Model name: model_name=EAM_Dynamo_TehranchiCurtin_2010_NiH__MO_535504325462_003
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5240105092525478
cohesive_energy=4.528250525522021
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.9364067016187398e-19, 2.8432066329300595e-19, 3.5270156203212596e-19, 4.08672000564282e-19, 4.546929221992979e-19, 4.93513662041118e-19, 5.268277207918799e-19, 5.55702148089828e-19, 5.80880353893138e-19, 6.0290868043400395e-19, 6.22200489283998e-19, 6.39090635359626e-19, 6.5411264348001e-19, 6.679730735407439e-19, 6.804043620439499e-19, 6.910748584263899e-19, 7.00000584454404e-19, 7.073321447315879e-19, 7.132329612746099e-19, 7.178424234506279e-19, 7.21279092330558e-19, 7.236407006890739e-19, 7.250073573578761e-19, 7.25447955932226e-19, 7.24978518178464e-19, 7.23467665612602e-19, 7.2074716968807e-19, 7.166135539723499e-19, 7.108345028535119e-19, 7.03209744252306e-19, 6.935293930296779e-19, 6.81338431021572e-19, 6.659959875743879e-19, 6.46785889732728e-19, 6.2291025353286e-19, 5.934478274102339e-19, 5.57262668131344e-19, 5.129400537283679e-19, 4.5869515943103e-19, 3.9272553652607997e-19, 3.12709631070852e-19, 2.1369191073638399e-19, 8.981786188437658e-20, -6.58882323319428e-20, -2.62487802301488e-19, -5.116342797716579e-19, -8.322506525312999e-19, -1.25000218808046e-18]
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: 0.01837696221545482
Energy: 0.5528562775840269
Energy: 0.018857338861362552
Energy: 0.018666062812157682
Energy: 11.661601697416412
Energy: 0.0187277214118442
Energy: 0.5528562775840269
Energy: 0.15883336045695773
Energy: 0.15883884206766505
Energy: 11.656118224332573
Energy: 0.1589271322492358
Energy: 0.16027862206253346
Energy: 0.01885733886231592
Energy: 0.15883884206766505
Energy: 0.16028184899545936
Energy: 0.018861065402040772
Energy: 0.15881527469170123
Energy: 11.65925675491517
Energy: 0.018666062812487696
Energy: 11.659390931831862
Energy: 0.018861065401380748
Energy: 0.01869393652328727
Energy: 11.6635223692466
Energy: 0.018761423433712458
Energy: 11.66166030435228
Energy: 0.1589271322492358
Energy: 0.15881527469137122
Energy: 11.68659403606636
Energy: 0.15892149539597328
Energy: 0.1588120077718549
Energy: 0.01872772141151419
Energy: 0.16027862206286347
Energy: 11.65925870858549
Energy: 0.018761423434665823
Energy: 0.1588120077718549
Energy: 0.01882920928312122

minimum gb energy = 0.01837696221545482 eV
minimum distance =  2.48906718810499 Angstroms
sigma value = 1


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

Energy: 1.6076683935710978
Energy: 1.095845528905568
Energy: 1.1243339170949338
Energy: 1.1306221428754872
Energy: 1.1084939832941967
Energy: 1.124432456673272
Energy: 1.4880374429850942
Energy: 1.0450339653097855
Energy: 1.0236247695695817
Energy: 1.0876388075365637
Energy: 1.0662920871068102
Energy: 1.024362130287425
Energy: 1.5250370351266176
Energy: 1.034259747867836
Energy: 1.0340054829355922
Energy: 1.05193477776288
Energy: 1.065921799690039
Energy: 1.0620069443867681
Energy: 1.642876686682712
Energy: 1.061825055355765
Energy: 1.0590731149478554
Energy: 1.0607909535817222
Energy: 1.0333541666811061
Energy: 1.059091106760741
Energy: 1.5055858257057357
Energy: 1.0954654312098109
Energy: 1.088394220079023
Energy: 1.0901568457365716
Energy: 1.0951210346919078
Energy: 1.0895829129148544
Energy: 1.4811728739411139
Energy: 1.0942719543694646
Energy: 1.0877368094422941
Energy: 1.088897798184255
Energy: 1.09364207303605
Energy: 1.0891837603390642
Energy: 1.4815148793906245
Energy: 1.0880443806997315
Energy: 1.0877210096996972
Energy: 1.07976545231109
Energy: 1.093373311910527
Energy: 1.0887001870315316
Energy: 1.4079639089802312
Energy: 1.093156896995448
Energy: 1.097478421364478
Energy: 1.0783158849638212
Energy: 1.0927226342228826
Energy: 1.0881882078091165
Energy: 1.2059136460460171
Energy: 1.0895981342084256
Energy: 1.0911005969904628
Energy: 1.0957091312607659
Energy: 1.0896817180188134
Energy: 1.0870628691033881
Energy: 1.2055480127158744
Energy: 1.104632656632428
Energy: 1.0891269443900111
Energy: 1.094566430215303
Energy: 1.1045204896344558
Energy: 1.0898074820363257
Energy: 1.26634390060993
Energy: 1.0698678615050825
Energy: 1.0702439968526012
Energy: 1.1045562970205065
Energy: 1.0697022547472421
Energy: 1.0431626096655915
Energy: 1.135173551669302
Energy: 1.0619484745338488
Energy: 1.0620915116751006
Energy: 1.0704621209323841
Energy: 1.0720654396812117
Energy: 1.0337721920842318
Energy: 1.134601929042841
Energy: 1.0887434643513032
Energy: 1.0894155757424524
Energy: 1.0877113785363735
Energy: 1.0763912332425016
Energy: 1.0230475484518171
Energy: 1.2521566251052298
Energy: 1.0587318736885871
Energy: 1.0590325905622282
Energy: 1.086381703828398
Energy: 1.0534346745788723
Energy: 1.0462339170140396
Energy: 1.1494165216115593
Energy: 1.1059991013437867
Energy: 1.0506178238526283
Energy: 1.0602595736632292
Energy: 1.1044704518419521
Energy: 1.0499753529683005
Energy: 1.1488832133658118
Energy: 1.0605951633522264
Energy: 1.0614515505240931
Energy: 1.063400959635205
Energy: 1.0611295534954448
Energy: 1.0605355199004454
Energy: 1.3286561379276627
Energy: 1.0864826794481075
Energy: 1.0869103121207169
Energy: 1.060585367800813
Energy: 1.0870600104670658
Energy: 1.0604494259867727
Energy: 1.3315443097240498
Energy: 1.1070239497420704
Energy: 1.104688581213022
Energy: 1.1047691386909868
Energy: 1.0864063745087502
Energy: 1.096978595669552
Energy: 1.3314057252384288
Energy: 1.1055791679420728
Energy: 1.0966192966891362
Energy: 1.1045701129428356
Energy: 1.1048510598489398
Energy: 1.0976312600300073
Energy: 1.4551962228366844
Energy: 1.1085790809612202
Energy: 1.1047430033335766
Energy: 1.1043324619637502
Energy: 1.1049948371410778
Energy: 1.095892752311915
Energy: 1.5533359986825388
Energy: 1.0600929394153757
Energy: 1.0704457179986684
Energy: 1.0727794192008662
Energy: 1.0337686836785165
Energy: 1.0701839881557076
Energy: 1.558990708314777
Energy: 1.0616051659337993
Energy: 1.0605798893908875
Energy: 1.0554083137406682
Energy: 1.0605083990030992
Energy: 1.0623040105850072
Energy: 1.554195086273953
Energy: 1.064512140257571
Energy: 1.0503042874239814
Energy: 1.0940096572959883
Energy: 1.0596736758955785
Energy: 1.0522248832466468

minimum gb energy = 1.0230475484518171 eV
minimum distance =  2.27541060523457 Angstroms
sigma value = 33


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

Energy: 1.9862105529110936
Energy: 1.102360601700731
Energy: 1.0967787090683951
Energy: 1.1157877760508228
Energy: 1.1335039055651763
Energy: 1.1501259384123237
Energy: 1.473772296741386
Energy: 1.0616001598163
Energy: 1.0533848553391258
Energy: 1.1123324459591548
Energy: 1.07295553860881
Energy: 1.0514923680627928
Energy: 1.467705025046593
Energy: 1.060363318039929
Energy: 1.0825789330337883
Energy: 1.1083497598016463
Energy: 1.0815482277238337
Energy: 1.059320018745
Energy: 1.592027303055142
Energy: 1.154222940044635
Energy: 1.0771188744203146
Energy: 1.1016816862662846
Energy: 1.0832987255637805
Energy: 1.1052994092990223
Energy: 1.4716151595534515
Energy: 1.1093268334926498
Energy: 1.1095471172796663
Energy: 1.1313879494070445
Energy: 1.1337257114190098
Energy: 1.1910918990442163
Energy: 1.5782295041815178
Energy: 1.1830273607239188
Energy: 1.1795459200502443
Energy: 1.1807251372488021
Energy: 1.1833242153116008
Energy: 1.1822330515626605
Energy: 1.576654184493624
Energy: 1.1730099407841095
Energy: 1.1789462032066698
Energy: 1.1798425578907201
Energy: 1.1724785280241266
Energy: 1.1804771392779374
Energy: 1.471629080885443
Energy: 1.1480983196607812
Energy: 1.1516474703691015
Energy: 1.165375239701337
Energy: 1.1469695954693524
Energy: 1.1513105707588853
Energy: 1.3093685330479414
Energy: 1.1511987055076094
Energy: 1.1880241950851296
Energy: 1.2004837722449988
Energy: 1.1462467273088204
Energy: 1.193436793322371
Energy: 1.3150642857118402
Energy: 1.2018253886254404
Energy: 1.1923193884530763
Energy: 1.2059447171597208
Energy: 1.2031218129014727
Energy: 1.1915324512389702
Energy: 1.3388431662378302
Energy: 1.0588764836910884
Energy: 1.0589665183035617
Energy: 1.221467187044806
Energy: 1.059040064161635
Energy: 1.0591277237356516
Energy: 1.2080259949621612
Energy: 1.1075058464519962
Energy: 1.1257076746792916
Energy: 1.1251893671072517
Energy: 1.0986089243143315
Energy: 1.1255045437097104
Energy: 1.2076009755041075
Energy: 1.1879753970409916
Energy: 1.136790362932002
Energy: 1.14856678760571
Energy: 1.1838364289414252
Energy: 1.1181338390556248
Energy: 1.3857665564126818
Energy: 1.1054724182282951
Energy: 1.1058649345855016
Energy: 1.2366146904389526
Energy: 1.1012063783436166
Energy: 1.105062239233192
Energy: 1.3040288322939106
Energy: 1.20589947527511
Energy: 1.1714042758128844
Energy: 1.173621590142938
Energy: 1.2069408472155796
Energy: 1.1725867818040434
Energy: 1.3024444934883896
Energy: 1.17262934195183
Energy: 1.1730718041640242
Energy: 1.1738020582318398
Energy: 1.172984288517074
Energy: 1.1760000163154578
Energy: 1.4153040329808133
Energy: 1.1701369617006974
Energy: 1.1728160326540877
Energy: 1.1624246155170024
Energy: 1.1700855021888268
Energy: 1.1730975254523748
Energy: 1.391635096980749
Energy: 1.2138376998017115
Energy: 1.2091903997229405
Energy: 1.1471926076714711
Energy: 1.2259094634366066
Energy: 1.1517295827036276
Energy: 1.3897314462954318
Energy: 1.2003952842391852
Energy: 1.2071527272445384
Energy: 1.147413604789543
Energy: 1.2209097780541607
Energy: 1.205837681749375
Energy: 1.406946273636623
Energy: 1.1979089350502798
Energy: 1.1871967515313702
Energy: 1.2005685714930798
Energy: 1.1995215453599988
Energy: 1.1955432519579472
Energy: 1.671191520355963
Energy: 1.1204326578750217
Energy: 1.009548642758368
Energy: 1.0095496552747598
Energy: 1.1565894299298174
Energy: 1.0094527648012617
Energy: 1.2699350368580005
Energy: 1.1219758240788302
Energy: 1.1222566716663671
Energy: 1.0117460956629485
Energy: 1.1322896530071147
Energy: 1.1211346513642961
Energy: 1.4056892047676326
Energy: 1.150584950361095
Energy: 1.1423854882605495
Energy: 1.191597161532442
Energy: 1.1596979279286956
Energy: 1.1349065302763743
Energy: 1.6311039996103436
Energy: 1.194966052428463
Energy: 1.150183039603713
Energy: 1.105596337354413
Energy: 1.1624945009974976
Energy: 1.162825498065014
Energy: 1.4060630544057466
Energy: 1.1653254670604538
Energy: 1.1629854641807635
Energy: 1.194300810638276
Energy: 1.16392905284648
Energy: 1.1612058530963674
Energy: 1.5862559536678293
Energy: 1.1687897988670897
Energy: 1.1721700057196527
Energy: 1.1700860042840564
Energy: 1.1621432778320264
Energy: 1.170306940204505
Energy: 1.5864593929056758
Energy: 1.1739753144743927
Energy: 1.17378023982525
Energy: 1.1746984588422242
Energy: 1.1736086368684158
Energy: 1.1730326659115022
Energy: 1.479608570851848
Energy: 1.1517022635954262
Energy: 1.151388926125129
Energy: 1.1585740629257402
Energy: 1.1480127401071643
Energy: 1.200210645125212
Energy: 1.2837346947883699
Energy: 1.1484016249126252
Energy: 1.1472842588992305
Energy: 1.2053299919264822
Energy: 1.1467380868738795
Energy: 1.1891114782686878
Energy: 1.2822268923708442
Energy: 1.1985931281280766
Energy: 1.189062306973515
Energy: 1.1850489265254045
Energy: 1.1986803697649433
Energy: 1.1869523053639661
Energy: 1.3307418872511467
Energy: 1.058946156014041
Energy: 1.0584805481769322
Energy: 1.1368599083975415
Energy: 1.0589143952895939
Energy: 1.0600569915820868
Energy: 1.2410901779866432
Energy: 1.053934448606381
Energy: 1.059463885613644
Energy: 1.1454341859142194
Energy: 1.0662267455717318
Energy: 1.1258467287602283
Energy: 1.241877375898311
Energy: 1.192859816326932
Energy: 1.145288563639452
Energy: 1.1551744273633915
Energy: 1.2111270460783556
Energy: 1.1459721940097753
Energy: 1.240130726987264
Energy: 1.1047674064716668
Energy: 1.104521864716467
Energy: 1.158376976238322
Energy: 1.1055234596959709
Energy: 1.1632303023966095
Energy: 1.2876100708951321
Energy: 1.2123631429183654
Energy: 1.169747088655347
Energy: 1.168548425430686
Energy: 1.2144963145210133
Energy: 1.1541905264176007
Energy: 1.2899867438210366
Energy: 1.1757755464163908
Energy: 1.1693004990012965
Energy: 1.168633508439312
Energy: 1.1756789899550717
Energy: 1.169439737908914
Energy: 1.2895249252372885
Energy: 1.1685606470615695
Energy: 1.0842467100584932
Energy: 1.1063070657124128
Energy: 1.0840083995805705
Energy: 1.1778371622228507
Energy: 1.3896333006184052
Energy: 1.200138567193704
Energy: 1.127869164332519
Energy: 1.1470638414097944
Energy: 1.1236309860983056
Energy: 1.2018443908611343
Energy: 1.390652605677406
Energy: 1.1140978835635498
Energy: 1.1264909706684552
Energy: 1.1471963914058112
Energy: 1.1266488295188788
Energy: 1.1522368601540267
Energy: 1.4723734175504046
Energy: 1.112353721504235
Energy: 1.1253734084538825
Energy: 1.1036619445002522
Energy: 1.112315352313251
Energy: 1.114502967927394
Energy: 1.644674028321724
Energy: 1.0525598838350667
Energy: 1.0358729109834988
Energy: 1.036734664653273
Energy: 1.075408928034276
Energy: 1.0848054002268137

minimum gb energy = 1.0094527648012617 eV
minimum distance =  2.26913518837298 Angstroms
sigma value = 51


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

Energy: 1.6716225323073424
Energy: 1.1307930546658642
Energy: 1.0314902012473837
Energy: 1.1334366920198764
Energy: 1.1313824656614198
Energy: 1.110818260831314
Energy: 1.2963789660228013
Energy: 1.0620432154894748
Energy: 1.031627787093482
Energy: 1.1061437412032389
Energy: 1.0834881889929087
Energy: 1.0305776473890704
Energy: 1.5193957487628373
Energy: 1.0620523067360712
Energy: 1.0627723331650094
Energy: 1.0800100362969451
Energy: 1.0840346502591809
Energy: 1.0306385158579634
Energy: 1.516771480926858
Energy: 1.0624411580911073
Energy: 1.0628654229718804
Energy: 1.0660681727152403
Energy: 1.0625769307145425
Energy: 1.0656944215587203
Energy: 1.3007238182613912
Energy: 1.107816469961206
Energy: 1.1055599244703875
Energy: 1.1069134724464058
Energy: 1.1054427827540798
Energy: 1.1053658504172341
Energy: 1.2973122058613438
Energy: 1.1083997089953297
Energy: 1.1058731840026468
Energy: 1.1057494050642442
Energy: 1.105807354259537
Energy: 1.104504411310885
Energy: 1.297164685830873
Energy: 1.107522794312929
Energy: 1.104489056417813
Energy: 1.106377723585031
Energy: 1.1069507789845623
Energy: 1.1044244246497594
Energy: 1.3369361231266363
Energy: 1.034407467510011
Energy: 1.0341417673935762
Energy: 1.0618100741853913
Energy: 1.034828916338235
Energy: 1.034046300988378
Energy: 1.1532008817225428
Energy: 1.035196264623297
Energy: 1.033991086081983
Energy: 1.0622328595668549
Energy: 1.0354855580575402
Energy: 1.0624061461258996
Energy: 1.152818776134887
Energy: 1.0779410413613761
Energy: 1.0307746886700997
Energy: 1.0620235388583148
Energy: 1.0784375194619134
Energy: 1.0306936176607937
Energy: 1.201417736963532
Energy: 1.0269139419253666
Energy: 1.0277030873144384
Energy: 1.0482783940294296
Energy: 1.0458921442570661
Energy: 1.0601413149219021
Energy: 1.1751401745514016
Energy: 1.0299941694271388
Energy: 1.04967689462039
Energy: 1.085888024786646
Energy: 1.098910570761559
Energy: 1.0490884474626798
Energy: 1.1743850368750481
Energy: 1.0693253453838807
Energy: 1.069366721799308
Energy: 1.0863363790331793
Energy: 1.069371856841478
Energy: 1.0690568591116494
Energy: 1.1759230039707902
Energy: 1.0699376896885229
Energy: 1.069505329104093
Energy: 1.070161823855875
Energy: 1.070090916327731
Energy: 1.0695595903001325
Energy: 1.3789603625661961
Energy: 1.0698326764777029
Energy: 1.0692317517915608
Energy: 1.0911953384919337
Energy: 1.070081889464517
Energy: 1.0694024691390043
Energy: 1.3846689830314811
Energy: 1.0708402485411341
Energy: 1.069434883641785
Energy: 1.092367970639019
Energy: 1.091910489090089
Energy: 1.092024091465326
Energy: 1.42172594119949
Energy: 1.0704160845258248
Energy: 1.0708907512589239
Energy: 1.120506729805495
Energy: 1.0936993797222179
Energy: 1.0693841563627926
Energy: 1.64387225722033
Energy: 1.0852381603661234
Energy: 1.0119268980395506
Energy: 1.031952405776433
Energy: 1.0844092818929338
Energy: 1.0566188060612987

minimum gb energy = 1.0119268980395506 eV
minimum distance =  2.25286665222118 Angstroms
sigma value = 19


