Energy: 1.3397231801155989
Energy: 1.264984010133992
Energy: 1.3087878812684968
Energy: 1.3349476837217646
Energy: 1.190245139780475
Energy: 1.4438596098924836
Energy: 1.450062531285009
Energy: 1.1795960489863309
Energy: 1.4689446030123625
Energy: 1.4721097960443885
Energy: 1.0930542634314921
Energy: 1.336316297595375
Energy: 1.3407607706310951
Energy: 1.0930708599795744
Energy: 1.3391400907429702
Energy: 1.3339031201090947
Energy: 1.687963983061333
Energy: 1.4184607130734013
Energy: 1.4220785138166603
Energy: 1.6890089180530203
Energy: 1.3585207071126455
Energy: 1.283222075283486
Energy: 1.0927989549542352
Energy: 1.2921109782738427
Energy: 1.3199632405701935
Energy: 1.093105040357925
Energy: 1.2902535201365068
Energy: 1.260409927613483
Energy: 1.107973379480423
Energy: 1.2771038360856497
Energy: 1.285375411299469
Energy: 1.109930467545807
Energy: 1.2765338786801326
Energy: 1.164135534850354
Energy: 1.3120013079870811
Energy: 1.2509292796174174
Energy: 1.2964508280910956
Energy: 1.1857354018326458
Energy: 1.0726863609302604
Energy: 1.3293326944648634
Energy: 1.317301868465986
Energy: 1.0186954356995401
Energy: 1.0153750474040786
Energy: 1.2139379360260807
Energy: 1.0118483151603157
Energy: 1.1398163282928686
Energy: 1.45859301847033
Energy: 1.1958162806507455
Energy: 1.2207549554436465
Energy: 1.4576628116387784
Energy: 1.1296467479647472
Energy: 1.2355405689609205
Energy: 1.0102050099231705
Energy: 1.2778079082288578
Energy: 1.292729881416778
Energy: 1.010179349607964
Energy: 1.3537704929524945
Energy: 1.1730160710607416
Energy: 1.0136694366943129
Energy: 1.352051920819802
Energy: 1.151396422931281
Energy: 1.0154014338559847
Energy: 1.3325392911339717
Energy: 1.1148778343583754
Energy: 1.3816919462505879
Energy: 1.2563344713968947
Energy: 1.26028943341577
Energy: 1.222664508857449
Energy: 1.1893973546589462
Energy: 1.2404864246127816
Energy: 1.169876604185468
Energy: 1.1170600045502643
Energy: 1.1707887236720043
Energy: 1.142252989744683
Energy: 1.1110120015198472
Energy: 1.2299996961251272
Energy: 1.2955303911652551
Energy: 1.2787478042577323
Energy: 1.209582444645281
Energy: 1.297449697857243
Energy: 1.0313598555995367
Energy: 1.210744279570503
Energy: 1.3050837774687316
Energy: 1.3153620672586543
Energy: 1.315225993329271
Energy: 1.3049747276735366
Energy: 1.4017798000936552
Energy: 1.3135859698705996
Energy: 1.3057482983082407
Energy: 1.1991913367998361
Energy: 1.3171038084566185
Energy: 1.29579760869253
Energy: 1.207929954101416
Energy: 1.317171284063317
Energy: 1.4726530669420383
Energy: 1.3698243850881093
Energy: 1.5544133706829313
Energy: 1.5912628075019097
Energy: 1.3749706673904276
Energy: 1.363142417604122

minimum gb energy = 1.010179349607964 eV
minimum distance =  2.53790435100618 Angstroms
sigma value = 41


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

Energy: 1.6378487159128785
Energy: 1.6751533402792342
Energy: 1.6896450436186017
Energy: 1.6420843911647593
Energy: 2.006067662986473
Energy: 1.692568298400985
Energy: 1.1866440609350968
Energy: 1.3265792330465462
Energy: 1.3221964007729938
Energy: 1.3549128111280626
Energy: 1.3261914569738913
Energy: 1.3994128946771995
Energy: 1.271118087513859
Energy: 1.5492316183232677
Energy: 1.5457635767184885
Energy: 1.4364998773010924
Energy: 1.3242296256002204
Energy: 1.4160265321180756
Energy: 1.4164291221617578
Energy: 1.5679025609186334
Energy: 1.5942747084682696
Energy: 1.4071539598499592
Energy: 1.50953171500785
Energy: 1.3252425102173817
Energy: 1.1427400732432227
Energy: 1.4216328146501642
Energy: 1.535279592683665
Energy: 1.1427862450616841
Energy: 1.4218068656709484
Energy: 1.5419247473852904
Energy: 1.5102742734186472
Energy: 1.47495492828726
Energy: 1.5373222884808193
Energy: 1.5120559509302984
Energy: 1.4981645862804438
Energy: 1.5426625695863643
Energy: 1.143715711807022
Energy: 1.3621725810382967
Energy: 1.3892896660868534
Energy: 1.1436889788190465
Energy: 1.3268984031216147
Energy: 1.294282234741381
Energy: 1.1559704165336018
Energy: 1.3806314262401729
Energy: 1.3117334458207166
Energy: 1.1578247573144111
Energy: 1.5229171199423648
Energy: 1.2303681697470246
Energy: 1.5165657931246432
Energy: 1.377208676172993
Energy: 1.3679942699112864
Energy: 1.51808843657335
Energy: 1.2307946081980203
Energy: 1.3697501967788484
Energy: 1.338332158213514
Energy: 1.2422947098427726
Energy: 1.2491326006698256
Energy: 1.2823452702005096
Energy: 1.1606735001473127
Energy: 1.250008942140328
Energy: 1.4315851187955004
Energy: 1.3801552944903044
Energy: 1.3775784856483146
Energy: 1.4334391835861535
Energy: 1.0982971068319536
Energy: 1.294175510683009
Energy: 1.2711395520201325
Energy: 1.402630187823576
Energy: 1.4262341727250496
Energy: 1.3060135395338932
Energy: 1.5423372067491794
Energy: 1.4087589976442978
Energy: 1.353747055920161
Energy: 1.2320940376624447
Energy: 1.3779688656341478
Energy: 1.3558202992509178
Energy: 1.271629214348038
Energy: 1.3979276282812871
Energy: 1.758782305226463
Energy: 1.457029600343741
Energy: 1.68162199302576
Energy: 1.6531789079831805
Energy: 1.4420686583271674
Energy: 1.6777450370801765