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

Energy: 1.402946989253445
Energy: 1.1182562368904128
Energy: 1.001701678260985
Energy: 1.2148357528915257
Energy: 0.9735688435167952
Energy: 1.001428545320446
Energy: 1.5055328661420035
Energy: 0.9808955313140252
Energy: 0.9839309502772235
Energy: 0.9883359802324335
Energy: 1.0295349213702654
Energy: 0.9911948819795727
Energy: 1.5058302770657468
Energy: 1.069555389345621
Energy: 1.0314084255245621
Energy: 0.9867250310754357
Energy: 1.0645311537557147
Energy: 0.9886258390710047
Energy: 1.2197963884845464
Energy: 0.990498164870364
Energy: 0.9910483114034522
Energy: 0.9920166776783009
Energy: 0.9922518238522922
Energy: 0.9905546595559893
Energy: 1.2296459619386553
Energy: 1.0153373132044679
Energy: 1.016189217925828
Energy: 1.0609649724921157
Energy: 1.0174349698560534
Energy: 1.006666992900371
Energy: 1.23502063583448
Energy: 0.9339085000286438
Energy: 1.0075897099243023
Energy: 1.0611873662429308
Energy: 0.9339594264936342
Energy: 1.0139343708234558
Energy: 1.2306802380427282
Energy: 1.010447920245119
Energy: 1.0219899511446355
Energy: 1.0600555148008193
Energy: 1.0077530518779343
Energy: 1.0567344799815173
Energy: 1.2222535162711308
Energy: 0.9337261538589087
Energy: 0.9346290435380775
Energy: 1.024677517213275
Energy: 0.9340579251915597
Energy: 0.934840878660592
Energy: 1.0689421724438863
Energy: 0.9338064810545003
Energy: 0.9345685035230041
Energy: 1.0254962594718051
Energy: 0.933275403906789
Energy: 0.9347533870647946
Energy: 1.0687937143003707
Energy: 0.9850129831794773
Energy: 0.9939857377006049
Energy: 1.0670841161377422
Energy: 1.0142440398147488
Energy: 0.9919326874505333
Energy: 1.0688896495138367
Energy: 0.9912052722284034
Energy: 0.9908744167740928
Energy: 1.0649347649360104
Energy: 0.9909744748962956
Energy: 0.9915241484739121
Energy: 1.2301798645396749
Energy: 1.0135742944980892
Energy: 1.01206373668948
Energy: 1.0291192422921145
Energy: 1.059926221332992
Energy: 0.9897639397246245
Energy: 1.0323519340563627
Energy: 1.008875057910974
Energy: 1.0082202292845484
Energy: 0.9450082227787393
Energy: 1.0605663966371626
Energy: 1.009163077314547
Energy: 1.2316484553681002
Energy: 1.0615457016066887
Energy: 1.0607332824854172
Energy: 0.9923367848269806
Energy: 1.061980954071726
Energy: 1.0183881144126674
Energy: 1.4164396528850687
Energy: 0.9815956157592937
Energy: 0.9907532372397334
Energy: 0.9336474704482863
Energy: 1.0246389512785217
Energy: 0.9343585410389463
Energy: 1.412324476564946
Energy: 0.9809685204582885
Energy: 0.9353435291707684
Energy: 0.9348379924904007
Energy: 0.9853819000536664
Energy: 0.9352864724594405
Energy: 1.2297659314844935
Energy: 1.0303636742913065
Energy: 0.9905965134647506
Energy: 1.0156938862935703
Energy: 1.028134548756627
Energy: 0.9939939623372754
Energy: 1.2162676744563474
Energy: 1.0304175314115573
Energy: 0.9914010737675975
Energy: 0.9909627391948473
Energy: 1.0298080348034693
Energy: 1.0284070234103673
Energy: 1.2162011556447638
Energy: 1.0300810200699702
Energy: 1.0278561798917838
Energy: 0.992253182542767
Energy: 1.030046068204613
Energy: 0.9860102822225069
Energy: 1.2319075702351818
Energy: 0.9354577703926399
Energy: 1.0106929435723027
Energy: 1.0199555716635205
Energy: 0.9332525512626276
Energy: 1.0093638394692137
Energy: 1.2248766684565173
Energy: 1.0084057225635734
Energy: 1.0112406060171095
Energy: 1.061087563251155
Energy: 1.013035582051661
Energy: 1.0166058532129054
Energy: 1.2308813381832513
Energy: 1.0104962548953913
Energy: 1.0075248370665122
Energy: 1.0609169910315694
Energy: 1.018407056818203
Energy: 1.0087232052190716
Energy: 1.0475650090454225
Energy: 0.9350716520223885
Energy: 0.9406134110936047
Energy: 1.1784599554763926
Energy: 0.9345783164983126
Energy: 1.0017961766508452
Energy: 1.0696133549323603
Energy: 0.9849787617774691
Energy: 0.9874247056270481
Energy: 1.0290130316509214
Energy: 0.9341795163291737
Energy: 0.9883080560862054
Energy: 1.0694031473524446
Energy: 0.9858055839669583
Energy: 0.9920909423524477
Energy: 1.0694439357510845
Energy: 0.9869296452533531
Energy: 0.9888323231822975
Energy: 1.2263053696551662
Energy: 0.9922241663165381
Energy: 0.9935322320669812
Energy: 1.0288073420767032
Energy: 0.9916302819149341
Energy: 0.9902820593307955
Energy: 1.2301268105304881
Energy: 1.0610799815365752
Energy: 1.0109145298378235
Energy: 1.01657558474943
Energy: 1.0609524597541269
Energy: 1.0142427809357657
Energy: 1.03289801257834
Energy: 1.0600584626561935
Energy: 1.0147480237261806
Energy: 0.9387320850536408
Energy: 1.0609027008380036
Energy: 1.010998383831545
Energy: 1.2334644309591332
Energy: 1.0594733454524197
Energy: 1.0567007527593661
Energy: 0.965208050695583
Energy: 1.0604864670766505
Energy: 1.0516731095599452
Energy: 1.4143499889180156
Energy: 0.9812049438564909
Energy: 0.9353265083679085
Energy: 0.93361292903709
Energy: 0.9941079389044395
Energy: 0.9349831607387764

minimum gb energy = 0.9332525512626276 eV
minimum distance =  2.37574137663512 Angstroms
sigma value = 27


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

Energy: 1.2167864262213626
Energy: 1.0609678490744596
Energy: 1.2537386310707268
Energy: 1.0004144779438118
Energy: 1.0568300000093935
Energy: 1.2522848511534563
Energy: 1.230154871557809
Energy: 1.0388032552332656
Energy: 0.9778517160270068
Energy: 0.9804291412514529
Energy: 1.038334575104874
Energy: 0.9776063925049787
Energy: 1.106048673877062
Energy: 1.0356523467398986
Energy: 0.9825629006314964
Energy: 0.9783923984824922
Energy: 1.0414500688588457
Energy: 0.9785767033967535
Energy: 1.1058101126763416
Energy: 0.9491877561702963
Energy: 0.9501875348293015
Energy: 0.9798383362113884
Energy: 1.0361778454144104
Energy: 0.9850651354282142
Energy: 1.2324742518412137
Energy: 0.8980823131465331
Energy: 0.9766467576872543
Energy: 1.0341721934586245
Energy: 0.8981472107268375
Energy: 0.9779032038631305
Energy: 1.0734383201095838
Energy: 0.8989704105724544
Energy: 0.8983029836590146
Energy: 1.033647023546859
Energy: 0.900157628269129
Energy: 0.8981208075651614
Energy: 1.078057336140225
Energy: 0.9810425618381311
Energy: 0.9779973833667012
Energy: 1.0382656756423072
Energy: 0.9790885293737709
Energy: 0.9778338116943199
Energy: 1.0769723887039215
Energy: 0.9809651946323599
Energy: 0.943516561412889
Energy: 1.038112127396095
Energy: 0.9783416101196877
Energy: 0.9423421030582054
Energy: 1.105413225036965
Energy: 0.9780967544583062
Energy: 0.9799397980922512
Energy: 1.0390377354246767
Energy: 0.9723448689192093
Energy: 0.9783566052755023
Energy: 0.9836035928153414
Energy: 0.9492137577201194
Energy: 0.9462418059413846
Energy: 0.9502089826255774
Energy: 0.9488724362972653
Energy: 0.9467975058609144
Energy: 1.1058309507727344
Energy: 0.9525516799522811
Energy: 0.9502682990314519
Energy: 0.9504055042639342
Energy: 1.0425000175753114
Energy: 0.9487891514073917
Energy: 1.1262308140204234
Energy: 0.9492488019833668
Energy: 0.9776409930704695
Energy: 0.9519383641182005
Energy: 0.9498121659270974
Energy: 0.9780932846827914

minimum gb energy = 0.8980823131465331 eV
minimum distance =  2.30976843242958 Angstroms
sigma value = 9


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

Energy: 2.064952199435034
Energy: 0.9288729940943167
Energy: 0.8520413229540242
Energy: 0.9482045754812118
Energy: 0.929591866573691
Energy: 0.8535655985138512
Energy: 0.9519878578225187
Energy: 0.906054283900442
Energy: 0.9113042496464875
Energy: 0.90216416368349
Energy: 0.9061361733877142
Energy: 0.8912193601267089
Energy: 0.9507335314503423
Energy: 0.9096078803911288
Energy: 0.8643712179093134
Energy: 0.9134936774981851
Energy: 0.9091005469601955
Energy: 0.868255448444642
Energy: 0.9509228770963469
Energy: 0.8757893555398144
Energy: 0.8760823504639896
Energy: 0.9093821288481143
Energy: 0.8906418472435413
Energy: 0.8701184812700521
Energy: 1.033581967278352
Energy: 0.9553200270319628
Energy: 0.9179893256278016
Energy: 0.9723755593585875
Energy: 0.9529624256366102
Energy: 0.8843857638145006
Energy: 0.9720821495892933
Energy: 0.8262374755304263
Energy: 0.9193156455507959
Energy: 0.9719144282045348
Energy: 0.8927428662879943
Energy: 0.9314213719227867
Energy: 0.9723997034265939
Energy: 0.9001292314932112
Energy: 0.8982887048731825
Energy: 0.9726300120191489
Energy: 0.8984750141921509
Energy: 0.9433826844893632
Energy: 0.9711225237641978
Energy: 0.9122293056955704
Energy: 0.8915179115699602
Energy: 0.9712566521342092
Energy: 0.9061179293246218
Energy: 0.8645739050517266
Energy: 1.3360367914113462
Energy: 0.9638074987169867
Energy: 0.8895141045494585
Energy: 0.9949257804693983
Energy: 0.9634806241077019
Energy: 0.8777520211471789
Energy: 0.8834404415004539
Energy: 0.9484494461004592
Energy: 0.8889764893630431
Energy: 0.8913368578473849
Energy: 0.9480354771582086
Energy: 0.883568654110267
Energy: 0.8836073331125254
Energy: 0.9725693712599819
Energy: 0.9428212540805372
Energy: 0.8954377471299451
Energy: 0.9735048033952456
Energy: 0.8791230998479623
Energy: 1.1489738431021805
Energy: 0.9719651783536349
Energy: 0.9724732401940996
Energy: 0.9200213093288445
Energy: 0.9725352186789996
Energy: 0.8990582319258569
Energy: 1.255694415335571
Energy: 1.0954515426130826
Energy: 1.0354583263455635
Energy: 0.9593215395157633
Energy: 0.9652016201108335
Energy: 0.8730029952296241
Energy: 1.144979223788012
Energy: 0.9721002317821246
Energy: 0.8787788311611608
Energy: 0.9222720431817
Energy: 0.9717594698082979
Energy: 0.8873770864735187
Energy: 0.9345475640825729
Energy: 0.9148520970998348
Energy: 0.9152806452445778
Energy: 0.9072970861776464
Energy: 0.9167727180367606
Energy: 0.9384932151655743
Energy: 0.9350815948895831
Energy: 0.8735898945657266
Energy: 0.8695744545650637
Energy: 0.9075541477707904
Energy: 0.9141110661089216
Energy: 0.8671405340666127
Energy: 0.933240869211948
Energy: 0.9174944746131406
Energy: 0.8963410269935355
Energy: 0.9084931257193287
Energy: 0.9172892526284205
Energy: 0.8895488186579658
Energy: 0.9498292697027734
Energy: 0.9022842124464453
Energy: 0.8967537904839442
Energy: 0.9067570306895666
Energy: 0.9333520033483548
Energy: 0.8947724701570228
Energy: 0.9515677305982757
Energy: 0.901585928310174
Energy: 0.9017854789003619
Energy: 0.9067819563890184
Energy: 0.9022306460411647
Energy: 0.8756243075879611
Energy: 0.9508323482455223
Energy: 0.8788017222011811
Energy: 0.8663725295772843
Energy: 0.8798653494068592
Energy: 0.8785991764783517
Energy: 0.864174250139097
Energy: 0.9497497361917985
Energy: 0.8801746534669787
Energy: 0.8725307412228095
Energy: 0.8968844605472089
Energy: 0.8826308171995048
Energy: 0.8678567530149803
Energy: 0.9937810965104585
Energy: 0.9225557479095462
Energy: 0.9559007174224848
Energy: 0.9535469177698277
Energy: 0.9063135338654967
Energy: 0.9262797695155104
Energy: 0.9887552978617655
Energy: 0.9078329234640574
Energy: 0.9125964013040077
Energy: 0.9520379519647638
Energy: 0.9064766762457527
Energy: 0.8703571294116029
Energy: 0.9505753015931201
Energy: 0.9076535331539526
Energy: 0.865815237989287
Energy: 0.9133213735266303
Energy: 0.9089254340533585
Energy: 0.8689174373432349
Energy: 1.2667661531013548
Energy: 0.906250261262579
Energy: 0.9358671602680305
Energy: 0.8903623126539087
Energy: 0.9061744270893031
Energy: 0.9175991246616132
Energy: 0.9497633705820265
Energy: 0.8987556392911848
Energy: 0.8843085241992716
Energy: 0.9725239626849624
Energy: 0.9207547009815141
Energy: 0.8921261634767754
Energy: 0.9126668175187329
Energy: 0.9161141848589243
Energy: 0.9164526592743051
Energy: 0.9103000223633201
Energy: 0.9163985860364211
Energy: 0.8697712088697808
Energy: 0.9721384622222345
Energy: 0.899192203842836
Energy: 0.8987327478323923
Energy: 0.9721188954124609
Energy: 0.9216557150331287
Energy: 0.943509199175105
Energy: 0.9727396974224721
Energy: 0.915613757398966
Energy: 0.8930482853185502
Energy: 0.9728921570531344
Energy: 0.9352354862321693
Energy: 0.8805142053780394
Energy: 0.9341149819602637
Energy: 0.8658266294337137
Energy: 0.8933773485871903
Energy: 0.9531636744516019
Energy: 0.9065556275101972
Energy: 0.9594823693866297
Energy: 0.8838063250772976
Energy: 0.9479169067786751
Energy: 0.8802462597519628
Energy: 0.8900229442138752
Energy: 0.9640676051292515
Energy: 0.8788194282761138
Energy: 0.8924410943887202
Energy: 0.9722197169257535
Energy: 0.8898057209409619
Energy: 0.8909138732293339
Energy: 0.971687866751333
Energy: 0.8843217438222447
Energy: 1.1461981942308606
Energy: 0.972723435429679
Energy: 0.9441901714876294
Energy: 0.9759745757124935
Energy: 0.9733514789291853
Energy: 0.8919765141279319
Energy: 0.9429790915182844
Energy: 0.9724442697693458
Energy: 0.8920995356985564
Energy: 0.9346221691602786
Energy: 0.9723624806661776
Energy: 0.8733205150221973
Energy: 0.937536567496333
Energy: 0.9723814062182079
Energy: 0.8863180680249856
Energy: 0.9326952206529489
Energy: 0.972239216254998
Energy: 0.8830101322546965
Energy: 0.9391782685199415
Energy: 0.9153401876259486
Energy: 0.8720450946539331
Energy: 0.958086270974948
Energy: 0.8275595436400953
Energy: 0.8776462008290136
Energy: 0.9328506769365458
Energy: 0.8926321454455632
Energy: 0.8694822481666332
Energy: 0.9083996338657696
Energy: 0.9141018139507701
Energy: 0.8663004989686617
Energy: 0.9333887309067128
Energy: 0.8901401829065739
Energy: 0.891678923263419
Energy: 0.9061210130498485
Energy: 0.8881088341759406
Energy: 0.8695648292333964
Energy: 1.0001430157739168
Energy: 0.8852057011571806
Energy: 0.8955158292117721
Energy: 1.010071045156113
Energy: 0.8859186275365473
Energy: 1.072901744188199
Energy: 0.9495178166845204
Energy: 0.8910270485306339
Energy: 0.8925491046187497
Energy: 0.9060028452170217
Energy: 0.888783642906273
Energy: 0.9077805848777873
Energy: 0.9489121826137625
Energy: 0.8672556340884893
Energy: 0.871456260225862
Energy: 0.8754590946705532
Energy: 0.883482861907552
Energy: 0.866567637831443
Energy: 0.951698196560484
Energy: 0.8798027648097647
Energy: 0.8686880294989228
Energy: 0.9001244993288938
Energy: 0.8793347713625457
Energy: 0.8643908994996606
Energy: 0.9890716534921618
Energy: 0.9068109425055685
Energy: 0.8938118203475489
Energy: 0.952210043823262
Energy: 0.906490715003402
Energy: 0.8700802166277771

minimum gb energy = 0.8262374755304263 eV
minimum distance =  2.30398501500609 Angstroms
sigma value = 57


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

Energy: 0.44491302081770523
Energy: 5.8737966793100735
Energy: 0.4963237006560247
Energy: 0.4475363443020523
Energy: 7.671360925450858
Energy: 0.44750513884848425
Energy: 7.60487663483561
Energy: 0.47579347359760327
Energy: 0.47784661051802035
Energy: 0.5082748222005442
Energy: 0.4721785686487084
Energy: 0.4857233939135894
Energy: 0.5757692589155271
Energy: 0.4736124117751804
Energy: 0.4744098023875552
Energy: 0.511753132236196
Energy: 0.5119943075282875
Energy: 0.475374813734112
Energy: 0.5760972776307312
Energy: 0.4739934301106377
Energy: 0.474270765942234
Energy: 0.5128475184093217
Energy: 0.512684773105255
Energy: 0.4766181108587709
Energy: 0.5714972234096154
Energy: 0.45674334970901687
Energy: 0.44705498013914546
Energy: 0.5126027465232922
Energy: 0.44770178052868576
Energy: 0.475508834635346
Energy: 0.5103058522096766
Energy: 0.44889777047949986
Energy: 0.4504890487201636
Energy: 7.7945129543904805
Energy: 0.44669057917456895
Energy: 0.4838878807293196
Energy: 0.5046322247791448
Energy: 0.4742476651468653
Energy: 0.4751225816201699
Energy: 0.5068059486133809
Energy: 0.47012479655698447
Energy: 0.4875246328757976
Energy: 0.5106791673430853
Energy: 0.4780709405425293
Energy: 0.47550901022141423
Energy: 0.5116459532707821
Energy: 0.4760402185430118
Energy: 0.4760536747953791
Energy: 0.5706527413476452
Energy: 0.4940756864270314
Energy: 0.4899080311042743
Energy: 0.5106660097771851
Energy: 0.5116823104865608
Energy: 0.4749121109438447
Energy: 0.4456773407096945
Energy: 0.5141168540905903
Energy: 0.4489767648150143
Energy: 0.4461551142778581
Energy: 7.585376027515612
Energy: 0.4779872624772605
Energy: 0.4456259080966788
Energy: 0.47745891312432037
Energy: 0.4752858640734481
Energy: 0.4463971088977483
Energy: 0.4718224967186844
Energy: 0.45068418882060146
Energy: 0.5736503626309724
Energy: 0.5164884087085391
Energy: 0.4866954699222254
Energy: 0.47412975399472945
Energy: 0.5103382526308484
Energy: 0.4864396985380834
Energy: 0.5766715474777878
Energy: 0.5819698586215116
Energy: 0.5176287441654335
Energy: 0.476431809174931
Energy: 0.5777491164675338
Energy: 0.514897011111506
Energy: 0.5721733450050174
Energy: 0.5181265831948936
Energy: 0.491639849423928
Energy: 0.5103281875399398
Energy: 7.543513371304397
Energy: 0.4916670931757434
Energy: 0.470853133720542
Energy: 0.4590820397208053
Energy: 0.44769767144469175
Energy: 7.620851167050066
Energy: 0.45066493651282885
Energy: 0.44851175865679316
Energy: 0.5077626571735708
Energy: 0.48155269014876445
Energy: 0.48684423179944664
Energy: 0.5120342008556196
Energy: 0.44902459504195047
Energy: 0.494732047150569
Energy: 0.5095854557860269
Energy: 0.4889567477501251
Energy: 0.4894511988554904
Energy: 0.5107782049323899
Energy: 0.5132119445922568
Energy: 0.4749103142475809
Energy: 0.5749943402853251
Energy: 0.47522655370607847
Energy: 0.47638638980217574
Energy: 0.5768759089436722
Energy: 0.4784898317822528
Energy: 0.4751413516071275
Energy: 0.44564874870896026
Energy: 0.4741480971923743
Energy: 0.47577846643446936
Energy: 0.44665825689797706
Energy: 0.472982852203578
Energy: 0.4773923393307734

minimum gb energy = 0.44491302081770523 eV
minimum distance =  2.35840580719481 Angstroms
sigma value = 11


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

Energy: 1.7411549440283733
Energy: 0.8611516737243345
Energy: 0.8647539122258721
Energy: 0.82787522421413
Energy: 0.7970956295882582
Energy: 0.8623690856480652
Energy: 0.7999419037416596
Energy: 0.8051214816060125
Energy: 0.8095269434224616
Energy: 0.7959209715175322
Energy: 0.8277653591826245
Energy: 0.8151348057595452
Energy: 0.7972072093226795
Energy: 0.8019381951402128
Energy: 0.803104322709214
Energy: 0.7978974905066463
Energy: 0.7975645224630296
Energy: 0.8071838847407212
Energy: 0.7972274575677538
Energy: 0.8052269194884284
Energy: 0.8083215670346827
Energy: 0.7979822977515396
Energy: 0.8093116928271439
Energy: 0.806862777523161
Energy: 0.7992510316964144
Energy: 0.8330770123896603
Energy: 0.8309608615165817
Energy: 0.8047975918182129
Energy: 0.8396409299514651
Energy: 0.8285525665215961
Energy: 0.8699000188514698
Energy: 0.8294336655171246
Energy: 0.8234262481672995
Energy: 0.8213680015939635
Energy: 0.7983883205544007
Energy: 0.8338658739685341
Energy: 0.8678792725378778
Energy: 0.8048865437953336
Energy: 0.8005692285003714
Energy: 0.8011337722654713
Energy: 0.8022198834023494
Energy: 0.8046153882772943
Energy: 0.8337134302721904
Energy: 0.8052479827412133
Energy: 0.8010247655275506
Energy: 0.8236448821273649
Energy: 0.8039101247793166
Energy: 0.8027682157646717
Energy: 0.8702520772006134
Energy: 0.8143287403325483
Energy: 0.827888692992289
Energy: 0.8031309136493484
Energy: 0.8000899561851027
Energy: 0.8326778621857206
Energy: 0.9366986861204006
Energy: 0.835976977950585
Energy: 0.8346182456070179
Energy: 0.7882520255803676
Energy: 0.8198015926229373
Energy: 0.8214150029326026
Energy: 1.149155386339826
Energy: 0.8162392691940199
Energy: 0.8331705334827848
Energy: 0.8222649814032891
Energy: 0.8190638271583329
Energy: 0.8324935866131932
Energy: 0.8675127789293551
Energy: 0.7814838804435663
Energy: 0.8367522573192674
Energy: 0.8013574485627517
Energy: 0.7740001479650142
Energy: 0.8116569003052847
Energy: 0.9094103173568889
Energy: 0.7830520558855364
Energy: 0.821940592992455
Energy: 0.8017408241563068
Energy: 0.7740175756824679
Energy: 0.8104757044510527
Energy: 0.9084704559497009
Energy: 0.8337092466175522
Energy: 0.8332556261614324
Energy: 0.816023757665299
Energy: 0.8472806037970777
Energy: 0.8323960600228693
Energy: 0.9617999566894541
Energy: 0.8144907593804764
Energy: 0.9606973158785359
Energy: 0.8271167992877099
Energy: 0.8090547749099296
Energy: 0.8187539391505612
Energy: 1.1303090684625545
Energy: 0.835826514016378
Energy: 0.8341252611198204
Energy: 0.8147979622681258
Energy: 0.8401886750026778
Energy: 0.8338729782112518
Energy: 1.2608730362687228
Energy: 0.819372405289225
Energy: 0.7796671407324138
Energy: 0.7746535157203905
Energy: 0.9715619568454518
Energy: 0.7801334266019239
Energy: 1.3760634875593738
Energy: 0.8156453209494829
Energy: 0.8390910989656071
Energy: 0.8435705717354791
Energy: 0.8156260848792503
Energy: 0.8366429313774488
Energy: 1.1443682598271712
Energy: 0.831830998299544
Energy: 0.8314066502312558
Energy: 0.8141407568779782
Energy: 0.8024069573837189
Energy: 0.8229444361957997
Energy: 1.0457837844995475
Energy: 0.8049018489754312
Energy: 0.8105922570406159
Energy: 0.8019150946404906
Energy: 0.8988646202539888
Energy: 0.8113019286377574
Energy: 1.130967900313355
Energy: 0.8352642797013768
Energy: 0.8377798542641817
Energy: 0.8150898909392984
Energy: 0.8333329485238923
Energy: 0.8405969229688625
Energy: 0.9490094596140216
Energy: 0.7799386019003972
Energy: 0.7802250709288883
Energy: 0.8216816041806111
Energy: 0.8201081167362373
Energy: 0.8315635728682357
Energy: 0.7999213557700252
Energy: 0.822678759194466
Energy: 0.8218587773559956
Energy: 0.8154098973215421
Energy: 0.8385386080348187
Energy: 0.8192490647320625
Energy: 0.7973818587955006
Energy: 0.8008991637342611
Energy: 0.8043364164783041
Energy: 0.7998690809900657
Energy: 0.7992481000646892
Energy: 0.8039200582356347
Energy: 0.7999575730898838
Energy: 0.7997943314685485
Energy: 0.8196815139814548
Energy: 0.7993501862370157
Energy: 0.799055345501253
Energy: 0.8091082187329469
Energy: 0.9164859881115643
Energy: 0.8439960826417394
Energy: 0.8287829880518898
Energy: 0.8131286319358586
Energy: 0.8072615963167273
Energy: 0.8311382078529548

minimum gb energy = 0.7740001479650142 eV
minimum distance =  2.31696695798766 Angstroms
sigma value = 41


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

Energy: 1.7604765814859282
Energy: 0.8904933976590796
Energy: 0.8848575418215813
Energy: 0.8346254674696219
Energy: 0.8898861579925209
Energy: 0.9364719409187544
Energy: 0.9824543368823307
Energy: 0.882361387245121
Energy: 0.8794208585901883
Energy: 0.8892937644843908
Energy: 0.8830629518085702
Energy: 0.8853092284809392
Energy: 0.9761330149776268
Energy: 0.975770809852213
Energy: 0.8635079669502598
Energy: 1.0099274605382405
Energy: 0.862114920826353
Energy: 0.9687337073470937
Energy: 0.976103304812969
Energy: 0.8797621750296463
Energy: 0.8839183126664231
Energy: 1.0094511881760726
Energy: 0.8708700077635101
Energy: 0.8858510833287863
Energy: 0.982582814039998
Energy: 0.9655598317100589
Energy: 0.9647734358377698
Energy: 0.8967760091785669
Energy: 0.9674531930024948
Energy: 0.90521008118912
Energy: 1.196835913145038
Energy: 0.9628245533474665
Energy: 0.9611283153578033
Energy: 1.0138854546367233
Energy: 0.9634207233223653
Energy: 0.9606506634286787
Energy: 1.127822677811045
Energy: 0.869085147467647
Energy: 0.8691457750193875
Energy: 0.8992828451867849
Energy: 0.8791134065962285
Energy: 0.9969041812394882
Energy: 1.013154336017662
Energy: 0.9988605063922376
Energy: 1.0038698654548326
Energy: 0.9051455642037158
Energy: 1.0278818083029482
Energy: 0.9094063441431812
Energy: 1.1953581438340215
Energy: 1.001956491834732
Energy: 1.0159036647184427
Energy: 0.8920227960530498
Energy: 1.0187733304684135
Energy: 1.0223679241916688
Energy: 1.0843154731293931
Energy: 1.0081487226208294
Energy: 1.0093254744239262
Energy: 0.9487033144390684
Energy: 1.0175448038583808
Energy: 1.002818996764811
Energy: 1.0849733778496018
Energy: 1.0090520237542373
Energy: 1.0036059439568619
Energy: 0.9535268585993811
Energy: 1.0233716329960258
Energy: 1.0038888969548225
Energy: 1.197131201649551
Energy: 0.9627283975376136
Energy: 0.9633495862196296
Energy: 1.0144636463515466
Energy: 0.9355100898698893
Energy: 0.9635530404650641
Energy: 1.033354019288956
Energy: 0.9650882941236533
Energy: 0.9641682871142202
Energy: 1.0250503279728327
Energy: 0.9314977803575246
Energy: 0.9661694458150422
Energy: 1.0231621653503762
Energy: 0.9589894262086633
Energy: 0.9545523078471432
Energy: 1.013691660991346
Energy: 0.9565718730571083
Energy: 0.9595124092098086
Energy: 1.0203071853325298
Energy: 1.0079579080490373
Energy: 1.0051102701723653
Energy: 1.020915525726345
Energy: 0.9919284397119184
Energy: 1.012172153094246
Energy: 1.03576053126206
Energy: 0.9580884449239643
Energy: 0.9545341290336726
Energy: 0.9759319740353907
Energy: 1.0058807602371396
Energy: 0.9529466048231886
Energy: 1.0538254412016486
Energy: 0.9664905532123761
Energy: 0.8534002939234403
Energy: 0.8354144314902545
Energy: 0.9994986023964884
Energy: 0.8813440436034115
Energy: 0.9148883520810321
Energy: 0.9588829734471515
Energy: 0.9579834499426922
Energy: 0.8582050100910941
Energy: 0.9543018300763062
Energy: 0.8656532731856801
Energy: 1.0239661384150651
Energy: 0.9902474410435557
Energy: 0.9866558530065709
Energy: 1.022215639064547
Energy: 0.9952714832919889
Energy: 0.9870684468224663
Energy: 1.0208313551924988
Energy: 0.9858934463760494
Energy: 0.9969417754859411
Energy: 1.0180329227992693
Energy: 0.9934166865182147
Energy: 1.0102869430005534
Energy: 1.0261795922477461
Energy: 0.9437926471568594
Energy: 0.9612894269075508
Energy: 1.0323435040365443
Energy: 0.9461655951246543
Energy: 0.9629045565140899
Energy: 1.1763830562369884
Energy: 0.959282960998179
Energy: 0.9751664429080728
Energy: 0.914462388513586
Energy: 0.9666927860961531
Energy: 0.9858483325461601
Energy: 1.1944044923696726
Energy: 1.0058366103475482
Energy: 0.9426225597424879
Energy: 1.0157637790641263
Energy: 1.0034673790991258
Energy: 0.9434758956182708
Energy: 1.0133136456396463
Energy: 1.0080042842619186
Energy: 0.9885932751750455
Energy: 0.9051566594554153
Energy: 1.007902542793745
Energy: 0.9000328124063487
Energy: 1.1948541362613059
Energy: 0.9898078078576722
Energy: 0.9676243012258933
Energy: 1.0137383432844025
Energy: 1.0060586799941187
Energy: 0.9645681806462385
Energy: 1.0851337975769628
Energy: 1.0152534481928166
Energy: 1.0613247479214494
Energy: 0.9536753327674713
Energy: 1.0158194486028846
Energy: 1.0081935878151806
Energy: 1.084634308252017
Energy: 0.8804431502469375
Energy: 0.8826493968424969
Energy: 0.9478206802889904
Energy: 0.8819421970233944
Energy: 1.0015961577072432
Energy: 1.1939464761258187
Energy: 0.9609557067775039
Energy: 0.89242801237369
Energy: 0.8988978845059629
Energy: 0.9384741821356052
Energy: 1.0102613345095532
Energy: 0.9901321692860526
Energy: 0.9315777445287511
Energy: 0.9317921075911428
Energy: 0.8937375082697246
Energy: 0.9308254991789988
Energy: 0.945272067277139
Energy: 1.0579870523466306
Energy: 0.926587953913923
Energy: 0.9297415278593266
Energy: 0.9861427237327034
Energy: 0.9269251339836613
Energy: 0.8862460691410119
Energy: 0.979833944474007
Energy: 0.8648503101904141
Energy: 0.9958794640534442
Energy: 1.0075125710036605
Energy: 0.9795002504039733
Energy: 0.9691948096032998
Energy: 0.9789363510736504
Energy: 0.8793640547678225
Energy: 0.8868302902714993
Energy: 0.8922804956439416
Energy: 0.8607335751584723
Energy: 0.8873516175351349
Energy: 1.1548104423527736
Energy: 0.8881315315223332
Energy: 0.8549391592095913
Energy: 0.8341631643461873
Energy: 0.8817186370127589
Energy: 0.9295366100040131

minimum gb energy = 0.8341631643461873 eV
minimum distance =  2.22973971867197 Angstroms
sigma value = 33