minimum gb energy = 1.0982971068319536 eV
minimum distance =  2.50711629311521 Angstroms
sigma value = 11


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

Energy: 2.0298702629309298
Energy: 1.3821450387934568
Energy: 1.5156247697650953
Energy: 2.0321017135200354
Energy: 1.5745230909008738
Energy: 1.739320026575174
Energy: 1.4933692870133624
Energy: 1.231994462916987
Energy: 1.2596722473523285
Energy: 1.5472908604428866
Energy: 1.266200229246832
Energy: 1.3538674468176901
Energy: 1.7365267772543043
Energy: 1.6959902254551766
Energy: 1.6796100160154217
Energy: 1.7305991175713782
Energy: 1.6985617767736028
Energy: 1.6173675575046524
Energy: 1.6450453280663255
Energy: 1.5657058220500033
Energy: 1.5117541796927823
Energy: 1.6472588853377859
Energy: 1.3064845011879134
Energy: 1.5013121549976531
Energy: 1.4115585976800582
Energy: 1.312896357615289
Energy: 1.2979997437072732
Energy: 1.316198478757623
Energy: 1.3145311774453117
Energy: 1.4123090841200425
Energy: 1.5123052215523172
Energy: 1.3331252876670827
Energy: 1.4369163556048261
Energy: 1.507633435903464
Energy: 1.3000206525609725
Energy: 1.4387709770712065
Energy: 1.3040643506701641
Energy: 1.4320473442426713
Energy: 1.4487484955030896
Energy: 1.3062600485302436
Energy: 1.4228668722795803
Energy: 1.4473953955310366
Energy: 1.2382372990696546
Energy: 1.3406917150802706
Energy: 1.3702876967743913
Energy: 1.2404743333063195
Energy: 1.3084203224141762
Energy: 1.3547123439863216
Energy: 1.4994387604227868
Energy: 1.583008925477292
Energy: 1.6143879904214422
Energy: 1.4990021108201308
Energy: 1.6201382189390623
Energy: 1.745635386725876
Energy: 1.4743829727735691
Energy: 1.625069219943023
Energy: 1.6291051927514624
Energy: 1.254029981943692
Energy: 1.6800028541858882
Energy: 1.746057567775603
Energy: 1.372831101184318
Energy: 1.3742961496477288
Energy: 1.4512400677821111
Energy: 1.375410083016511
Energy: 1.4587614342009119
Energy: 1.3401860483603125
Energy: 1.3266366655897344
Energy: 1.8569690469532931
Energy: 1.7713498786087425
Energy: 1.3255564391804608
Energy: 1.9276628227330024
Energy: 1.7747542330020791
Energy: 1.2031928664744131
Energy: 1.5050472998481907
Energy: 1.48694958790346
Energy: 1.2032602436939615
Energy: 1.605922695424714
Energy: 1.4440125560629393
Energy: 1.7251569858607512
Energy: 1.6345563972519366
Energy: 1.6314842762744928
Energy: 1.7116347416768014
Energy: 1.633830431503301
Energy: 1.665331420809179
Energy: 1.2047240081645538
Energy: 1.3793659668499771
Energy: 1.4246944235236971
Energy: 1.204552648594611
Energy: 1.5957118284039336
Energy: 1.428652436212837
Energy: 1.225712478003486
Energy: 1.3636646449982848
Energy: 1.3811339477505036
Energy: 1.2282314770611504
Energy: 1.3807851827457391
Energy: 1.2904844342721897
Energy: 1.230490004135009
Energy: 1.3825436012954346
Energy: 1.4094370197059383
Energy: 1.230300931368642
Energy: 1.371896083320641
Energy: 1.3887809088408536
Energy: 1.6041265553506638
Energy: 1.4321740606500155
Energy: 1.431848805270393
Energy: 1.5978351678869434
Energy: 1.4411448129557098
Energy: 1.5019815331368134
Energy: 1.2452084085563409
Energy: 1.3619616895240394
Energy: 1.3982769887682347
Energy: 1.2451808989044948
Energy: 1.35783513144563
Energy: 1.3588847720004125
Energy: 1.4236492049002882
Energy: 1.788414907467197
Energy: 1.734580355366323
Energy: 1.4484289818633878
Energy: 1.829696038254933
Energy: 1.5088185525806161
Energy: 1.4361740564037477
Energy: 1.6178747569980096
Energy: 1.4827402395488773
Energy: 1.4900160206031539
Energy: 1.2952576318209856
Energy: 1.4194655927883124
Energy: 1.2651195801683648
Energy: 1.3354858486077223
Energy: 1.3912342889681248
Energy: 1.265381405783783
Energy: 1.403936282968722
Energy: 1.419392606444449
Energy: 1.868022342340164
Energy: 1.4238258149773355
Energy: 1.6450400816908883
Energy: 1.8406866035721667
Energy: 1.453272789038217
Energy: 1.6205696499277156
Energy: 1.4005591417582752
Energy: 1.2664743249247579
Energy: 1.3336744331067711
Energy: 1.40185219418247
Energy: 1.2350065166738504
Energy: 1.3919761818747345
Energy: 1.4330827869781044
Energy: 1.6247671537982042
Energy: 1.559770272487671
Energy: 1.4401778912316054
Energy: 1.519873014910878
Energy: 1.5569897192023692
Energy: 1.502633936407819
Energy: 1.3446083306701877
Energy: 1.3995803815365593
Energy: 1.3760154418064692
Energy: 1.224005315242333
Energy: 1.4097416802054268
Energy: 1.4473388207761761
Energy: 1.2402938841439408
Energy: 1.24040257577925
Energy: 1.3811243443429542
Energy: 1.243112477750233
Energy: 1.331388165443739
Energy: 1.6025060419728492
Energy: 1.3788392937875307
Energy: 1.4073733768913534
Energy: 1.5407511667557565
Energy: 1.2370155011385702
Energy: 1.4211700612587377
Energy: 1.6270285937440694
Energy: 1.6372949232487974
Energy: 1.6164490618862268
Energy: 1.6302253140440002
Energy: 1.602696002345697
Energy: 1.5544050962857034
Energy: 1.5533179010655414
Energy: 1.2194382601246905
Energy: 1.295067958911157
Energy: 1.5430535346897793
Energy: 1.219464054456188
Energy: 1.4007722509625649
Energy: 2.0410256497081165
Energy: 1.2933712162206616
Energy: 1.6724165333396293
Energy: 2.0450605980475434
Energy: 1.3153136951005515
Energy: 1.511405204753603