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

Energy: 1.08861548270877
Energy: 1.0018436760723783
Energy: 0.8932483308906339
Energy: 0.891292909036675
Energy: 1.0024378141788006
Energy: 0.8934187206968243
Energy: 0.959723587759229
Energy: 0.9470597984166171
Energy: 0.9470641033604938
Energy: 0.931028735215435
Energy: 0.978590651669431
Energy: 0.9457398678871853
Energy: 0.9597338715289543
Energy: 0.9259496276242695
Energy: 0.923402239866217
Energy: 0.9269936162503729
Energy: 0.9260092421079991
Energy: 0.9209809970373278
Energy: 0.9574746515134324
Energy: 0.9443560018655559
Energy: 0.9418829667876032
Energy: 0.9536456499796803
Energy: 0.9310290990650627
Energy: 0.9229661934222161
Energy: 0.9588648178461903
Energy: 0.9417158050543669
Energy: 0.904831368058785
Energy: 0.9796954336696243
Energy: 0.9263500831785333
Energy: 0.9039221624710425
Energy: 1.0174566380914902
Energy: 0.9214031843638697
Energy: 0.9204008013829755
Energy: 0.9111660749879076
Energy: 0.9260272838826947
Energy: 0.9219845278525944
Energy: 1.0170524220582113
Energy: 0.9313615566613906
Energy: 0.9280712847859098
Energy: 0.973686468803355
Energy: 0.9451435749750402
Energy: 0.9260741929791352
Energy: 1.0865653467034786
Energy: 0.9292599430926204
Energy: 0.8920095973988518
Energy: 0.8934757130461691
Energy: 0.9236883814031859
Energy: 0.8916143895520525
Energy: 1.0154790427295577
Energy: 0.9243430455673347
Energy: 0.9278671693388462
Energy: 0.9055179126393104
Energy: 0.9244497088379895
Energy: 0.9051350707320379
Energy: 1.1097443854652196
Energy: 0.9273944954706951
Energy: 0.9242122026465028
Energy: 0.9274245564239784
Energy: 0.9240791444785087
Energy: 0.9215600692135881
Energy: 1.0182231003798783
Energy: 0.9280734561930007
Energy: 0.9249404812639668
Energy: 0.9538632237597048
Energy: 0.9489474459767215
Energy: 0.9231938756165544
Energy: 1.0168240425400483
Energy: 0.8917765970985446
Energy: 0.8930139687921971
Energy: 0.9322544286319812
Energy: 0.8979692015480394
Energy: 0.8926315520178902
Energy: 1.0273160653675304
Energy: 0.8901243986171752
Energy: 0.8914753210670091
Energy: 0.907937193139547
Energy: 0.8950766162415879
Energy: 0.8910605189086555
Energy: 0.9550659500049984
Energy: 0.9282386205050576
Energy: 0.9259549871480421
Energy: 0.9543842225232637
Energy: 0.928605880356871
Energy: 0.925417845754989
Energy: 0.8904481048634503
Energy: 0.9275783412330205
Energy: 0.9225725239544631
Energy: 0.9242470994793047
Energy: 0.9265531276288257
Energy: 0.9215986430314599
Energy: 0.9611785738835684
Energy: 0.9456243832342344
Energy: 0.9444899806858725
Energy: 0.9471396763253919
Energy: 0.9573269762886877
Energy: 0.9279546596989211
Energy: 1.10575880490984
Energy: 0.9265311616034398
Energy: 0.9258153732009897
Energy: 0.9240658848752159
Energy: 0.9251523104528302
Energy: 0.922793912131627
Energy: 1.0165460105351831
Energy: 0.9041999896876673
Energy: 0.9038507856910963
Energy: 0.9725512326474115
Energy: 0.9318606572282925
Energy: 0.9046949433889812
Energy: 0.9560051435416913
Energy: 0.8931568560353217
Energy: 0.8923988900968811
Energy: 0.9293503748818183
Energy: 0.8964656877096897
Energy: 0.9236708368279883
Energy: 0.9675326155501078
Energy: 0.8934272425911421
Energy: 0.8904755085072515
Energy: 0.9265947148086067
Energy: 0.8960275967668632
Energy: 0.9232175373328507
Energy: 0.9052238647182591
Energy: 0.9436697360111028
Energy: 0.9033320588454434
Energy: 0.904764625721942
Energy: 0.9451978507272931
Energy: 0.9245955853817591
Energy: 0.9835371072349031
Energy: 0.9209049193459471
Energy: 0.9227836692872956
Energy: 0.9238874672689439
Energy: 0.9236150694786746
Energy: 0.924461765600109
Energy: 0.9587100160572695
Energy: 0.9468901204826948
Energy: 0.9450832643495555
Energy: 0.9247421927615835
Energy: 0.9777035886910015
Energy: 0.9081133730188368
Energy: 1.0123787446937231
Energy: 0.9230233498943736
Energy: 0.8909674142268272
Energy: 0.8938841360670187
Energy: 0.9084301510196895
Energy: 0.8910475155026607
Energy: 1.0117975659926715
Energy: 0.9475216811616592
Energy: 0.9494125946879584
Energy: 0.9376753294694581
Energy: 0.9506301605024051
Energy: 0.9473429065765564
Energy: 0.9583069763865055
Energy: 0.9275274016332361
Energy: 0.9223772708403192
Energy: 0.9530850617565497
Energy: 0.9271053174070671
Energy: 0.9206688526965973
Energy: 0.9591999187747374
Energy: 0.9248908468035384
Energy: 0.9230009817070333
Energy: 0.928328130121771
Energy: 0.9283460665110841
Energy: 0.9231493198575376
Energy: 0.9579881369703027
Energy: 0.9298400975729368
Energy: 0.9035608247506813
Energy: 0.9792423176280637
Energy: 0.948039061061959
Energy: 0.9439828229924264
Energy: 1.0478413255209988
Energy: 0.9189869949307728
Energy: 0.9200072121652857
Energy: 0.9255062181566034
Energy: 0.9229032249070375
Energy: 0.9228358921779324
Energy: 1.0151247175246647
Energy: 0.9330260707496493
Energy: 0.9344699331457463
Energy: 0.9786500981624607
Energy: 0.9267305755608644
Energy: 0.9278154751326009
Energy: 1.0874724832284002
Energy: 0.9242755317575362
Energy: 0.8905543241412105
Energy: 0.8923811414904782
Energy: 0.9250483864952576
Energy: 0.890699938089297
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Energy: 0.9230731451059356
Energy: 0.9252735853200093
Energy: 0.946359546400185
Energy: 0.9268204351258473
Energy: 0.903051621884518
Energy: 1.1096258595807695
Energy: 0.9272675630909982
Energy: 0.923871282380321
Energy: 0.9282059964538494
Energy: 0.9268423918041969
Energy: 0.9216080914299607
Energy: 1.0187724372261666
Energy: 0.9437440672435792
Energy: 0.9231728788186495
Energy: 0.9523716142493313
Energy: 0.928610092389381
Energy: 0.9217952221961649
Energy: 1.018277279298547
Energy: 0.945840698764258
Energy: 0.8945507182957918
Energy: 0.932345892617013
Energy: 0.9195144636202515
Energy: 0.9047973070585816
Energy: 1.0283875181055373
Energy: 0.8910410118803056
Energy: 0.8910888746002928
Energy: 0.9468860912859204
Energy: 0.8945492590299663
Energy: 0.8909400187727924
Energy: 0.9564663656853333
Energy: 0.9295531327767987
Energy: 0.9273916711471611
Energy: 0.9564915813314268
Energy: 0.9297010140159336
Energy: 0.9263037860028285
Energy: 0.8923130735865957
Energy: 0.9276282503175425
Energy: 0.9223722231438625
Energy: 0.895096739314083
Energy: 0.9241958631329085
Energy: 0.9218652612284229
Energy: 0.9575341550806662
Energy: 0.9302067831200156
Energy: 0.9257885818710633
Energy: 0.9477885719530137
Energy: 0.9548171651876448
Energy: 0.9256461986467707
Energy: 1.1059218697080988
Energy: 0.9103874250781756
Energy: 0.9053026325186124
Energy: 0.921442629642139
Energy: 0.910102863675002
Energy: 0.9210068572847381
Energy: 1.1077394709059962
Energy: 0.9046447651295546
Energy: 0.9056086059902745
Energy: 0.951599830022136
Energy: 0.9327407704172012
Energy: 0.9053260258043524
Energy: 0.9553874161844502
Energy: 0.8945206382816017
Energy: 0.8915264009971242
Energy: 0.930071798114555
Energy: 0.8975438501636432
Energy: 0.9236006781114067
Energy: 0.9720975064704761
Energy: 0.8934107942214308
Energy: 0.8924620759214068
Energy: 0.9238100601378341
Energy: 0.8954320868954266
Energy: 0.8932738231685184
Energy: 0.9029423245345701
Energy: 0.9046619364304636
Energy: 0.9045145502981938
Energy: 0.9047492533355981
Energy: 0.9037586436618996
Energy: 0.927539463142341
Energy: 0.9805649424058617
Energy: 0.9226663274779844
Energy: 0.9255136630540648
Energy: 0.9252388333372407
Energy: 0.9225099117187074
Energy: 0.9274075776979054
Energy: 0.957028546339524
Energy: 0.9450945074015947
Energy: 0.9423419304335411
Energy: 0.9269246626414815
Energy: 0.9739556862863998
Energy: 0.9273220956138802
Energy: 1.1950389231695109
Energy: 0.9048313257898367
Energy: 0.8910260782181465
Energy: 0.892480968588906
Energy: 0.9034091363094631
Energy: 0.8913214053991726

minimum gb energy = 0.8901243986171752 eV
minimum distance =  2.30972758111157 Angstroms
sigma value = 67


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

Energy: 1.271783124034516
Energy: 5.94545181230801
Energy: 0.9330274224895769
Energy: 0.9323383869613187
Energy: 5.94048426201472
Energy: 0.93257286427963
Energy: 1.029302367710116
Energy: 0.9822300404276106
Energy: 0.9807843889254511
Energy: 0.9834434975740961
Energy: 0.9864568212536158
Energy: 0.9810090690927529
Energy: 1.0344564167967436
Energy: 0.9168509717793107
Energy: 0.9641547107276526
Energy: 0.9675614943908201
Energy: 0.9168410629394844
Energy: 0.9650469690866644
Energy: 1.0261731073783047
Energy: 0.9643573447606131
Energy: 0.9643437101913591
Energy: 0.9746292542041313
Energy: 0.9660312978022186
Energy: 0.9643968491961263
Energy: 1.0229770288874822
Energy: 0.9860342866913797
Energy: 0.9858249594150509
Energy: 1.023875332299047
Energy: 0.9859611742281691
Energy: 0.9866275317403987
Energy: 1.0249551388540732
Energy: 0.9537808277159928
Energy: 0.9890747039610451
Energy: 1.026007451850112
Energy: 0.9534680684744468
Energy: 0.990572744679856
Energy: 1.1119829107450692
Energy: 0.9829811677391482
Energy: 0.9850406454655594
Energy: 0.9202516550472694
Energy: 0.9879701133134627
Energy: 0.984304244701537

minimum gb energy = 0.9168410629394844 eV
minimum distance =  2.36520473508019 Angstroms
sigma value = 3


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

Energy: 1.7033421413301524
Energy: 1.118584746009419
Energy: 1.1524236699295052
Energy: 1.1190585697966846
Energy: 1.25359148748867
Energy: 1.1516312463461966
Energy: 1.1220492473149613
Energy: 1.0920894963352137
Energy: 1.0637552485695714
Energy: 1.1267288327630172
Energy: 1.1106511787686673
Energy: 1.0649977405764308
Energy: 1.1222578725651502
Energy: 1.0919137264495087
Energy: 1.0908018321768282
Energy: 1.0674168867920897
Energy: 1.0917320561384947
Energy: 1.1555995559298056
Energy: 1.1418890126279968
Energy: 1.0783122896852948
Energy: 1.069763262680638
Energy: 1.0691659512152951
Energy: 1.0910634471736724
Energy: 1.0676447738286834
Energy: 1.1246515817131384
Energy: 1.0678244361833218
Energy: 1.1236590889363554
Energy: 1.1288872674885522
Energy: 1.136176422100711
Energy: 1.0635830518908314
Energy: 1.1182453621733
Energy: 1.1367371952646168
Energy: 1.1197858378536851
Energy: 1.122979342750008
Energy: 1.133391404842866
Energy: 1.1188385959855354
Energy: 1.1194280833847123
Energy: 1.1432389209717562
Energy: 1.196938317801939
Energy: 1.1532393072924587
Energy: 1.150429205967309
Energy: 1.1393277469912202
Energy: 1.3244913871439719
Energy: 1.1798308190845184
Energy: 1.1385751972690132
Energy: 1.0932883880126267
Energy: 1.1230723142505084
Energy: 1.1391302896767088
Energy: 1.1165823934052375
Energy: 1.1592881974251903
Energy: 1.1517415135254316
Energy: 1.1530240198370114
Energy: 1.1301197133849326
Energy: 1.1530423096461173
Energy: 1.119672840359377
Energy: 1.0988542855212389
Energy: 1.097944642811775
Energy: 1.1726372325126733
Energy: 1.107845138423543
Energy: 1.0949352545213231
Energy: 1.2092810673202679
Energy: 1.1300703150207012
Energy: 1.0941984475436646
Energy: 1.2026736392955377
Energy: 1.0957815606956727
Energy: 1.1593142689300615
Energy: 1.2359327783453768
Energy: 1.157154960417653
Energy: 1.1503418461753998
Energy: 1.1558198225560128
Energy: 1.1269057821749966
Energy: 1.1203948778046335
Energy: 1.1665564942161262
Energy: 1.1204853299515383
Energy: 1.1200964612675317
Energy: 1.0809429028009265
Energy: 1.1198332946907072
Energy: 1.1205818414498634
Energy: 1.2018191536536682
Energy: 1.124344048346388
Energy: 1.1230427243361647
Energy: 1.152098347300142
Energy: 1.1242247215782908
Energy: 1.1215039007555314
Energy: 1.215952315125246
Energy: 1.124781145571973
Energy: 1.1847679792869181
Energy: 1.0863405040372276
Energy: 1.2230472041799552
Energy: 1.1258415391526981
Energy: 1.2852225168290183
Energy: 1.1219115934634583
Energy: 1.122608324836838
Energy: 1.1715963618283436
Energy: 1.1808477484001176
Energy: 1.1227243239606024
Energy: 1.3480522569491682
Energy: 1.1016411679924802
Energy: 1.1010373372730016
Energy: 1.3469821226842689
Energy: 1.1017810466406441
Energy: 1.139885327382247
Energy: 1.198179549811245
Energy: 1.1254051218792962
Energy: 1.1921727022952004
Energy: 1.1348809176657135
Energy: 1.1458322597505808
Energy: 1.1922692265587453
Energy: 1.3248964320707028
Energy: 1.1333971964687384
Energy: 1.132273773244946
Energy: 1.1000349224565305
Energy: 1.1625460278710156
Energy: 1.1120939472608116
Energy: 1.263616706867756
Energy: 1.125717046641629
Energy: 1.1266717609947114
Energy: 1.1094812679485135
Energy: 1.1272370851426163
Energy: 1.104302125425848
Energy: 1.157234045006449
Energy: 1.142694863058173
Energy: 1.142633889751717
Energy: 1.16486020498092
Energy: 1.1439258287587741
Energy: 1.1423049382259352
Energy: 1.1509414945720304
Energy: 1.1766713185932838
Energy: 1.168204385884593
Energy: 1.157728322400764
Energy: 1.1697592392316816
Energy: 1.1694084244306433
Energy: 1.150375044576139
Energy: 1.1702631150721992
Energy: 1.165242994771455
Energy: 1.1542243859810013
Energy: 1.163582034357542
Energy: 1.1639094185062515
Energy: 1.1546965080480864
Energy: 1.093947862196064
Energy: 1.0931494674396716
Energy: 1.1544195055236317
Energy: 1.096223105228518
Energy: 1.1274664054210566
Energy: 1.111339351910872
Energy: 1.1462864126139134
Energy: 1.1462572552513537
Energy: 1.1792516800434503
Energy: 1.1436394518532678
Energy: 1.1472240529825413
Energy: 1.3268813039331597
Energy: 1.2198111010358725
Energy: 1.1137468409017268
Energy: 1.063561227118334
Energy: 1.2067215315465667
Energy: 1.0626029354715498
Energy: 1.063819847445274
Energy: 1.1955044414986216
Energy: 1.1131628102760065
Energy: 1.0636594068396363
Energy: 1.1764331060771258
Energy: 1.062278616516796
Energy: 1.1115781017990725
Energy: 1.1464529653305717
Energy: 1.1467951892778527
Energy: 1.184167007539638
Energy: 1.1422901038890365
Energy: 1.1468060719295878
Energy: 1.1268307965516566
Energy: 1.0927690211239494
Energy: 1.0906840375289926
Energy: 1.1267413152316865
Energy: 1.0936191065060352
Energy: 1.1282011164655634
Energy: 1.1223131873452592
Energy: 1.1413712144327888
Energy: 1.1381732549546022
Energy: 1.124397383581915
Energy: 1.1204743891467166
Energy: 1.133034652769914
Energy: 1.1233516203203222
Energy: 1.132730667822762
Energy: 1.14129586410114
Energy: 1.1357241416592128
Energy: 1.12119984484353
Energy: 1.1397371521381146
Energy: 1.125813427445132
Energy: 1.121260578940075
Energy: 1.1225012688037856
Energy: 1.1623651397147072
Energy: 1.1218047324172213
Energy: 1.1230693988884157
Energy: 1.3213101914575525
Energy: 1.168195699417013
Energy: 1.1830743474407686
Energy: 1.091255712389825
Energy: 1.1699139730776695
Energy: 1.1008963148537327
Energy: 1.1870477512506874
Energy: 1.1293862631836569
Energy: 1.1280434521305842
Energy: 1.1004426072161406
Energy: 1.1329255654182502
Energy: 1.1541407338191505
Energy: 1.1326512204752206
Energy: 1.0959756691876588
Energy: 1.0949228825173716
Energy: 1.169767010007882
Energy: 1.1452462938174546
Energy: 1.1317776553938976
Energy: 1.2500175202864474
Energy: 1.096287876450165
Energy: 1.0989421248905047
Energy: 1.2391826944116118
Energy: 1.1117590465624139
Energy: 1.0979855056802899
Energy: 1.2382027357772034
Energy: 1.1493942089330282
Energy: 1.1211727263719617
Energy: 1.1905182123574132
Energy: 1.1530218534980579
Energy: 1.159462732999123
Energy: 1.2974306472436994
Energy: 1.1993017489715287
Energy: 1.1216477874322093
Energy: 1.0814551120656337
Energy: 1.125412912812266
Energy: 1.2035823441482942
Energy: 1.1839835933102683
Energy: 1.1196199047878033
Energy: 1.119459474732638
Energy: 1.18254861243194
Energy: 1.124038622305485
Energy: 1.1193182600654739
Energy: 1.2152641956600907
Energy: 1.1250441850520665
Energy: 1.1254035779847313
Energy: 1.0846694162877284
Energy: 1.1251752852277406
Energy: 1.125909839527441
Energy: 1.341785128634722
Energy: 1.130066706880712
Energy: 1.1242957129633455
Energy: 1.1226049797683975
Energy: 1.1756683296190509
Energy: 1.1236997747411732
Energy: 1.313608894889378
Energy: 1.1250616666365358
Energy: 1.0908062786597919
Energy: 1.2191177673650473
Energy: 1.0997531627742325
Energy: 1.1754607974223017
Energy: 1.2629531197143622
Energy: 1.101586047575602
Energy: 1.1007344659282918
Energy: 1.3013517821125673
Energy: 1.110696815449659
Energy: 1.1535748733365325
Energy: 1.2611066349893636
Energy: 1.1288024226315019
Energy: 1.1218266800497814
Energy: 1.1616105193372506
Energy: 1.12806784109912
Energy: 1.121997606915159
Energy: 1.4764152782917925
Energy: 1.0631233635860462
Energy: 1.1402150532605682
Energy: 1.117567577632927
Energy: 1.0675449593634854
Energy: 1.138720647881904
Energy: 1.1456412309112767
Energy: 1.0860057723340046
Energy: 1.1512647037123247
Energy: 1.1576982751961613
Energy: 1.0811078825737575
Energy: 1.1480821781816644
Energy: 1.1471714291017296
Energy: 1.1524064323129202
Energy: 1.1686978672838444
Energy: 1.167028663450894
Energy: 1.1480758964172058
Energy: 1.1714327145433692
Energy: 1.1556251090706686
Energy: 1.1689019405645287
Energy: 1.1712613505712937
Energy: 1.1617615890236859
Energy: 1.1565115081336428
Energy: 1.1017199804882283
Energy: 1.1706964160350324
Energy: 1.0914598944176652
Energy: 1.0701288126211976
Energy: 1.099638005134765
Energy: 1.0907363459530925
Energy: 1.067412362187923
Energy: 1.1212501686910916
Energy: 1.092901995895332
Energy: 1.0928955013079
Energy: 1.0756331369371783
Energy: 1.0922884862607183
Energy: 1.1551271864640158
Energy: 1.0923981554652071
Energy: 1.0884779723338849
Energy: 1.1016653151898215
Energy: 1.1174365715656995
Energy: 1.074629074379981
Energy: 1.1197514031653393

minimum gb energy = 1.062278616516796 eV
minimum distance =  2.30445025069566 Angstroms
sigma value = 81


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

Energy: 1.6823009185807207
Energy: 1.1227109038167016
Energy: 1.071651873850042
Energy: 1.0703314436157039
Energy: 4.850890876487511
Energy: 1.070989100347301
Energy: 1.015697369202665
Energy: 1.0504608187462268
Energy: 1.0563070594368142
Energy: 1.0770966382933387
Energy: 1.0182569882879158
Energy: 1.048764347738791
Energy: 1.0191705658868009
Energy: 1.0721187330674455
Energy: 1.0734656951750887
Energy: 1.0630709735684214
Energy: 1.0531139505508083
Energy: 1.0570112294073182
Energy: 1.0176376910935232
Energy: 1.020285133471977
Energy: 1.0183133004761564
Energy: 1.0175154869095517
Energy: 1.0128648831099372
Energy: 1.018552226957378
Energy: 1.0185213956217687
Energy: 1.0589267395166806
Energy: 1.059043569921094
Energy: 1.0188440691029137
Energy: 1.0181869843116214
Energy: 1.0586647781915943
Energy: 1.020518889444523
Energy: 1.0569433151901042
Energy: 1.0575628159889643
Energy: 1.0227003475125798
Energy: 1.053763888899475
Energy: 1.0581679706560918
Energy: 1.0161907299450665
Energy: 1.0554447777235894
Energy: 1.051317173550324
Energy: 1.0227374462699768
Energy: 1.0233232020144463
Energy: 1.0493987543225898
Energy: 1.164788076185009
Energy: 1.1508518773478111
Energy: 1.1178368737006648
Energy: 1.0640246328192156
Energy: 1.1725072023882264
Energy: 1.0663865772163643
Energy: 1.0163160706555676
Energy: 1.0521601949912247
Energy: 1.0487909885352615
Energy: 1.0175102784047985
Energy: 1.0510185611039962
Energy: 1.046769990394879
Energy: 1.0243392777028975
Energy: 1.0120114235699282
Energy: 1.012111710443662
Energy: 1.0218396105199106
Energy: 1.0117135927857304
Energy: 1.012362808682711
Energy: 1.0210238415906423
Energy: 1.0137295351816795
Energy: 1.0134458247240732
Energy: 1.0185155295864043
Energy: 1.0139404212041614
Energy: 1.0502207060095232
Energy: 1.0112948484371338
Energy: 1.0569202180785484
Energy: 1.0192790106090828
Energy: 1.0113311716678755
Energy: 1.0563171034536194
Energy: 1.018857716959826
Energy: 1.011046855558784
Energy: 1.0199758703355326
Energy: 1.0595485460823637
Energy: 1.0165169603212778
Energy: 1.0192028015028483
Energy: 1.0721178156673337
Energy: 1.0170119583523225
Energy: 1.0171511483802569
Energy: 1.0175194950218174
Energy: 1.0182204579736571
Energy: 1.015786242749032
Energy: 1.0195349783926024
Energy: 1.1758698524032558
Energy: 1.1424135776962758
Energy: 1.0858031828434629
Energy: 1.0577961358184158
Energy: 1.1420116242945269
Energy: 1.0177266865708727
Energy: 1.0173107425364762
Energy: 1.017209259584855
Energy: 1.0565467474639874
Energy: 1.0182023627438355
Energy: 1.0189277946350945
Energy: 1.0504088243091976
Energy: 1.1772452315436082
Energy: 1.0632792485364178
Energy: 1.0165595043332294
Energy: 1.1766306776294044
Energy: 1.0621880935108794
Energy: 1.076264816597256
Energy: 1.020743504054041
Energy: 1.0500618097071721
Energy: 1.049962072381785
Energy: 1.0204973533513857
Energy: 1.052666054815882
Energy: 1.0502486126706858
Energy: 1.1790183344063632
Energy: 1.057649594706218
Energy: 1.0185106712448013
Energy: 1.0152799946654782
Energy: 1.020919973509878
Energy: 1.0184682702230146
Energy: 1.3058403326476336
Energy: 1.0587588392505893
Energy: 1.0120871295551443
Energy: 1.0169617486732359
Energy: 1.0225755028019412
Energy: 1.0121372191361118
Energy: 1.0195760247022698
Energy: 1.0224123855357827
Energy: 1.049822592140919
Energy: 1.0207058369597053
Energy: 1.0176469624773261
Energy: 1.056941309209313
Energy: 1.0189373988191905
Energy: 1.0750544373290192
Energy: 1.0765647443499957
Energy: 1.019691499160562
Energy: 1.074912961141362
Energy: 1.0745338511987386
Energy: 1.015244685015696
Energy: 1.0220444425097668
Energy: 1.020813806578831
Energy: 1.0165765565662754
Energy: 1.0181538964287575
Energy: 1.0178571555724194
Energy: 1.019973834535644
Energy: 1.0621715672377074
Energy: 1.0192718996382097
Energy: 1.0622054633190896
Energy: 1.020969378347549
Energy: 1.0186870382073456
Energy: 1.0164001073461024
Energy: 1.0505614640466525
Energy: 1.0559344640354225
Energy: 1.0196333729600995
Energy: 1.0502102111776823
Energy: 1.053182006478019
Energy: 1.16430168818128
Energy: 1.1205522453835
Energy: 1.1174416717200812
Energy: 1.0436300041427202
Energy: 1.1172542155376042
Energy: 1.1175951383650187
Energy: 1.165240713114958
Energy: 1.1177402019606726
Energy: 1.1140759725217955
Energy: 1.04465339475231
Energy: 1.1171902015703696
Energy: 1.051417596599812
Energy: 1.016408734647299
Energy: 1.0122521901723218
Energy: 1.1115780863151623
Energy: 1.0195522933704608
Energy: 1.0465102336378056
Energy: 1.0506074937303054
Energy: 1.0196519403172921
Energy: 1.0125242726646346
Energy: 1.0123450963182778
Energy: 1.019434314833242
Energy: 1.0124407683682761
Energy: 1.013013683336391
Energy: 1.0165003732015863
Energy: 1.052465921290761
Energy: 1.054198249785901
Energy: 1.0183521846814363
Energy: 1.0185667303643078
Energy: 1.0488940211850943
Energy: 1.0120095326862046
Energy: 1.0693306295672735
Energy: 1.0171635486337829
Energy: 1.0726570145340057
Energy: 1.142744125868791
Energy: 1.074764322714198
Energy: 1.0161947015970803
Energy: 1.0164493778264336
Energy: 1.0178593346357563
Energy: 1.017629818919544
Energy: 1.0160193223489622
Energy: 1.0192716578878485
Energy: 1.1738659972304282
Energy: 1.0592011709135019
Energy: 1.0607770202423186
Energy: 1.0201542517646058
Energy: 1.0167463847099356
Energy: 1.062374353373992
Energy: 1.173240468991383
Energy: 1.019896440820695
Energy: 1.0537319874904423
Energy: 1.0506379460901933
Energy: 1.0573008046903092
Energy: 1.0551571304357743
Energy: 1.0201282522638697
Energy: 1.051379393529049
Energy: 1.0499599944933249
Energy: 1.0209121771971161
Energy: 1.0444974110782463
Energy: 1.050855928686769
Energy: 1.247115897622742
Energy: 1.0583202261223308
Energy: 1.059415467025835
Energy: 1.247950976971563
Energy: 1.0541076827789948
Energy: 1.1190529795367663
Energy: 1.0161074351845265
Energy: 1.0198128037173158
Energy: 1.056022665127158
Energy: 1.0747916107424516
Energy: 1.0188704802257358
Energy: 1.0482110295617166
Energy: 1.30540768060358
Energy: 1.151149791452351
Energy: 1.0715252387950582
Energy: 1.0122312593387062
Energy: 1.120187856270636
Energy: 1.0708358451682984

minimum gb energy = 1.011046855558784 eV
minimum distance =  2.33894866823715 Angstroms
sigma value = 43


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

Energy: 1.7899674948357496
Energy: 1.1234539975040032
Energy: 1.1858211823144942
Energy: 1.118628646127112
Energy: 1.312990456792185
Energy: 1.1194904917800197
Energy: 1.0579666079144823
Energy: 1.055663167682602
Energy: 1.0559323157117864
Energy: 1.1000754445314775
Energy: 1.0376569195933696
Energy: 1.0567153330031842
Energy: 1.0579935985854472
Energy: 1.036135274355599
Energy: 1.0357450997038349
Energy: 1.0904441788362467
Energy: 1.0352571469581413
Energy: 1.0589312851308503
Energy: 1.0589859821618168
Energy: 1.0340537716462037
Energy: 1.0589172801197348
Energy: 1.0590398628566637
Energy: 1.032402663106559
Energy: 1.0588855448493908
Energy: 1.0564273229323091
Energy: 1.0787783787437346
Energy: 1.0800754724553787
Energy: 1.056833229049208
Energy: 1.0760065627598665
Energy: 1.0765334608004502
Energy: 1.0590776949065779
Energy: 1.0749241926662025
Energy: 1.0567566009237952
Energy: 1.11906292976329
Energy: 1.0678618900008578
Energy: 1.1153606517910852
Energy: 1.057234936225508
Energy: 1.0564700817779733
Energy: 1.0621611288585104
Energy: 1.0518380628467343
Energy: 1.0568569698406343
Energy: 1.0633447733241057
Energy: 1.2114356696392694
Energy: 1.0581974709354782
Energy: 1.058578320551135
Energy: 1.031870447629261
Energy: 1.058165213780252
Energy: 1.0589983230190245
Energy: 1.049858871158937
Energy: 1.0576654361673739
Energy: 1.0581730859221048
Energy: 1.0500249054754534
Energy: 1.0582044128183328
Energy: 1.0673401822698008
Energy: 1.2468846799124862
Energy: 1.0555310725049432
Energy: 1.0554897078880088
Energy: 1.1732637687875394
Energy: 1.055323201304752
Energy: 1.0557671304041463
Energy: 1.033432331563916
Energy: 1.0718309461781452
Energy: 1.0291211955716526
Energy: 1.051279103422285
Energy: 1.0320414901134425
Energy: 1.0321756317506103
Energy: 1.0633941315830668
Energy: 1.0597411280381455
Energy: 1.0596074522923904
Energy: 1.1006951295537442
Energy: 1.0591894659368317
Energy: 1.0594273206872442
Energy: 1.2562502173052115
Energy: 1.0591839944858226
Energy: 1.0792575680841034
Energy: 1.0333721496827575
Energy: 1.0588446097849036
Energy: 1.07910184290933
Energy: 1.0341722688121926
Energy: 1.0713516768848477
Energy: 1.055042204685696
Energy: 1.050524150794858
Energy: 1.0592129867045634
Energy: 1.0552367919409167
Energy: 1.0337321133887898
Energy: 1.1356957005560155
Energy: 1.0393546303504169
Energy: 1.035418264848376
Energy: 1.124728346014227
Energy: 1.0395778395119966
Energy: 1.031842442189503
Energy: 1.1111284759101314
Energy: 1.0331049676827075
Energy: 1.0335371725450473
Energy: 1.0647121211315524
Energy: 1.0322020842828605
Energy: 1.0341359393646805
Energy: 1.03254855427881
Energy: 1.0329827481398763
Energy: 1.0343873730187212
Energy: 1.029512300945135
Energy: 1.0339586405523462
Energy: 1.036651298752715
Energy: 1.033375650143401
Energy: 1.034590348808809
Energy: 1.0550500197256611
Energy: 1.0334629086721385
Energy: 1.0343181501429741
Energy: 1.0468077932229696
Energy: 1.034044183556347
Energy: 1.0345764280120315
Energy: 1.0695977108687873
Energy: 1.033473315673269
Energy: 1.056974972632183
Energy: 1.1596575272650342
Energy: 1.0338428276506426
Energy: 1.0337876127929497
Energy: 1.054689919427066
Energy: 1.033189899757143
Energy: 1.0574724826067055
Energy: 1.0361697198746995
Energy: 1.0329301310602361
Energy: 1.0329553164609697
Energy: 1.055385052364927
Energy: 1.0513019191684327
Energy: 1.0328951685731969
Energy: 1.2188556254251262
Energy: 1.0787667605843632
Energy: 1.1259504886623657
Energy: 1.1089701235031293
Energy: 1.0299346361541049
Energy: 1.1844247492331912
Energy: 1.0873577159045122
Energy: 1.032567052602031
Energy: 1.03290459901887
Energy: 1.0535208060798098
Energy: 1.0551597234201264
Energy: 1.0632902705335292
Energy: 1.1652974210715001
Energy: 1.033268115607427
Energy: 1.0348186042661103
Energy: 1.0299295376095619
Energy: 1.1973989993601035
Energy: 1.035555508601437
Energy: 1.087091891564899
Energy: 1.0347644486188332
Energy: 1.0354308660003761
Energy: 1.0740255316799558
Energy: 1.0337154724816755
Energy: 1.0354899314899686
Energy: 1.1255458440957424
Energy: 1.0336124519944907
Energy: 1.0342579105612386
Energy: 1.0329440991128704
Energy: 1.0325508378374615
Energy: 1.0549641595491153
Energy: 1.1255994589792575
Energy: 1.0327017795246431
Energy: 1.032735559950709
Energy: 1.071670442956766
Energy: 1.0328061606315904
Energy: 1.0328615940841015
Energy: 1.101469776525379
Energy: 1.0383190267661004
Energy: 1.0671804866846781
Energy: 1.0581918647155046
Energy: 1.0610736419378606
Energy: 1.067977448532191
Energy: 1.0593574455058237
Energy: 1.0557437909675411
Energy: 1.0559372065871395
Energy: 1.060534317014413
Energy: 1.0284861996392907
Energy: 1.0559222184273696
Energy: 1.059483352562471
Energy: 1.054680656270385
Energy: 1.0705486930840125
Energy: 1.1009597012312256
Energy: 1.0507089807784784
Energy: 1.0689099455123978
Energy: 1.0323293262496513
Energy: 1.0340433877605808
Energy: 1.1022815353994089
Energy: 1.077515141989918
Energy: 1.1419151406477073
Energy: 1.0339530834743593

minimum gb energy = 1.0284861996392907 eV
minimum distance =  2.30423232845586 Angstroms
sigma value = 57


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

Energy: 1.3498590260091448
Energy: 4.1607328519957045
Energy: 1.1108459760532987
Energy: 1.112711654095549
Energy: 1.1545037205516824
Energy: 1.111073737149089
Energy: 1.0368366945536784
Energy: 1.0393820240959861
Energy: 1.0527408595671581
Energy: 1.0463190038457237
Energy: 1.0455295919458654
Energy: 1.0099659431948815
Energy: 1.0402713819582758
Energy: 0.9668054052435845
Energy: 0.9670254888609187
Energy: 1.1189754843399196
Energy: 0.9688442743521264
Energy: 0.9666282798241795
Energy: 1.039852019149807
Energy: 0.9661699247161556
Energy: 0.9665738561398458
Energy: 1.037844135295955
Energy: 0.9689983227784476
Energy: 1.0383398267439066
Energy: 1.0340926802535937
Energy: 1.0118770753586963
Energy: 1.0108365486680333
Energy: 1.0348430998977585
Energy: 1.0106005458736884
Energy: 1.0096032161797728
Energy: 0.9670341346871884
Energy: 1.0086127324068874
Energy: 1.0130917357523825
Energy: 1.0084585184656216
Energy: 1.009084599033732
Energy: 1.0118025749032427
Energy: 1.0432334884874477
Energy: 1.0348264206385835
Energy: 1.0357276621558678
Energy: 1.0550972991024354
Energy: 1.037161185203066
Energy: 1.0540808261744772
Energy: 1.0283217406243215
Energy: 1.0403512699089594
Energy: 1.1177050047104784
Energy: 1.0412482454632914
Energy: 1.038596433521379
Energy: 1.039079920791731
Energy: 1.0430904348196086
Energy: 1.0378708344996268
Energy: 1.0375660955366013
Energy: 1.044256976409908
Energy: 1.0401471077091058
Energy: 1.008407792375349
Energy: 1.185554287183211
Energy: 1.0349217512514537
Energy: 1.0352007411068427
Energy: 1.1163222468729124
Energy: 1.0350786739711577
Energy: 1.0346749982933108
Energy: 1.040903018659388
Energy: 1.0037471372808395
Energy: 1.035582230477555
Energy: 1.050458872055131
Energy: 1.0297353279571493
Energy: 1.0378477354420315
Energy: 0.9658328215646013
Energy: 1.0408935068256324
Energy: 1.0387993675497156
Energy: 0.9653607719994616
Energy: 1.0461108587614825
Energy: 1.0983045672899576
Energy: 0.9657411849328381
Energy: 1.1144301449672152
Energy: 1.0985134757629966
Energy: 1.1250122445201765
Energy: 1.0408387952272726
Energy: 1.0987765920018266
Energy: 1.0406057927745949
Energy: 1.0098635092601669
Energy: 1.009286229330991
Energy: 1.0445590310785524
Energy: 1.0434331579594738
Energy: 1.0081603732135787
Energy: 1.0393081265450368
Energy: 1.1121676645571819
Energy: 1.1120672041688453
Energy: 1.0416952027580406
Energy: 1.1128602542977148
Energy: 1.115852744435722
Energy: 1.0338954809730612
Energy: 1.0092660582135469
Energy: 1.0095923965291826
Energy: 1.0357723241251962
Energy: 1.0105817654772196
Energy: 1.0515783010419582
Energy: 1.0342630855773516
Energy: 1.0091277989233256
Energy: 1.012060816275164
Energy: 1.0082449167372318
Energy: 1.0102751779013794
Energy: 1.0129334264506424
Energy: 1.0354270915438175
Energy: 1.00944337538347
Energy: 1.0094311944382495
Energy: 1.0088392520850973
Energy: 1.035403328140475
Energy: 1.0103391989332928
Energy: 1.0428341988063388
Energy: 1.037451928670119
Energy: 1.0384420384894886
Energy: 1.00890452465082
Energy: 1.0380269317478705
Energy: 1.0407753031596296
Energy: 1.0431851771880716
Energy: 1.0398875156672298
Energy: 1.0390696578514573
Energy: 1.0080392528915918
Energy: 1.0412451873457345
Energy: 1.038387684870047
Energy: 1.046851564393026
Energy: 1.0383513700013136
Energy: 1.0105342884669692
Energy: 1.0457703035234303
Energy: 1.0426262325316273
Energy: 1.008810902495439
Energy: 1.2396473226437432
Energy: 1.0284082144806281
Energy: 1.0314171610120397
Energy: 1.1535241057917223
Energy: 1.0388344583071478
Energy: 1.1159140222181854
Energy: 1.0407483917210891
Energy: 1.038748101214171
Energy: 1.0084120784239838
Energy: 1.0451364490089912
Energy: 1.0430013415498052
Energy: 1.0087404227788568
Energy: 0.9657485190411409
Energy: 1.114886662829477
Energy: 1.0985547147178276
Energy: 1.1250379068436347
Energy: 1.0409574951933664
Energy: 1.0990366066296633

minimum gb energy = 0.9653607719994616 eV
minimum distance =  2.28900620125536 Angstroms
sigma value = 17