minimum gb energy = 1.2031928664744131 eV
minimum distance =  2.50943567444045 Angstroms
sigma value = 57


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

Energy: 1.8302096175476112
Energy: 1.5402384120379131
Energy: 1.628292879910432
Energy: 1.8341981720003109
Energy: 2.114768807148099
Energy: 1.7500615852684782
Energy: 1.0996112067489394
Energy: 1.3641043341623724
Energy: 1.3775762524841633
Energy: 1.249964297613438
Energy: 1.3115950429893393
Energy: 1.3674026470136995
Energy: 1.3094109629346198
Energy: 1.5290436494823199
Energy: 1.427879488522946
Energy: 1.3096101626294439
Energy: 1.523471934389895
Energy: 1.3681127351152265
Energy: 1.407967935173482
Energy: 1.4527171817285243
Energy: 1.3125255364481132
Energy: 1.409530598833547
Energy: 1.7576434791066495
Energy: 1.3136056537100345
Energy: 1.327032039671002
Energy: 1.369480177355492
Energy: 1.5538108816618594
Energy: 1.2926322767291958
Energy: 1.3542735655859253
Energy: 1.5365964032137913
Energy: 1.5152717924324577
Energy: 1.5088109711328694
Energy: 1.5521538456896613
Energy: 1.5166344323307415
Energy: 1.5108092710230003
Energy: 1.5504345652206704
Energy: 1.3255411661070875
Energy: 1.1791322485026865
Energy: 1.337855577590134
Energy: 1.3274613395921908
Energy: 1.183780332987255
Energy: 1.480811609844692
Energy: 1.312810508486712
Energy: 1.3541205593816439
Energy: 1.4266462058738651
Energy: 1.279850722954468
Energy: 1.312410987256288
Energy: 1.3149272677349935
Energy: 1.1000460469082518
Energy: 1.393135954684265
Energy: 1.6175346041076817
Energy: 1.3935265136732045
Energy: 1.3954968356941817
Energy: 1.6205640008763544
Energy: 1.0996298653007348
Energy: 1.4314708855301963
Energy: 1.6180887391636443
Energy: 1.224485394410449
Energy: 1.430966017422509
Energy: 1.6211594264952047
Energy: 1.312483913563721
Energy: 1.4565551317260763
Energy: 1.427241515516906
Energy: 1.2800133364180746
Energy: 1.360417453565503
Energy: 1.3148991088590891
Energy: 1.3960770673518026
Energy: 1.5129356292963478
Energy: 1.5064509460507782
Energy: 1.3289697937868779
Energy: 1.5064719042669965
Energy: 1.87928536164207
Energy: 1.3303856528454416
Energy: 1.4344404382679206
Energy: 1.4140056505365872
Energy: 1.152733950089749
Energy: 1.4289671015604781
Energy: 1.4156278488952747
Energy: 1.7082955060566931
Energy: 1.326299160598136
Energy: 1.552006440824854
Energy: 1.6520912206270657
Energy: 1.3281548825397897
Energy: 1.5554470923124941
Energy: 1.3258202540684623
Energy: 1.1987640459957651
Energy: 1.450749646104701
Energy: 1.3431993914719957
Energy: 1.4448761201128908
Energy: 1.429850450206726
Energy: 1.2939335177398925
Energy: 1.1993221113221546
Energy: 1.3055698944968284
Energy: 1.2960927025103506
Energy: 1.2027014240134246
Energy: 1.379827128073671
Energy: 1.0997511669392852
Energy: 1.2176809479412976
Energy: 1.3002802748477176
Energy: 1.0999234479561255
Energy: 1.2196486816555454
Energy: 1.3678435830317182