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

Energy: 1.2562150731290105
Energy: 1.0566883322914367
Energy: 1.1500682455905318
Energy: 0.9949001925594648
Energy: 3.3149885505881187
Energy: 0.9985149778750375
Energy: 1.0596524601270527
Energy: 1.0528684949624088
Energy: 1.0545916680898106
Energy: 1.1069171632354733
Energy: 1.0528739925572042
Energy: 0.9933886259000339
Energy: 1.053985281327171
Energy: 0.9474360491499987
Energy: 0.9482633888530639
Energy: 1.055132210033632
Energy: 0.9509318192349347
Energy: 0.9490860555482502
Energy: 1.053234553472095
Energy: 0.9489490632821699
Energy: 0.9486256038670484
Energy: 1.0514409171176942
Energy: 0.9492445750944652
Energy: 1.051117428020913
Energy: 0.9344702690853974
Energy: 0.9214475501256238
Energy: 0.9213638652240596
Energy: 0.9346881543309395
Energy: 0.9211136412816993
Energy: 1.0313286217611037
Energy: 0.9486706326480683
Energy: 0.9218493353788287
Energy: 0.966584237770035
Energy: 0.8879442116760294
Energy: 0.921608119298095
Energy: 0.889238077763592
Energy: 0.9209153646013379
Energy: 0.9192918814813738
Energy: 0.9207674922458475
Energy: 0.9201919457420942
Energy: 0.9212118232330568
Energy: 0.9722042021923584
Energy: 0.9216901180370709
Energy: 0.9691856702544078
Energy: 0.9698061666554765
Energy: 1.0161989840498176
Energy: 1.0379260915432151
Energy: 0.9695088257793678
Energy: 0.9231538708846792
Energy: 1.0174253731914664
Energy: 0.9735375552666841
Energy: 0.9250299090666722
Energy: 0.932437589399529
Energy: 0.9221732892717501
Energy: 0.9207862667277598
Energy: 0.9674421991685344
Energy: 0.9665728183384922
Energy: 0.9211232117518333
Energy: 0.9217644665497785
Energy: 0.9668994346317223
Energy: 0.9215040404202315
Energy: 0.9908126979017396
Energy: 0.9901288518305744
Energy: 0.9210238100823711
Energy: 1.0620826191162749
Energy: 0.9896870353122462
Energy: 1.047312564921854
Energy: 1.0507686731911894
Energy: 1.0511866908721532
Energy: 0.9873899318336642
Energy: 1.0506031856078313
Energy: 1.0515771789207378
Energy: 1.0464224344588018
Energy: 1.0566169467536461
Energy: 1.0556235262290505
Energy: 0.9173160084084803
Energy: 1.057231516227948
Energy: 1.0968570865737808
Energy: 1.0653228528518266
Energy: 1.053553981398062
Energy: 1.0353985136623316
Energy: 1.0652990688741069
Energy: 1.0538642312447515
Energy: 0.9927833326470444
Energy: 1.0700696599760078
Energy: 1.055397912395935
Energy: 1.0467089762488344
Energy: 1.0628288482411339
Energy: 1.054913856337018
Energy: 1.0640998276587594
Energy: 1.1195134881804498
Energy: 1.1089120600942748
Energy: 0.9940620501032683
Energy: 1.1083287435413018
Energy: 1.0643532128588982
Energy: 1.0526212003461626
Energy: 1.0322391565340343
Energy: 1.0639613428786732
Energy: 1.1499716554897303
Energy: 0.9478560418937696
Energy: 1.0544694059216242
Energy: 1.149986262981228

minimum gb energy = 0.8879442116760294 eV
minimum distance =  2.31249663773817 Angstroms
sigma value = 17


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

Energy: 0.857783568640041
Energy: 1.0579180049713246
Energy: 0.9918088911262234
Energy: 0.9513157558199299
Energy: 1.4304121488080748
Energy: 0.9488930161794364
Energy: 1.1318255050252775
Energy: 1.0403389625979722
Energy: 0.9024323965604903
Energy: 1.0402361927384038
Energy: 1.0437189073823343
Energy: 1.0023378633578666
Energy: 1.233510558029117
Energy: 0.8550559436965385
Energy: 0.9475595335457001
Energy: 1.0407331526595882
Energy: 0.8946969896810522
Energy: 0.9482348744107062
Energy: 1.0465498404457783
Energy: 0.9482043817874491
Energy: 0.947493712061932
Energy: 1.0470518165853462
Energy: 0.8520608672412511
Energy: 0.9480606294446627
Energy: 0.9150266137837649
Energy: 0.9038238333263275
Energy: 0.9033166862721055
Energy: 0.9160246462741273
Energy: 0.902849222982029
Energy: 0.9385443447515118
Energy: 0.9485747693433731
Energy: 0.900630450504986
Energy: 0.8536744742828534
Energy: 0.8611457660109265
Energy: 0.9005152836195099
Energy: 0.8912127678334452
Energy: 0.8380871852664535
Energy: 0.9016944094471014
Energy: 0.9006832990376081
Energy: 0.8763800766351311
Energy: 0.9042906464231698
Energy: 0.9320462163399712
Energy: 0.8402478887109954
Energy: 0.8260555005597413
Energy: 0.8390041293171308
Energy: 0.840389953200603
Energy: 0.8868167685707078
Energy: 0.8404065491355172
Energy: 0.8395522661427146
Energy: 0.9047520941935667
Energy: 0.8376179840839221
Energy: 0.8410297514899211
Energy: 0.9021191541097172
Energy: 0.8398362518594065
Energy: 0.8393702461124825
Energy: 0.9474606025974441
Energy: 0.9438443985496936
Energy: 0.8392864779146365
Energy: 0.8970214037658238
Energy: 0.9465672197224836
Energy: 0.8399148392069963
Energy: 0.8387503793520574
Energy: 0.9529902585029946
Energy: 0.9093441019688296
Energy: 0.8392328199516785
Energy: 0.9418233784922077
Energy: 0.8416815470669884
Energy: 0.8400186223456366
Energy: 0.8395765576795388
Energy: 0.8566504930734649
Energy: 0.8402335568223599
Energy: 0.8387861548774589
Energy: 0.902225196861044
Energy: 0.839502128887292
Energy: 0.8410793259259894
Energy: 0.9473143735715656
Energy: 0.8392781959837693
Energy: 0.8413385696196409
Energy: 0.9030841189366579
Energy: 0.913476380936855
Energy: 0.8864733222400749
Energy: 0.903155927053138
Energy: 0.8765624595117031
Energy: 0.9007657941210113
Energy: 0.9006353552262989
Energy: 0.9068551583327977
Energy: 0.9166871014453041
Energy: 0.9008728071213806
Energy: 0.8466987781270741
Energy: 0.9656164375042241
Energy: 1.0346561206626301
Energy: 0.9835754192534328
Energy: 0.9612798756223906
Energy: 0.9019467563993181
Energy: 0.9172599308795075
Energy: 0.9396547103862064
Energy: 0.8381989926954727
Energy: 1.0422177390366414
Energy: 1.0421691169030236
Energy: 0.9232089393106375
Energy: 1.0423364475560628
Energy: 0.8998377249464581
Energy: 0.917711072929188
Energy: 1.0402884141038913
Energy: 1.0421572305971363
Energy: 0.9229020218623842
Energy: 1.0405772155578146
Energy: 0.9000478977503822
Energy: 1.149092841197726
Energy: 1.0403400723035214
Energy: 0.9833622353303217
Energy: 1.0419578336886548
Energy: 0.9155145763296264
Energy: 0.902533963524522
Energy: 1.1772901756992944
Energy: 0.9018400932425245
Energy: 0.9067837999641066
Energy: 1.0571374013088617
Energy: 0.9014156452504096
Energy: 1.0454178148555104
Energy: 1.1386592519560705
Energy: 1.0408215006194415
Energy: 0.9835346202732583
Energy: 1.0427388811413298
Energy: 1.0446610720424345
Energy: 1.0393404074586823
Energy: 0.8520875175141971
Energy: 1.0513263157573898
Energy: 1.1312685488889707
Energy: 0.946443670066508
Energy: 1.043936111297077
Energy: 0.9465157627172158
Energy: 0.8568489239048508
Energy: 1.0420513377787703
Energy: 1.0417389525287486
Energy: 0.8594755757796199
Energy: 1.0505761399978686
Energy: 1.1302878116479822
Energy: 1.2214357426563527
Energy: 0.9471652175781105
Energy: 1.0398110468826116
Energy: 1.044532059684402
Energy: 0.8515999016759761
Energy: 1.0401425533365305
Energy: 1.039254374773716
Energy: 0.8578022607711324
Energy: 0.9758222144910463
Energy: 1.0394671407219902
Energy: 0.8549786810214072
Energy: 0.9482927747104909
Energy: 0.9188396610513088
Energy: 0.9048953983617376
Energy: 0.9035044382045969
Energy: 0.9189471960196446
Energy: 0.9029204823663441
Energy: 0.9654190280499342
Energy: 0.9484199997484369
Energy: 0.9010641231384058
Energy: 0.932160291923573
Energy: 0.8936214314598613
Energy: 0.9013475722970892
Energy: 0.852185343065463
Energy: 0.8240633526964466
Energy: 0.9021434367345187
Energy: 0.9022085123650164
Energy: 0.9004811364957767
Energy: 0.903503928824275
Energy: 0.9021387382500083
Energy: 0.8404582971437181
Energy: 0.9624837852099788
Energy: 0.9519124045685288
Energy: 0.8483038604108533
Energy: 0.9006925426900758
Energy: 0.9491183309625448
Energy: 0.8397455811601237
Energy: 0.9399579278124581
Energy: 0.9386068953462305
Energy: 0.8398322787619473
Energy: 0.9417922451919244
Energy: 0.8411517990641562
Energy: 0.844422039067908
Energy: 0.9435345399226512
Energy: 0.9447170717835872
Energy: 0.8458831939874516
Energy: 0.9486444915375439
Energy: 0.8981472306698476
Energy: 0.8408702527164686
Energy: 0.9430300656938855
Energy: 0.942187218943645
Energy: 0.9030503733235409
Energy: 0.9490845574673119
Energy: 0.9504455445934511
Energy: 0.852546353886314
Energy: 0.839490553385137
Energy: 0.839235071989942
Energy: 0.8533966173253736
Energy: 0.8400447496085426
Energy: 0.8392284271307809
Energy: 0.9010873384901076
Energy: 0.9617392988612086
Energy: 0.9427352576352585
Energy: 0.9417562225614697
Energy: 0.8403671856066097
Energy: 0.9067230835153022
Energy: 0.9025565077558027
Energy: 0.9045315855634863
Energy: 0.9060483808381568
Energy: 0.9025803612133045
Energy: 0.9037518140421944
Energy: 0.957458557045205
Energy: 0.9008148666802326
Energy: 0.9372032196626355
Energy: 0.9626892590223431
Energy: 0.9008141663567251
Energy: 0.9367210305492841
Energy: 0.9007739781605921
Energy: 1.1518053065393417
Energy: 0.9630966914458979
Energy: 0.9377645120925083
Energy: 0.90382534700718
Energy: 0.9254707910791096
Energy: 0.9385829220547576
Energy: 0.8375492753018605
Energy: 1.040911299665941
Energy: 1.0409379332879325
Energy: 0.9298444679090029
Energy: 1.044375492880014
Energy: 0.9853830142489955
Energy: 0.9154725575732534
Energy: 1.0506251506836322
Energy: 0.9081689255407289
Energy: 0.9011694364991288
Energy: 1.0428106117267484
Energy: 0.9015609850633196
Energy: 0.9012464585619248
Energy: 1.041349462687733
Energy: 1.0400582424639908
Energy: 0.9168446533137438
Energy: 1.0451895918813463
Energy: 0.9806915817490622
Energy: 1.1580526555125334
Energy: 0.9015048862798363
Energy: 1.0386862097823266
Energy: 1.0506365243150482
Energy: 0.8996580782826045
Energy: 1.039249444784097
Energy: 1.2229525325709878
Energy: 0.9790530761943982
Energy: 0.9837804005933352
Energy: 1.0479203446043055
Energy: 0.9158135552629904
Energy: 1.0176520604636976
Energy: 0.8583490542270775
Energy: 1.0415061541869268
Energy: 1.0415050598467197
Energy: 0.8508676852012367
Energy: 1.0461482036241725
Energy: 1.130175324310076

minimum gb energy = 0.8240633526964466 eV
minimum distance =  2.27227653746437 Angstroms
sigma value = 57


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

Energy: 0.9861844982666538
Energy: 1.344114481460792
Energy: 0.9701055297160942
Energy: 0.8386891247228623
Energy: 1.3432217273368903
Energy: 1.0101633215927281
Energy: 1.0894581781733452
Energy: 0.8912762830571009
Energy: 0.8850795934315487
Energy: 1.0198053356922132
Energy: 0.8934769075212051
Energy: 0.9821032871371219
Energy: 1.1768233374852926
Energy: 0.834384654222719
Energy: 0.8372652660479557
Energy: 1.013654440746094
Energy: 0.8345461357504038
Energy: 0.9319502646926417
Energy: 1.0147372368692473
Energy: 0.8367932007710284
Energy: 0.932167036954014
Energy: 1.0135100584873262
Energy: 0.8649542722980148
Energy: 0.9319442280960905
Energy: 0.872539788204486
Energy: 0.8926826257182899
Energy: 0.887034359389378
Energy: 0.8730901164658036
Energy: 0.887253686556226
Energy: 0.936628355327966
Energy: 0.8795153625658847
Energy: 0.8841482384359624
Energy: 0.8386616196927617
Energy: 0.8919609205917153
Energy: 0.8844941208340765
Energy: 0.8651350000886164
Energy: 0.8093976767172048
Energy: 0.8910235990630727
Energy: 0.883885759017288
Energy: 0.8779014716192264
Energy: 0.8906020216424416
Energy: 0.9008132610632725
Energy: 0.8162410039411669
Energy: 0.8900229300424687
Energy: 0.9074174681323676
Energy: 0.811665566901724
Energy: 0.8900791389802232
Energy: 0.8442140017955628
Energy: 0.8144954531148373
Energy: 0.8119512507487991
Energy: 0.8106272198875233
Energy: 0.816260627484943
Energy: 0.8185493431155152
Energy: 0.810988522998262
Energy: 0.8111631588256547
Energy: 0.8853627094593478
Energy: 0.8888124318485711
Energy: 0.811139735765555
Energy: 0.7845828928193816
Energy: 0.8910110269362719
Energy: 0.7858731624887807
Energy: 0.776077430986369
Energy: 0.841576229518195
Energy: 0.8848746413159945
Energy: 0.7777040564534057
Energy: 0.8955107182052052
Energy: 0.8151885134395814
Energy: 0.7775174639161162
Energy: 0.7765706277041332
Energy: 0.8873915846246371
Energy: 0.7837120942921735
Energy: 0.8372258548609082
Energy: 0.7758775320215463
Energy: 0.8867195446748348
Energy: 0.8849793337247005
Energy: 0.8856615216506732
Energy: 0.8401489447590846
Energy: 0.8858953736506784
Energy: 0.7775869299037135
Energy: 0.8897739495761781
Energy: 0.7768565093602623
Energy: 0.7796790311968633
Energy: 0.845397110552123
Energy: 0.7769031539367339
Energy: 0.776727426280154
Energy: 0.8935366183550955
Energy: 0.8926564321489655
Energy: 0.7760619006392652
Energy: 0.9057856557442671
Energy: 0.9009592105118069
Energy: 0.8316261028995906
Energy: 0.809903446500863
Energy: 0.9054248655103977
Energy: 0.8437008556655569
Energy: 0.811341126944502
Energy: 0.9041373934386155
Energy: 0.8294589481220377
Energy: 0.810807209638669
Energy: 0.810626396077405
Energy: 0.8874389290122361
Energy: 0.811559387409239
Energy: 0.8114632487013914
Energy: 0.7808713480988573
Energy: 0.8129441078914514
Energy: 0.8703070069693032
Energy: 0.8271125066607371
Energy: 0.8215695523195223
Energy: 0.9164741955614095
Energy: 0.8842598823437194
Energy: 0.8805392547485515
Energy: 0.9010978743163512
Energy: 0.8866184591468901
Energy: 0.8401843344427041
Energy: 0.8849814942468588
Energy: 0.8834329477955262
Energy: 0.8153432434535568
Energy: 0.8165471554210256
Energy: 0.8849181692029888
Energy: 0.8147574603464531
Energy: 0.8856762581769672
Energy: 1.0051338888628922
Energy: 0.8883885407603518
Energy: 0.9327451702098742
Energy: 0.8863662656377552
Energy: 0.8884995546909545
Energy: 0.9433216206172211
Energy: 0.8929340776058248
Energy: 1.014308640394305
Energy: 0.8840697933207733
Energy: 0.8934432721473536
Energy: 1.013765912411433
Energy: 0.8845545156652641
Energy: 0.8162159623083884
Energy: 1.014114403637043
Energy: 1.0141598044214315
Energy: 0.9001051840892732
Energy: 1.0184158952226645
Energy: 1.0154436877407393
Energy: 1.0927926002951365
Energy: 0.8838080053950628
Energy: 0.8946933035202335
Energy: 0.8916829646980415
Energy: 0.9295500611964191
Energy: 0.8871184253081278
Energy: 1.181067250509702
Energy: 0.8847274944312544
Energy: 0.8854324506817995
Energy: 1.0130490444512437
Energy: 0.9133228213567645
Energy: 1.0126092949600323
Energy: 1.1730302721431842
Energy: 0.9968930483940723
Energy: 0.9937332607634712
Energy: 1.0177092051569712
Energy: 1.0188462298790586
Energy: 0.9595185878595249
Energy: 0.9553294602239132
Energy: 1.0129197023440573
Energy: 0.9313642226636047
Energy: 0.8955810652373265
Energy: 1.0126868619542617
Energy: 0.9319107415019344

minimum gb energy = 0.7758775320215463 eV
minimum distance =  2.28078361931431 Angstroms
sigma value = 43


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

Energy: 0.8688839524029401
Energy: 0.9407931634798402
Energy: 0.9131809816039175
Energy: 0.7673155842394777
Energy: 0.9858816925011263
Energy: 0.8560404155745177
Energy: 0.9594750851937176
Energy: 0.8132689472171463
Energy: 0.8353644371385189
Energy: 0.9111226265342587
Energy: 0.8142282138804247
Energy: 0.8916632741253966
Energy: 1.0319238198406
Energy: 0.7928766601594313
Energy: 0.7998179594708679
Energy: 0.9119088205730339
Energy: 0.7929570701709381
Energy: 0.7698495379783847
Energy: 0.9034625462677397
Energy: 0.7985455593038516
Energy: 0.7702743988394419
Energy: 0.8130124786043462
Energy: 0.7931870145880393
Energy: 0.8483345162429604
Energy: 0.8099909165263051
Energy: 0.8105447176293646
Energy: 0.8103263095661543
Energy: 0.8109100964891592
Energy: 0.8135216093014717
Energy: 0.8344728674321319
Energy: 0.6675902874110795
Energy: 0.8096419521674841
Energy: 0.7964478106338821
Energy: 0.7731945308989828
Energy: 0.8096489081276208
Energy: 0.7938008304482012
Energy: 0.9406998572442984
Energy: 0.8099579810229443
Energy: 0.8092784208557837
Energy: 0.7471547777776685
Energy: 0.8106709489078004
Energy: 0.7987276387947735
Energy: 0.9367280947854576
Energy: 0.7707985898178517
Energy: 0.783817675336832
Energy: 0.7441869021747107
Energy: 0.7708718443118526
Energy: 0.7829628677145624
Energy: 0.7470181874212337
Energy: 0.7561541166649798
Energy: 0.7440964485967354
Energy: 0.7490766977400591
Energy: 0.6845648387156935
Energy: 0.7438521008865636
Energy: 0.7213438224845954
Energy: 0.7717183374135723
Energy: 0.7712449256096638
Energy: 0.7289254580937118
Energy: 0.7521024804415348
Energy: 0.7713296839757863
Energy: 0.6617882435781047
Energy: 0.701510016495714
Energy: 0.7029969979077049
Energy: 0.7579118403269824
Energy: 0.7015810566594441
Energy: 0.7705023678504159
Energy: 0.7443840071971106
Energy: 0.7018545437724727
Energy: 0.70136607789723
Energy: 0.7752401310852034
Energy: 0.7023711456967948
Energy: 0.7661822114631455
Energy: 0.6770854462512067
Energy: 0.7575462412669733
Energy: 0.7640164186822738
Energy: 0.7672100246602778
Energy: 0.7573800387618309
Energy: 0.7675921734936481
Energy: 0.6769404630250553
Energy: 0.6773493081293692
Energy: 0.6766953500613102
Energy: 0.6788524204657073
Energy: 0.6652482545283485
Energy: 0.6769814041242548
Energy: 0.6768849268585733
Energy: 0.7524209248596189
Energy: 0.7507236334616436
Energy: 0.6763880961268397
Energy: 0.7212923640814444
Energy: 0.7514897091345056
Energy: 0.6670839859308284
Energy: 0.6646189205023034
Energy: 0.6658399197018225
Energy: 0.7559618085347416
Energy: 0.6648995613417416
Energy: 0.7565622953575102
Energy: 0.6817302710899455
Energy: 0.6652329717471926
Energy: 0.6647723526879106
Energy: 0.7557818606897777
Energy: 0.6653965395976558
Energy: 0.7558743476665869
Energy: 0.664736948986927
Energy: 0.755502406423272
Energy: 0.7552551356736258
Energy: 0.6651139896542617
Energy: 0.7568398730641495
Energy: 0.7579985948289656
Energy: 0.6654892870499776
Energy: 0.6655048623358595
Energy: 0.6647621979895545
Energy: 0.6672416606785255
Energy: 0.7393926310477168
Energy: 0.6652581215919599
Energy: 0.6643721681488458
Energy: 0.7574087682159321
Energy: 0.7588549438736637
Energy: 0.6651396622198544
Energy: 0.7573090284486552
Energy: 0.7614194304961968
Energy: 0.7062195313486789
Energy: 0.6769611130200729
Energy: 0.6769122939741672
Energy: 0.7622970933550158
Energy: 0.6772537065618789
Energy: 0.7612688169507924
Energy: 0.6671981433142736
Energy: 0.6764962132188147
Energy: 0.6769602003340468
Energy: 0.7633432750675516
Energy: 0.6766634403213297
Energy: 0.7647218188864864
Energy: 0.7024136118705754
Energy: 0.7288112331203976
Energy: 0.7566462776977627
Energy: 0.7014064637685283
Energy: 0.6785006276566568
Energy: 0.756243525871389
Energy: 0.7019991786940932
Energy: 0.7030215661524495
Energy: 0.7019631058012717
Energy: 0.7042387804098028
Energy: 0.6767978326994432
Energy: 0.7019666178834255
Energy: 0.9091706892981538
Energy: 0.764146109560207
Energy: 0.7733930288540879
Energy: 0.7473451735281033
Energy: 0.7643956086576154
Energy: 0.7725346518978816
Energy: 0.8493054962958858
Energy: 0.7440500242889035
Energy: 0.7435912681065047
Energy: 0.7032597986374983
Energy: 0.7444982278472629
Energy: 0.7748931775565868
Energy: 0.6650197501054744
Energy: 0.7436941680611
Energy: 0.7447147289350716
Energy: 0.7658091189026839
Energy: 0.7438398471376424
Energy: 0.778513029782537
Energy: 0.743395741114595
Energy: 0.7787176429190674
Energy: 0.7798994349802754
Energy: 0.7036530282077819
Energy: 0.7470251767652104
Energy: 0.8021829728683154
Energy: 0.8133387527558497
Energy: 0.7436845905313747
Energy: 0.8097497557730927
Energy: 0.815371109249798
Energy: 0.7013211387813147
Energy: 0.8097769360832829
Energy: 0.9743548217079381
Energy: 0.7822315168618633
Energy: 0.8051610348993663
Energy: 0.8108802933677315
Energy: 0.7823169813935537
Energy: 0.7801181081240282
Energy: 0.9723885453101109
Energy: 0.8125081102232606
Energy: 0.8351965473394413
Energy: 0.8110123424291465
Energy: 0.8131530390951797
Energy: 0.8353315318310068
Energy: 0.6776856108190425
Energy: 0.9116648435372164
Energy: 0.8101623879898884
Energy: 0.7748460996230007
Energy: 0.9116104055591635
Energy: 0.7854294819668716
Energy: 0.8356108145199506
Energy: 0.8935156483160309
Energy: 0.880902689935855
Energy: 0.810464454146765
Energy: 0.9139227723407136
Energy: 0.8382961595793277
Energy: 0.97241476272007
Energy: 0.8104401954393743
Energy: 0.8099960257261033
Energy: 0.8133787993581173
Energy: 0.814307993585687
Energy: 0.9088383991798273
Energy: 1.0334650012572464
Energy: 0.7868516164599382
Energy: 0.8394439676206945
Energy: 0.912114605346203
Energy: 0.7871287538082329
Energy: 0.810261214119425
Energy: 0.9896814462625046
Energy: 0.8942064262060571
Energy: 0.8806454542860375
Energy: 0.9109035902911456
Energy: 0.8917419615869057
Energy: 0.8451613494200877

minimum gb energy = 0.6617882435781047 eV
minimum distance =  2.30210539074585 Angstroms
sigma value = 81


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

Energy: 0.4141800195464399
Energy: 7.080195938836853
Energy: 0.0952461552386556
Energy: 0.0977704128091884
Energy: 0.658431063932355
Energy: 0.4148656599405353
Energy: 0.7605420166371804
Energy: 0.6986257799191067
Energy: 0.6675107862706763
Energy: 0.6963802683995501
Energy: 0.7017060784703166
Energy: 0.711543025857287
Energy: 0.741902841185507
Energy: 0.09556702527384811
Energy: 0.09559697722775137
Energy: 0.7628507633982797
Energy: 0.09537851468716035
Energy: 0.14987955131429165
Energy: 0.7219982072172514
Energy: 0.09568843546256531
Energy: 0.09658341468069805
Energy: 0.6913754023809708
Energy: 0.09549232891580638
Energy: 0.14990427857517286
Energy: 0.15016862564599592
Energy: 0.779167798038459
Energy: 0.7365036895113091
Energy: 0.15085739424225167
Energy: 0.7890088875516661
Energy: 0.7938411759825721
Energy: 0.09643440739579312
Energy: 10.292141021841239
Energy: 0.09608354635355369
Energy: 0.09805976722230846
Energy: 0.742822021955252
Energy: 0.09575589114515919
Energy: 0.7787723924499704
Energy: 0.7328809706393539
Energy: 0.7935082038802079
Energy: 0.7956623096200632
Energy: 0.7122245678169928
Energy: 0.7296977146743293
Energy: 0.7724451062280919
Energy: 0.09554562462052403
Energy: 0.09559174682904403
Energy: 0.740704871144104
Energy: 0.09529325845007831
Energy: 0.0952321152507183
Energy: 0.6937665319106879
Energy: 0.09529730764164786
Energy: 0.14991886609313096
Energy: 0.7118851609993544
Energy: 0.09556967203022652
Energy: 0.15143648007525612
Energy: 0.41435977075508834
Energy: 0.7532447991016215
Energy: 0.72167231662239
Energy: 0.09522134323659613
Energy: 0.7437321278640593
Energy: 0.7397875410288405

minimum gb energy = 0.09522134323659613 eV
minimum distance =  2.30637436002827 Angstroms
sigma value = 3


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

Energy: 0.8658158890013975
Energy: 0.8842871070687683
Energy: 0.9108915630410087
Energy: 0.7928129956846517
Energy: 0.8818343175608712
Energy: 0.7978860741441651
Energy: 0.9033189083992608
Energy: 0.8866644781721553
Energy: 0.8959300633249737
Energy: 0.874946047627064
Energy: 0.8868576425990479
Energy: 0.8823081557081097
Energy: 0.8857046116227061
Energy: 0.8226800381909201
Energy: 0.8132366014534753
Energy: 0.884526733121699
Energy: 0.8456624073188286
Energy: 0.8868406525794007
Energy: 0.8212508271093082
Energy: 0.8446000160777952
Energy: 0.8448764327296038
Energy: 0.821120898516476
Energy: 0.7354116067831247
Energy: 0.8827193840591389
Energy: 0.7426157779772001
Energy: 0.8969149375387966
Energy: 0.8963538930228517
Energy: 0.7427971023331109
Energy: 0.8875022548173981
Energy: 0.8861461926987609
Energy: 0.6873056343863836
Energy: 0.8855076631593316
Energy: 0.8085769647477214
Energy: 0.687657020290638
Energy: 0.806407977792615
Energy: 0.7369593938831142
Energy: 0.8187028894261548
Energy: 0.7517485047468727
Energy: 0.7547259199182783
Energy: 0.8192346462068085
Energy: 0.7522714830934809
Energy: 0.8291851288927834
Energy: 0.8212849007783792
Energy: 0.692795167437728
Energy: 0.7472404689286251
Energy: 0.8214319477916046
Energy: 0.6555281449261464
Energy: 0.7465053197580338
Energy: 0.6993314034367385
Energy: 0.8238732010605778
Energy: 0.8311945579631381
Energy: 0.8716812703912794
Energy: 0.6919915267416094
Energy: 0.828912781226273
Energy: 0.6981473412525837
Energy: 0.7520289147749363
Energy: 0.7535845647785515
Energy: 0.6980694766610903
Energy: 0.7574314629244612
Energy: 0.7546421540886554
Energy: 0.6609909197695794
Energy: 0.7574386499788945
Energy: 0.7545669189154346
Energy: 0.6625075901073115
Energy: 0.7439386072803389
Energy: 0.6943692088511074
Energy: 0.6974252762953549
Energy: 0.7535272014688734
Energy: 0.7540183523666187
Energy: 0.697503415982859
Energy: 0.784724717734254
Energy: 0.6981797029402095
Energy: 0.7002090053321053
Energy: 0.6421169462938345
Energy: 0.7000517942183863
Energy: 0.7004479558089186
Energy: 0.6417391909321608
Energy: 0.6994084860842505
Energy: 0.6450122944919164
Energy: 0.6640979315981738
Energy: 0.6998618416434155
Energy: 0.7028845816933141
Energy: 0.6625639203913475
Energy: 0.6998473395524369
Energy: 0.6447491567057704
Energy: 0.6627553033051955
Energy: 0.6626079138862139
Energy: 0.6469975442323299
Energy: 0.6675570205210315
Energy: 0.6638511712885439
Energy: 0.6466443657980577
Energy: 0.6634799521874206
Energy: 0.6636896654023448
Energy: 0.6445772733982754
Energy: 0.8250517266645938
Energy: 0.6638921125033546
Energy: 0.6453730930540394
Energy: 0.664225176936776
Energy: 0.6447413065399272
Energy: 0.6453043601387913
Energy: 0.6634021891106242
Energy: 0.6446996755690567
Energy: 0.6449850684811779
Energy: 0.6454520404563647
Energy: 0.6470387550998419
Energy: 0.6451460828583979
Energy: 0.6446503281503013
Energy: 0.645551580681419
Energy: 0.8172694019449867
Energy: 0.6452811182349553
Energy: 0.6464299169678711
Energy: 0.6453834282175541
Energy: 0.6454639403476446
Energy: 0.6832206867522674
Energy: 0.8120027552365463
Energy: 0.6448171632377065
Energy: 0.6445595711382608
Energy: 0.8132576253723607
Energy: 0.6457309631394276
Energy: 0.6460479953374493
Energy: 0.8086387142681621
Energy: 0.7345700105292986
Energy: 0.6646083000289058
Energy: 0.6641338371590171
Energy: 0.6959586220909992
Energy: 0.6643978985441241
Energy: 0.6649698482036245
Energy: 0.6457569509385555
Energy: 0.6634280355691029
Energy: 0.6639610643437818
Energy: 0.6985921584272369
Energy: 0.6628419381919983
Energy: 0.6628874813731931
Energy: 0.7008034428716271
Energy: 0.8033094721127332
Energy: 0.6628138475043074
Energy: 0.7007838786208497
Energy: 0.8033614877113889
Energy: 0.6473455171095752
Energy: 0.7013351509235598
Energy: 0.7002857488086973
Energy: 0.6490706605348878
Energy: 0.700194992609699
Energy: 0.6747181439265356
Energy: 0.6638081391032206
Energy: 0.6977791240695135
Energy: 0.6977827148965139
Energy: 0.6640100637362866
Energy: 0.6981190941538166
Energy: 0.69898194372476
Energy: 0.6640249960203166
Energy: 0.6731665424669571
Energy: 0.7212652183915543
Energy: 0.700965017061195
Energy: 0.6447893889959387
Energy: 0.7550075748572661
Energy: 0.7567410515985523
Energy: 0.7186787229275554
Energy: 0.7211757675077886
Energy: 0.7567378144294465
Energy: 0.6749969192845579
Energy: 0.7547841232658512
Energy: 0.7165692329457294
Energy: 0.8312486037797109
Energy: 0.8319420099186997
Energy: 0.7165793311713385
Energy: 0.7529039154229216
Energy: 0.8320062815707838
Energy: 0.6682811985254443
Energy: 0.8200994615785537
Energy: 0.7816533174658622
Energy: 0.6712323444156133
Energy: 0.8201021648025997
Energy: 0.7118566539660054
Energy: 0.7515217077928679
Energy: 0.8282864636898138
Energy: 0.8308501551816798
Energy: 0.7515018211323526
Energy: 0.8202086417438318
Energy: 0.8295198883453614
Energy: 0.8207837649467747
Energy: 0.7105597729658312
Energy: 0.7720725195616501
Energy: 0.815930016925876
Energy: 0.666092568851996
Energy: 0.7713156695756351
Energy: 0.8856245376723064
Energy: 0.8361869058533219
Energy: 0.8685113264315446
Energy: 0.886508396205084
Energy: 0.710178240931786
Energy: 0.897520581599752
Energy: 0.7676415859683497
Energy: 0.8208603713061594
Energy: 0.8301982543725073
Energy: 0.767713264663205
Energy: 0.8257220782118069
Energy: 0.8449943408929792

minimum gb energy = 0.6417391909321608 eV
minimum distance =  2.26533212822576 Angstroms
sigma value = 67


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

Energy: 0.9367383149807861
Energy: 1.0782314102375534
Energy: 1.0025431630994446
Energy: 0.8141153403862913
Energy: 1.1663486200858486
Energy: 1.0380728668843706
Energy: 1.0597493366872195
Energy: 1.022317740967515
Energy: 1.0118765158667873
Energy: 1.0168003808128483
Energy: 1.0201878705976275
Energy: 1.019098811994395
Energy: 1.0342382203410092
Energy: 0.9220316216827597
Energy: 1.0154993353096111
Energy: 1.0164531361563427
Energy: 0.9238334986198249
Energy: 1.0152518669656068
Energy: 0.930508742105756
Energy: 1.0160105609754866
Energy: 1.0152372791178046
Energy: 0.9315011695215893
Energy: 0.9225461570794145
Energy: 1.0150294579184225
Energy: 0.9273315932370755
Energy: 1.0176775227443886
Energy: 1.0186678292060722
Energy: 0.9276098779630925
Energy: 1.0177258210950064
Energy: 1.019611889534747
Energy: 0.7911134085249779
Energy: 1.018117516713042
Energy: 0.924249374832235
Energy: 0.8440010174618975
Energy: 1.020581393844534
Energy: 0.9233191599343288
Energy: 0.9278281230127305
Energy: 0.9391257682111834
Energy: 0.9336215425605227
Energy: 0.9311138478242996
Energy: 0.8494737867601079
Energy: 0.9340446170140512
Energy: 0.9294936092043207
Energy: 0.8017478592782357
Energy: 0.828316745168001
Energy: 0.9294552034454566
Energy: 0.7963787910491565
Energy: 0.9330360043971709
Energy: 0.9782151288643963
Energy: 0.9767893418516749
Energy: 0.9361989782395377
Energy: 0.939081007324524
Energy: 0.8413181973488916
Energy: 0.9379186532001486
Energy: 0.7967973443811804
Energy: 0.8465408079964296
Energy: 0.8425249604252133
Energy: 0.7955913030860174
Energy: 0.8447372844589477
Energy: 0.8413467643097661
Energy: 0.7952083115768095
Energy: 0.8424488643458875
Energy: 0.8408304825376681
Energy: 0.7987411723632271
Energy: 0.9152708922605527
Energy: 0.8539422129089144
Energy: 0.797054804978369
Energy: 0.8419428223933438
Energy: 0.7955016019681835
Energy: 0.7969659840348932
Energy: 0.8454303196810135
Energy: 0.7946040848090635
Energy: 0.7971167802776525
Energy: 0.7929090963855506
Energy: 0.7948393337335653
Energy: 0.7972111364975485
Energy: 0.8006398556888696
Energy: 0.7944854416386967
Energy: 0.8828412676290334
Energy: 0.8314670144708405
Energy: 0.8349880551488774
Energy: 0.7980045436615395
Energy: 0.7946744454854858
Energy: 0.7989418906874245
Energy: 0.886794083123279
Energy: 0.8012451394304423
Energy: 0.7972604783577006
Energy: 0.8880048465055109
Energy: 0.798960216869568
Energy: 0.7967793647407103
Energy: 0.9611326444287005
Energy: 0.8864455899118157
Energy: 0.8567907456415366
Energy: 0.84389850389319
Energy: 0.7952248494423875
Energy: 0.8421075271061975
Energy: 0.8478827758977506
Energy: 0.7920128444436341
Energy: 0.8189090839007864
Energy: 0.8490489453833653
Energy: 0.7862489501981228
Energy: 0.8403281619448122
Energy: 0.8427347997499807
Energy: 0.9768850476719834
Energy: 0.9820096431345888
Energy: 0.8432316338228062
Energy: 0.937992348258667
Energy: 0.8411447289076864
Energy: 0.7844146895622125
Energy: 0.8470414235200391
Energy: 0.8744023034382922
Energy: 0.811716037768288
Energy: 0.9751323746678932
Energy: 0.8727195255356471
Energy: 0.8421057988814502
Energy: 0.9322206720953468
Energy: 0.9346518945536546
Energy: 0.8424850333125082
Energy: 0.9316974987631602
Energy: 0.9335900170580211
Energy: 0.9368026848866989
Energy: 0.9897355678552754
Energy: 0.9927998068349225
Energy: 0.9370279204742564
Energy: 0.9528934767865983
Energy: 0.9881986164245272
Energy: 1.0332372137801975
Energy: 0.8127366637477865
Energy: 0.9885353599974855
Energy: 1.0171649950673303
Energy: 0.8087009705160427
Energy: 0.9896264316569533
Energy: 0.9739841177295616
Energy: 0.9302136920986612
Energy: 0.9271023288443908
Energy: 0.9793718108695018
Energy: 0.9357653019960619
Energy: 1.0176417275188374

minimum gb energy = 0.7844146895622125 eV
minimum distance =  2.27980194562533 Angstroms
sigma value = 33