minimum gb energy = 1.0996112067489394 eV
minimum distance =  2.52937843587282 Angstroms
sigma value = 9


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

Energy: 2.060096237034733
Energy: 1.6048080989649283
Energy: 1.7278774984003173
Energy: 2.064102768836604
Energy: 2.133012131183275
Energy: 1.8806807694586405
Energy: 1.5418119850460488
Energy: 1.532685389583926
Energy: 1.4745512131243879
Energy: 1.5667579326955547
Energy: 1.5138576071999843
Energy: 1.4827395373116226
Energy: 1.5120558525745136
Energy: 1.5150738821938834
Energy: 1.553338961591338
Energy: 1.5136332036856923
Energy: 1.5207548159625197
Energy: 1.5398847038045604
Energy: 1.508014642597437
Energy: 1.4744949917793118
Energy: 1.438503268644201
Energy: 1.5098661313504202
Energy: 1.4344067893362702
Energy: 1.451751046083965
Energy: 1.4107683691916177
Energy: 1.36242355658565
Energy: 1.4062902095229173
Energy: 1.410851309565037
Energy: 1.3482611712750456
Energy: 1.3941750062896596
Energy: 1.329696041555134
Energy: 1.3671057966227262
Energy: 1.3404751540837825
Energy: 1.314267979132694
Energy: 1.356000745860643
Energy: 1.3675526468993484
Energy: 1.4875853893253448
Energy: 1.644576056111736
Energy: 1.412585242459868
Energy: 1.4701156463451612
Energy: 1.6457115204516202
Energy: 1.4139706226004916
Energy: 1.4802226904688875
Energy: 1.4147564924375697
Energy: 1.4532115855927588
Energy: 1.4815990595069428
Energy: 1.511328449752487
Energy: 1.4674926755673436
Energy: 1.7738230184972454
Energy: 1.493992246882269
Energy: 1.525787350318404
Energy: 1.7776657916084375
Energy: 1.5643542836131739
Energy: 1.5546699146239635
Energy: 1.8050851644756052
Energy: 1.4894319225072812
Energy: 1.5307112419401163
Energy: 1.5719924095582165
Energy: 1.4840482003095572
Energy: 1.568636089964164
Energy: 1.4232493489064497
Energy: 1.4242433193016828
Energy: 1.3951583119431687
Energy: 1.4246724780255615
Energy: 1.4004806965978343
Energy: 1.3843878028438792
Energy: 1.3614958278682157
Energy: 1.4334133543638337
Energy: 1.40491936391852
Energy: 1.3603057316204687
Energy: 1.3969068912478857
Energy: 1.4304171622862127
Energy: 1.6980262221817588
Energy: 1.4386034339499505
Energy: 1.4878149196202362
Energy: 1.6062054803945616
Energy: 1.4546891353876252
Energy: 1.625228437494836
Energy: 1.6207720577772176
Energy: 1.526967372945225
Energy: 1.5623200404374513
Energy: 1.6237944453515987
Energy: 1.5518135716461336
Energy: 1.548329132772645
Energy: 1.5828169837780506
Energy: 1.5794484402318782
Energy: 1.588732360933235
Energy: 1.5839885221705694
Energy: 1.6235377072013457
Energy: 1.5152701357225233
Energy: 1.6690317673428472
Energy: 1.742813382236335
Energy: 1.5507027870629162
Energy: 1.669276413714366
Energy: 1.7699030761940295
Energy: 1.5385382342408955
Energy: 1.5506328507439837
Energy: 1.5080053982052728
Energy: 1.5088877307921333
Energy: 1.4231279289778562
Energy: 1.498584938748729
Energy: 1.512283526165532
Energy: 1.5507222248797476
Energy: 1.4185745248189376
Energy: 1.516972423611804
Energy: 1.550533619497401
Energy: 1.4251666674344385
Energy: 1.5490060964403518
Energy: 1.4594598243854005
Energy: 1.5229624691133623
Energy: 1.5774374578160524
Energy: 1.4611108947031985
Energy: 1.406181744020207
Energy: 1.577253373044127
Energy: 1.501245441614056
Energy: 1.516344466587901
Energy: 1.5170906403522624
Energy: 1.5017306858122927
Energy: 1.4615662751356382
Energy: 1.508020884095737
Energy: 1.7295775247930565
Energy: 1.532055806159956
Energy: 1.580150056240456
Energy: 1.504884473085364
Energy: 1.5637159783319599
Energy: 1.4263897817907085

minimum gb energy = 1.314267979132694 eV
minimum distance =  2.52613607503125 Angstroms
sigma value = 27


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

Energy: 1.3029598174792092
Energy: 1.3874395560174142
Energy: 1.3911809829369566
Energy: 1.306570250216498
Energy: 1.7960801052097872
Energy: 1.3759076358603455
Energy: 1.4215259553472817
Energy: 1.3954328512836658
Energy: 1.396694837688488
Energy: 1.4931016289712835
Energy: 1.3944780323751844
Energy: 1.4094300202464942
Energy: 1.3359582006357278
Energy: 1.3809742186358474
Energy: 1.3810727024374116
Energy: 1.3374896446640416
Energy: 1.3113127141108067
Energy: 1.358160222906801
Energy: 1.452050178047381
Energy: 1.4340530242424614
Energy: 1.4431907048715538
Energy: 1.453901490984442
Energy: 1.391881186625284
Energy: 1.3961472967199395
Energy: 1.328829572647817
Energy: 1.399566403824366
Energy: 1.39529992820693
Energy: 1.3299552732635873
Energy: 1.3642011749425706
Energy: 1.3815819236484403
Energy: 1.3335480454379467
Energy: 1.5371086223153954
Energy: 1.4067205880750207
Energy: 1.3353480730832925
Energy: 1.4649816476583228
Energy: 1.4062567518426647
Energy: 1.342883159012394
Energy: 1.3138334170887662
Energy: 1.3743997995321597
Energy: 1.3435201612321601
Energy: 1.3088127403452567
Energy: 1.3751578793136892
Energy: 1.3484435581834842
Energy: 1.3045801628401332
Energy: 1.4092464201274146
Energy: 1.382289039024956
Energy: 1.3039434871741655
Energy: 1.3738692561502397
Energy: 1.5782548981670033
Energy: 1.3813718121506593
Energy: 1.381287232479829
Energy: 1.5289572866661634
Energy: 1.3368592502166083
Energy: 1.3843693901982916
Energy: 1.5787434547673012
Energy: 1.3410567804727067
Energy: 1.3835092240810192
Energy: 1.3925102943750185
Energy: 1.3354980947103263
Energy: 1.3878941634365574
Energy: 1.3273238847442639
Energy: 1.3642512561877647
Energy: 1.363845062124542
Energy: 1.3278426218893689
Energy: 1.3314901633860434
Energy: 1.3836460611995347
Energy: 1.4585285316263066
Energy: 1.341669077706588
Energy: 1.4039918888561647
Energy: 1.4601767281020535
Energy: 1.3356232106041959
Energy: 1.4030844365988828
Energy: 1.3095618551065278
Energy: 1.3854889231964778
Energy: 1.3853950047746906
Energy: 1.3107739225403199
Energy: 1.3478342135989645
Energy: 1.375351950471257
Energy: 1.5201634087367728
Energy: 1.3851582802356956
Energy: 1.376488564719243
Energy: 1.3044871738532466
Energy: 1.3815257387098459
Energy: 1.4085866535060694
Energy: 1.7149528045270672
Energy: 1.4384785722032247
Energy: 1.4383758310198582
Energy: 1.4648078100322177
Energy: 1.4337401840343402
Energy: 1.4435660452092671
Energy: 1.3352140989767658
Energy: 1.381640970606691
Energy: 1.381176636239106
Energy: 1.3365971766632065
Energy: 1.4386202459917286
Energy: 1.3806704542963149
Energy: 1.330015921613975
Energy: 1.3805718257918642
Energy: 1.4256887119990762
Energy: 1.331512620145822
Energy: 1.3805081802170862
Energy: 1.4122005958604706
Energy: 1.334302497248716
Energy: 1.5305498324213147
Energy: 1.4139408813464533
Energy: 1.3356653018766504
Energy: 1.462020703243452
Energy: 1.4032737646070639
Energy: 1.4187798930342108
Energy: 1.3041345582145412
Energy: 1.370869801898052
Energy: 1.344173693141021
Energy: 1.3037918203087078
Energy: 1.3710714098255863
Energy: 1.3451239717732781
Energy: 1.3040737316796605
Energy: 1.3708954752703377
Energy: 1.347054521898158
Energy: 1.30349832290156
Energy: 1.37073579892788
Energy: 1.5785301642386034
Energy: 1.5081175211589102
Energy: 1.3951603624698012
Energy: 1.578584225358672
Energy: 1.4731188514198
Energy: 1.441451527319204
Energy: 1.3078441716478062
Energy: 1.3333350103783386
Energy: 1.3798015545212283
Energy: 1.3077092866435764
Energy: 1.3327530783628871
Energy: 1.380091714198111
Energy: 1.583759358857808
Energy: 1.4079683177144555
Energy: 1.4086911492936
Energy: 1.396117773434777
Energy: 1.407796813456569
Energy: 1.438661377301692
Energy: 1.4620192492942943
Energy: 1.3808579871590072
Energy: 1.4055981503210784
Energy: 1.4632552472072158
Energy: 1.3343374098901164
Energy: 1.4034987688891838
Energy: 1.523185708228985
Energy: 1.3527807435039843
Energy: 1.3958244118753835
Energy: 1.3040039875456784
Energy: 1.3465081141189597
Energy: 1.370826807444084

minimum gb energy = 1.3029598174792092 eV
minimum distance =  2.52966394721025 Angstroms
sigma value = 19


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

Energy: 1.9826476417586516
Energy: 1.8301551523177038
Energy: 1.8824889495402624
Energy: 1.9855477006934283
Energy: 2.246690940113411
Energy: 1.9654790631637251
Energy: 1.55821812706957
Energy: 1.5035420913135007
Energy: 1.5131532866641615
Energy: 1.723487533943835
Energy: 1.4904673894230835
Energy: 1.484674692630085
Energy: 1.477793274866123
Energy: 1.4966111705301977
Energy: 1.5112808161340354
Energy: 1.4515607090696843
Energy: 1.4639498788507688
Energy: 1.507821855798195
Energy: 1.5516160686535956
Energy: 1.5061928071962603
Energy: 1.468660603133525
Energy: 1.4869460048982075
Energy: 1.490477120662279
Energy: 1.4673976661025976
Energy: 1.3490671912329497
Energy: 1.4844445552791317
Energy: 1.533682598334873
Energy: 1.3521045622591135
Energy: 1.483017019101795
Energy: 1.5408963147706851
Energy: 1.5630446440609675
Energy: 1.6263856883187613
Energy: 1.471627522440242
Energy: 1.57116949057188
Energy: 1.569491422566405
Energy: 1.472918186173894
Energy: 1.3626621247693351
Energy: 1.7101032253701092
Energy: 1.6440099403819435
Energy: 1.3625392238793435
Energy: 1.8875397877532838
Energy: 1.5805831622757118
Energy: 1.64502772498602
Energy: 1.5044932568894769
Energy: 1.5104488796206301
Energy: 1.4955927505770858
Energy: 1.5619849273720563
Energy: 1.519479478700806
Energy: 1.3189352637515763
Energy: 1.4382209851510623
Energy: 1.444267990029196
Energy: 1.3195224814650521
Energy: 1.4054599785350403
Energy: 1.433029295422636
Energy: 1.3719646414503819
Energy: 1.4338986322822247
Energy: 1.4757846763971862
Energy: 1.4416027469938826
Energy: 1.4420243291374688
Energy: 1.4485661206786853
Energy: 1.5221671105061243
Energy: 1.6523260776227124
Energy: 1.6354254020586139
Energy: 1.4919313717198477
Energy: 1.6140114472381617
Energy: 1.6518342280121543
Energy: 1.5129337127872406
Energy: 1.4592705598364086
Energy: 1.4770589394834661
Energy: 1.4381704537844942
Energy: 1.4621491651457543
Energy: 1.4740324600859482
Energy: 1.7871670131086688
Energy: 1.3406180770332605
Energy: 1.330639468219637
Energy: 1.7902055273555568
Energy: 1.332665633347814
Energy: 1.4237245215973047
Energy: 1.7529560766440249
Energy: 1.3906784553554623
Energy: 1.5029002524521649
Energy: 1.6085723482557306
Energy: 1.4006730997829744
Energy: 1.505010723593278
Energy: 1.382802277427169
Energy: 1.3215694539050655
Energy: 1.4329651745378875
Energy: 1.3673287370348317
Energy: 1.2820599305959484
Energy: 1.422869164301284
Energy: 1.4546783191486754
Energy: 1.383179130588776
Energy: 1.4278079296416606
Energy: 1.420846424902032
Energy: 1.3155924584021255
Energy: 1.4509318333514998
Energy: 1.67863178070639
Energy: 1.402487716933107
Energy: 1.4236469709046728
Energy: 1.6804944886515005
Energy: 1.3956781982092936
Energy: 1.5002138128416886
Energy: 1.7108404120805467
Energy: 1.4088151660658523
Energy: 1.4886106656841878
Energy: 1.5066911365662692
Energy: 1.4204394537890908
Energy: 1.465731136904351
Energy: 1.3923765750505583
Energy: 1.494802907446299
Energy: 1.5968361081251101
Energy: 1.3947293691184124
Energy: 1.4762752387450737
Energy: 1.4361527078970289
Energy: 1.411055191868939
Energy: 1.565032943853436
Energy: 1.622165318004856
Energy: 1.4136035299226712
Energy: 1.5645133570438625
Energy: 1.4321220631432723
Energy: 1.2916882694567429
Energy: 1.3883403977304913
Energy: 1.44616240982839
Energy: 1.2914830449590313
Energy: 1.3882753032182644
Energy: 1.4340745966864286
Energy: 1.3455391554532516
Energy: 1.446709017893936
Energy: 1.4607624742118304
Energy: 1.344923961953503
Energy: 1.4152427308621365
Energy: 1.440574778085217
Energy: 1.3597227915645411
Energy: 1.6129182543359246
Energy: 1.5318817822068176
Energy: 1.3599458804268174
Energy: 1.6168278506056502
Energy: 1.3790975630428914
Energy: 1.4542983204981081
Energy: 1.5346325383213897
Energy: 1.5260140638087507
Energy: 1.3531902992579194
Energy: 1.567144057924399
Energy: 1.3818340719142508
Energy: 1.5453964158655566
Energy: 1.4240614321432765
Energy: 1.481973567641527
Energy: 1.4570192910740938
Energy: 1.441446580755265
Energy: 1.5063184954233597
Energy: 1.460439191955398
Energy: 1.4997050408628725
Energy: 1.4740063046626553
Energy: 1.4619023926790142
Energy: 1.497461674313879
Energy: 1.5177162344559094
Energy: 1.4460546625409623
Energy: 1.40053205422673
Energy: 1.4400893548892209
Energy: 1.4296880475083562
Energy: 1.3546344456706727
Energy: 1.4767889384347372
Energy: 1.5070247393172227
Energy: 1.3511356418083236
Energy: 1.4345362014231184
Energy: 1.4844059175610937
Energy: 1.3510752124062315
Energy: 1.4601030922593352
Energy: 1.8501352389656747
Energy: 1.460546339225978
Energy: 1.51648084659308
Energy: 1.602202839970919
Energy: 1.3875490031120727
Energy: 1.3929467964168056

minimum gb energy = 1.2820599305959484 eV
minimum distance =  2.5313090350663 Angstroms
sigma value = 101


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

Energy: 1.8576021490473322
Energy: 1.9175687416220208
Energy: 1.9182440744110434
Energy: 1.8602825320185596
Energy: 2.1599557939436083
Energy: 1.7051159342688533
Energy: 1.4589555960838916
Energy: 1.4067156335436397
Energy: 1.4715059082990105
Energy: 1.64812827896914
Energy: 1.3444412437870061
Energy: 1.445343338727986
Energy: 1.4769028178177364
Energy: 1.522621752661337
Energy: 1.5513797256219717
Energy: 1.4785243159731483
Energy: 1.4766909287658516
Energy: 1.447487567009723
Energy: 1.4342810294557031
Energy: 1.461605535315896
Energy: 1.3969734439950234
Energy: 1.4937967576239743
Energy: 1.458262518026327
Energy: 1.3912033687397645
Energy: 1.2579892363941918
Energy: 1.5029296721542968
Energy: 1.6148805166744689
Energy: 1.2607730145812794
Energy: 1.5075973517636343
Energy: 1.4110862986162351
Energy: 1.4022242510989418
Energy: 1.4588327029813146
Energy: 1.413300129123004
Energy: 1.4022375527804418
Energy: 1.5757306779694722
Energy: 1.4130280978741554
Energy: 1.3952851716189987
Energy: 1.8885450981483132
Energy: 1.9205808553105526
Energy: 1.3950213608150266
Energy: 1.888014762184291
Energy: 1.7857544427775371
Energy: 1.391247655072231
Energy: 1.4453264358231603
Energy: 1.4139861891395802
Energy: 1.4790583520212017
Energy: 1.4548983637232562
Energy: 1.4712597699918248
Energy: 1.2353105505358197
Energy: 1.4693016988945082
Energy: 1.4435803061951429
Energy: 1.2371874148652797
Energy: 1.416528135878797
Energy: 1.389764699939577
Energy: 1.2313779435309744
Energy: 1.4591509882008362
Energy: 1.4373248172937823
Energy: 1.2312469088846134
Energy: 1.4363976014050317
Energy: 1.4047142365072753
Energy: 1.5733819456598979
Energy: 1.755570694879193
Energy: 1.7500357457167448
Energy: 1.5320607251773275
Energy: 1.759521465193982
Energy: 1.6583496492908074
Energy: 1.4505840724632038
Energy: 1.4498831478283587
Energy: 1.427198985205248
Energy: 1.4137623884452366
Energy: 1.4321702553510303
Energy: 1.4061400769001584
Energy: 1.57219887126759
Energy: 1.404609676011663
Energy: 1.4426432782511311
Energy: 1.573736174990355
Energy: 1.4093555942271703
Energy: 1.516270098373497
Energy: 1.7225318567636758
Energy: 1.4060062107419826
Energy: 1.4274993054360587
Energy: 1.4613066212672388
Energy: 1.5764857245554222
Energy: 1.4440291245966255
Energy: 1.384798854776603
Energy: 1.2900040382155722
Energy: 1.408643776457041
Energy: 1.3870073852047615
Energy: 1.2363445256511565
Energy: 1.4095328948340222
Energy: 1.537362811340003
Energy: 1.3075444461162813
Energy: 1.368096091376521
Energy: 1.5367168799814184
Energy: 1.371641100205777
Energy: 1.4105961987186657
Energy: 1.8698491627751004
Energy: 1.373185160983461
Energy: 1.386042230494527
Energy: 1.8624559938978724
Energy: 1.3999445090131684
Energy: 1.730397104991333
Energy: 1.4529041882934086
Energy: 1.4962570798727086
Energy: 1.4347274960006922
Energy: 1.4532844032710692
Energy: 1.5127081071737092
Energy: 1.4838201302942124
Energy: 1.478232966072921
Energy: 1.5461196203867842
Energy: 1.5818751681640801
Energy: 1.4768830862417663
Energy: 1.307622308340646
Energy: 1.5808215764584077
Energy: 1.4933168535643964
Energy: 1.5240395828480762
Energy: 1.5572245500965947
Energy: 1.50568493475265
Energy: 1.5314293441382387
Energy: 1.5089468400007835
Energy: 1.2612393523653922
Energy: 1.4590297339718494
Energy: 1.492882197639696
Energy: 1.2634308806831684
Energy: 1.4622412793873858
Energy: 1.4169466818211047
Energy: 1.4035869239777694
Energy: 1.474420356555918
Energy: 1.4440250501936132
Energy: 1.327745710622026
Energy: 1.544869788336912
Energy: 1.4154940255535313
Energy: 1.3938359246902252
Energy: 1.5528648938025107
Energy: 1.5321014646375684
Energy: 1.3690166719737829
Energy: 1.6066409177571253
Energy: 1.5326614699233378
Energy: 1.463203385413153
Energy: 1.449232992146226
Energy: 1.5796375046355746
Energy: 1.463429826438496
Energy: 1.488294176722721
Energy: 1.4375737588667483
Energy: 1.230969129413682
Energy: 1.4153169522400129
Energy: 1.4110082405781108
Energy: 1.2313007056853627
Energy: 1.4658436714806038
Energy: 1.3877261427894463
Energy: 1.2307126451720105
Energy: 1.4058463866479427
Energy: 1.4515835679421167
Energy: 1.231290216573674
Energy: 1.4102134475259571
Energy: 1.4364004619639505
Energy: 1.4953099423416878
Energy: 1.6670537342265928
Energy: 1.6880777327456464
Energy: 1.4969618424322568
Energy: 1.6818750054367888
Energy: 1.6595067105441277
Energy: 1.4310504690540462
Energy: 1.4119076695606085
Energy: 1.4667225034918816
Energy: 1.4326267087759164
Energy: 1.6777812766884794
Energy: 1.4743551733586373
Energy: 1.481064754305217
Energy: 1.4048313581468048
Energy: 1.4423121909647534
Energy: 1.4786560552449137
Energy: 1.4069049348984053
Energy: 1.4705765703878797
Energy: 1.5620185676500469
Energy: 1.4176506243058735
Energy: 1.4258400530901674
Energy: 1.5637953678324577
Energy: 1.4494144050724949
Energy: 1.465571903022826
Energy: 1.3999452058549438
Energy: 1.2872246579061954
Energy: 1.4132541465517385
Energy: 1.3994192596813941
Energy: 1.2322122596675866
Energy: 1.4305198814276976
Energy: 1.5361782645173565
Energy: 1.3074674153724373
Energy: 1.3745361302976353
Energy: 1.5368134959175572
Energy: 1.3068351329787697
Energy: 1.440557623516346
Energy: 1.7515749220418173
Energy: 1.3898012383921554
Energy: 1.429280750585896
Energy: 1.7515881399043498
Energy: 1.4397896990964374
Energy: 1.4538304282231345

minimum gb energy = 1.2307126451720105 eV
minimum distance =  2.51854444069357 Angstroms
sigma value = 33


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

Energy: 0.02144314960629018
Energy: 0.02296334950834871
Energy: 0.023653284290911014
Energy: 0.024459620049366772
Energy: 0.8870009866622616
Energy: 0.02228623093476019
Energy: 0.022494448859992328
Energy: 0.13589223641424572
Energy: 0.13342921546137002
Energy: 0.1335420642110194
Energy: 0.13308433720891852
Energy: 0.1330588912252784
Energy: 1.5489437038422729
Energy: 0.8844719846917527
Energy: 0.8829260935660186
Energy: 0.8819790579466644
Energy: 1.3790203817518667
Energy: 0.8840280861725698
Energy: 0.8018387940475785
Energy: 0.13589223641390996
Energy: 0.13342921546137002
Energy: 0.13354206421064174
Energy: 0.13308433720854085
Energy: 0.1330588912252784

minimum gb energy = 0.02144314960629018 eV
minimum distance =  2.73564568191373 Angstroms
sigma value = 1