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

Energy: 1.0902741273005279
Energy: 1.127654143240327
Energy: 1.2006576154913888
Energy: 0.9314392910247072
Energy: 1.1272918952567272
Energy: 1.0749534041328381
Energy: 1.1158342684761593
Energy: 1.0863742977594986
Energy: 1.0880134303950866
Energy: 1.0915551896380677
Energy: 1.0914514702911438
Energy: 1.0553418521787252
Energy: 1.136010928476632
Energy: 0.9057087351033023
Energy: 1.0504257391955387
Energy: 1.0878529753991342
Energy: 0.9964870965700885
Energy: 1.0503379219897566
Energy: 1.0936528580692002
Energy: 1.049546757197274
Energy: 1.0509419265810718
Energy: 1.094022890504735
Energy: 1.0051420822388277
Energy: 1.0062164133416795
Energy: 0.9918221974161422
Energy: 1.0878057929055105
Energy: 1.0969887767790416
Energy: 0.9916301117222147
Energy: 1.0916857043234296
Energy: 1.0606643862834368
Energy: 0.9015159785530332
Energy: 1.0957153306023646
Energy: 0.9303298990087228
Energy: 0.9063289501517428
Energy: 1.0056873582295212
Energy: 0.9068847121885555
Energy: 0.9932199866656857
Energy: 1.0074260192910771
Energy: 1.0112689451126853
Energy: 0.9917516805548103
Energy: 1.0028857084937655
Energy: 1.0000306461620425
Energy: 0.9919204740137549
Energy: 0.9033877866440017
Energy: 0.905789373829344
Energy: 0.9915834186009678
Energy: 0.9105391076100288
Energy: 0.9911950168835418
Energy: 1.0566486213170636
Energy: 0.9971796077233954
Energy: 0.9999739885531244
Energy: 0.9990615671437836
Energy: 0.9049817634833214
Energy: 1.0351600700031003
Energy: 0.9844406247125843
Energy: 0.9061562993957729
Energy: 0.9051488079758362
Energy: 0.9159389552747966
Energy: 0.9055495748303398
Energy: 0.90438547946071
Energy: 0.9803357436661279
Energy: 0.9055734327383961
Energy: 0.9069793560897023
Energy: 0.9080713611944345
Energy: 0.9839350299479949
Energy: 0.9069587119325204
Energy: 0.9046188812810666
Energy: 0.9066399428815536
Energy: 0.9044128490873313
Energy: 0.9045844934600664
Energy: 0.9229085097080706
Energy: 0.9050855875898816
Energy: 0.9046616957686084
Energy: 1.0013698978153853
Energy: 0.9051885452268399
Energy: 0.9044188244433088
Energy: 0.9999058602328766
Energy: 0.9045861763682652
Energy: 0.8834628615028143
Energy: 1.002965658356816
Energy: 0.9097591011639725
Energy: 0.8826507430207493
Energy: 1.0338688551648951
Energy: 0.9296319696440334
Energy: 0.8795016831598859
Energy: 0.9906253023753371
Energy: 1.005660152029771
Energy: 0.878725235840077
Energy: 0.993116026307204
Energy: 0.9570051756360906
Energy: 1.0973480158283737
Energy: 1.059763769190482
Energy: 0.9899911982204574
Energy: 1.0984765928447637
Energy: 0.9240839401253884
Energy: 1.0985389679181654
Energy: 1.1810405718114745
Energy: 0.9234025140041071
Energy: 0.9237965057555908
Energy: 1.087949325522112
Energy: 0.9293691737518948
Energy: 0.9740809150529248
Energy: 1.1338373009416356
Energy: 0.9923371854383041
Energy: 1.0021284244605069
Energy: 1.0901081337408178
Energy: 0.9953295644160138
Energy: 1.0801876300764275
Energy: 0.9187173821460073
Energy: 1.0035376652982742
Energy: 1.1156290357687924
Energy: 0.9193545509703811
Energy: 1.0894510999134381
Energy: 0.9661603782240901
Energy: 1.0492935920884745
Energy: 1.0894042796726497
Energy: 1.0881860914049755
Energy: 1.0500627703441114
Energy: 1.09154724420332
Energy: 1.0565658044697033
Energy: 1.1399408306725398
Energy: 1.050500454197576
Energy: 1.0498229349457862
Energy: 1.0895792314711645
Energy: 1.0106386701841992
Energy: 1.0502659626479478
Energy: 1.0900206895506765
Energy: 0.9845224565225524
Energy: 1.050148275763555
Energy: 1.0895655761685372
Energy: 0.9974591199166444
Energy: 1.0071188393291537
Energy: 0.9913182682672266
Energy: 1.0866947866218324
Energy: 1.0959645807584932
Energy: 0.9914816028922767
Energy: 1.0914869392994226
Energy: 1.0574538248567837
Energy: 0.8982155240289132
Energy: 1.1560390315078566
Energy: 0.9985606299584903
Energy: 0.8996523098692503
Energy: 1.139006475217038
Energy: 1.0140827793151885
Energy: 0.9925299322890301
Energy: 1.1100399867392492
Energy: 1.009171569925366
Energy: 0.9910762518356409
Energy: 1.0952149863089364
Energy: 1.001678139448272
Energy: 0.9959779595837891
Energy: 0.9033144196300101
Energy: 0.9060884206976113
Energy: 0.9918318285521927
Energy: 0.9091730047698183
Energy: 0.9082928806962278
Energy: 1.057853545550829
Energy: 0.9047221148234552
Energy: 0.9053608971994712
Energy: 0.9181375287349658
Energy: 0.9289501921123446
Energy: 0.9047030918724263
Energy: 1.0608450628462187
Energy: 0.9064072989011412
Energy: 0.9053280499494116
Energy: 0.9998422255679417
Energy: 0.9064562398738195
Energy: 0.9045644865982695
Energy: 0.9790552335350404
Energy: 0.9076147256103383
Energy: 0.9408417480449373
Energy: 0.9102312563064732
Energy: 0.905361751873605
Energy: 0.912297618954032
Energy: 0.9042781381345425
Energy: 0.9071815622033179
Energy: 0.9047628603131963
Energy: 0.904287272695647
Energy: 0.9312641745468961
Energy: 0.9047479631220414
Energy: 0.9078836037422849
Energy: 0.9708195102397947
Energy: 0.9048536279921228
Energy: 0.9068653963486694
Energy: 0.9994444315011328
Energy: 0.9049958703273141
Energy: 0.8790335110037735
Energy: 1.0032194259611813
Energy: 0.9114818444888987
Energy: 0.8820567445385159
Energy: 1.0005266783063849
Energy: 0.8792964406388593
Energy: 0.8782009936602062
Energy: 0.9920158665904428
Energy: 0.9918116595867769
Energy: 0.9449778349621694
Energy: 0.9933543773714634
Energy: 0.9557799217311249
Energy: 0.9945408182575538
Energy: 0.9258247336775144
Energy: 1.0763351527989256
Energy: 0.9975266858392381
Energy: 0.9236428819956756
Energy: 1.0083337968322441
Energy: 1.1810747023393395
Energy: 0.923182008565531
Energy: 0.9241337335276567
Energy: 1.090076812630722
Energy: 0.8832165022138491
Energy: 0.9722371038214945
Energy: 1.13466726573245
Energy: 0.990794697677155
Energy: 1.0796546058866856
Energy: 1.0927343710315718
Energy: 0.9909534327574249
Energy: 1.0794216130749792
Energy: 0.9176067884176553
Energy: 1.087987884080767
Energy: 1.0247867467206808
Energy: 0.9257935163777717
Energy: 1.08781152542952
Energy: 0.9303405559634641

minimum gb energy = 0.8782009936602062 eV
minimum distance =  2.27226103235116 Angstroms
sigma value = 41


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

Energy: 1.3938770438426424
Energy: 1.096051349390253
Energy: 1.2993419212580084
Energy: 1.0363062475296643
Energy: 1.1431086567173674
Energy: 1.0421409719294248
Energy: 1.2506749145798353
Energy: 1.1756012562285416
Energy: 1.1437303943385075
Energy: 1.0933409474504394
Energy: 1.1666350848662395
Energy: 1.1397170294453658
Energy: 1.2494154500376025
Energy: 1.0468766870373434
Energy: 1.0423352368210432
Energy: 1.094156676159235
Energy: 1.0810193820549259
Energy: 1.1349670366884796
Energy: 1.1695616876872286
Energy: 1.045290135283997
Energy: 1.0429635500850292
Energy: 1.1844035182960138
Energy: 1.1381149635882408
Energy: 1.0483338380560345
Energy: 1.073404546358939
Energy: 1.1776697906204907
Energy: 1.0722768907254052
Energy: 1.0737275078004898
Energy: 1.167989689741736
Energy: 1.0496381927629423
Energy: 1.105246190812345
Energy: 1.0529406330706155
Energy: 1.0489514520366372
Energy: 1.0496798375487977
Energy: 1.2072070243891821
Energy: 1.0486372893980371
Energy: 1.072433475428099
Energy: 1.1409680529069308
Energy: 1.0520336142345614
Energy: 1.0725746566635328
Energy: 1.1401581630229818
Energy: 1.05287447695052
Energy: 1.0771075986475607
Energy: 1.0491567769394614
Energy: 1.048553439946016
Energy: 1.0785569113621083
Energy: 1.0580347000513517
Energy: 1.0737076793245373
Energy: 1.1610119944022304
Energy: 1.0487171501423316
Energy: 1.0469336016291713
Energy: 1.0224290380233745
Energy: 1.073039772687025
Energy: 1.0477459022358402
Energy: 1.114675327145774
Energy: 1.0811636685350097
Energy: 1.0519301416668458
Energy: 1.0493627075671244
Energy: 1.075394007344571
Energy: 1.0474471819385682
Energy: 1.1836960423045242
Energy: 1.0532807576943362
Energy: 1.0678951974624575
Energy: 1.1404843869220855
Energy: 1.022616415072743
Energy: 1.1415220504295271
Energy: 1.2021279648170828
Energy: 1.0216477263424255
Energy: 1.0215295389681502
Energy: 1.2013474576391512
Energy: 1.021306738474114
Energy: 1.0977166882433556
Energy: 1.257483498777496
Energy: 1.050537021096891
Energy: 1.0693143618928846
Energy: 1.1675717317497412
Energy: 1.1693341838331701
Energy: 1.1421557946198868
Energy: 1.0202030764706254
Energy: 1.0767637405721269
Energy: 1.022797660301804
Energy: 1.0253188330014535
Energy: 1.1676874085508095
Energy: 1.0229037491327413

minimum gb energy = 1.0202030764706254 eV
minimum distance =  2.28497802397708 Angstroms
sigma value = 11


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

Energy: 1.7433455921424095
Energy: 1.265106302855968
Energy: 1.2450858531317168
Energy: 1.2538678502967135
Energy: 1.3235995583730236
Energy: 1.2547987756754613
Energy: 1.2672290936921866
Energy: 1.197738127474035
Energy: 1.2240710519045674
Energy: 1.2378258912663265
Energy: 1.1969299673258296
Energy: 1.2143413025919805
Energy: 1.2643035531310445
Energy: 1.182150640682835
Energy: 1.2112923290426238
Energy: 1.2203836493643259
Energy: 1.2084788824564405
Energy: 1.2143353602396427
Energy: 1.2377460482973788
Energy: 1.1838549442165176
Energy: 1.1877541699142968
Energy: 1.212123363414661
Energy: 1.1963382494113513
Energy: 1.2111030918412937
Energy: 1.2378019562713805
Energy: 1.197754417935454
Energy: 1.2068341981698039
Energy: 1.2293793430365605
Energy: 1.1997346844983983
Energy: 1.2204836116700668
Energy: 1.236626048531657
Energy: 1.2191276644830886
Energy: 1.2424506252386331
Energy: 1.2184984369914493
Energy: 1.2140302720182778
Energy: 1.227850891165368
Energy: 1.2135837922746204
Energy: 1.2285350196402096
Energy: 1.2496109695685
Energy: 1.2137278406192222
Energy: 1.2363269904063008
Energy: 1.2016052215195574
Energy: 1.2123566917387287
Energy: 1.221897642983914
Energy: 1.2206596013301216
Energy: 1.1976796716784395
Energy: 1.2436623589637408
Energy: 1.2221861647203216
Energy: 1.2144310156738316
Energy: 1.2171520229301511
Energy: 1.2186879326809799
Energy: 1.224708913992265
Energy: 1.216164068099486
Energy: 1.1894676744013128
Energy: 1.2140311365544043
Energy: 1.2165836693430294
Energy: 1.2187364006447143
Energy: 1.176026284511319
Energy: 1.2171244352321038
Energy: 1.1892272062558669
Energy: 1.212458736659527
Energy: 1.232620526388447
Energy: 1.2214914378259971
Energy: 1.1976959178039017
Energy: 1.213533805990673
Energy: 1.2221891805547191
Energy: 1.2010107911252548
Energy: 1.189944556904106
Energy: 1.1893702960242223
Energy: 1.201545495223067
Energy: 1.2069835592248197
Energy: 1.198059058256815
Energy: 1.1964862863896486
Energy: 1.2101888011781623
Energy: 1.2113448649726701
Energy: 1.1972094350846998
Energy: 1.2112597038471848
Energy: 1.211940985425017
Energy: 1.2098865983602929
Energy: 1.2273038615711593
Energy: 1.2203690368431912
Energy: 1.2174802996022769
Energy: 1.2905725729692978
Energy: 1.2124463027417904
Energy: 1.186198724299373
Energy: 1.2103862828254948
Energy: 1.2090734489825918
Energy: 1.1991123223518352
Energy: 1.2118265601564
Energy: 1.2112351047659684
Energy: 1.1863811582085257
Energy: 1.2120537280571342
Energy: 1.2105531540293084
Energy: 1.1881676773803185
Energy: 1.2100626597060773
Energy: 1.186526536499512
Energy: 1.1851729884198756
Energy: 1.2123891997994476
Energy: 1.2113742460443557
Energy: 1.186139240434955
Energy: 1.206162311239179
Energy: 1.2121251497316121
Energy: 1.4044048850106792
Energy: 1.261096238642178
Energy: 1.2528071063019173
Energy: 1.2116211892474513
Energy: 1.2863737636654056
Energy: 1.224305833465218
Energy: 1.20958291605509
Energy: 1.2051906482021004
Energy: 1.2133612033593737
Energy: 1.2114808771818992
Energy: 1.2045698869335606
Energy: 1.2113522806575223
Energy: 1.2308276552166075
Energy: 1.1845264475725914
Energy: 1.1851330925491086
Energy: 1.209969934766853
Energy: 1.1840828405823574
Energy: 1.2206013443476076
Energy: 1.283537927691676
Energy: 1.1841530282123864
Energy: 1.2065365391626743
Energy: 1.206080295988256
Energy: 1.1845019994470798
Energy: 1.209901790516368
Energy: 1.208803037639153
Energy: 1.2072517934176672
Energy: 1.2137689840609367
Energy: 1.2123537607217274
Energy: 1.2058354756790077
Energy: 1.2108301877003864
Energy: 1.2262727696222453
Energy: 1.2158965070532057
Energy: 1.2021296747261547
Energy: 1.2060068878763042
Energy: 1.2114709523993696
Energy: 1.18142279226258
Energy: 1.2844931124340886
Energy: 1.2116783239925812
Energy: 1.2107538053770284
Energy: 1.2128425993806264
Energy: 1.211366117447776
Energy: 1.2131604398227251
Energy: 1.2823296680258203
Energy: 1.2199430425666995
Energy: 1.224756580593031
Energy: 1.2840664118922571
Energy: 1.2047688170733455
Energy: 1.2104826234603807
Energy: 1.2784924032531044
Energy: 1.235720464008601
Energy: 1.2119642488257143
Energy: 1.2155626387065392
Energy: 1.1856117082867124
Energy: 1.2109101931488073
Energy: 1.276069667258257
Energy: 1.1852068588378792
Energy: 1.186086319212782
Energy: 1.2101886017468018
Energy: 1.1885478455170677
Energy: 1.2137908290893402
Energy: 1.2672240806684063
Energy: 1.2126210264322117
Energy: 1.2129116092132068
Energy: 1.213720132316265
Energy: 1.20023268982775
Energy: 1.2098821161085214
Energy: 1.2927081876727469
Energy: 1.2259607491158546
Energy: 1.2251176068682794
Energy: 1.2101198095496406
Energy: 1.1922192298258216
Energy: 1.219248968018326
Energy: 1.2635302694618609
Energy: 1.2201383415917664
Energy: 1.210936690926849
Energy: 1.2365443200662911
Energy: 1.197193041598309
Energy: 1.2117377259209297
Energy: 1.1827705771719743
Energy: 1.207027366180261
Energy: 1.20025316797357
Energy: 1.1833581515096432
Energy: 1.1999429276567017
Energy: 1.2006195497852354

minimum gb energy = 1.176026284511319 eV
minimum distance =  2.29083563190474 Angstroms
sigma value = 57


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

Energy: 1.5645303316687542
Energy: 1.7241215748276724
Energy: 1.3392617205214934
Energy: 1.3700192166939749
Energy: 5.2538004769976085
Energy: 1.3373611019531222
Energy: 1.280476428635376
Energy: 1.2155893094074586
Energy: 1.2250340734713092
Energy: 1.2109012793598042
Energy: 1.2154898272107078
Energy: 1.2226766044690314
Energy: 1.2865627040272485
Energy: 1.2112926957235433
Energy: 1.212873952718171
Energy: 1.2867281117938691
Energy: 1.2058539619413013
Energy: 1.220826071192321
Energy: 1.2062308670994146
Energy: 1.2147899665467146
Energy: 1.2227199832527271
Energy: 1.21129742556212
Energy: 1.2095312206739104
Energy: 1.2230593596501491
Energy: 1.2059760646209716
Energy: 1.2142792290252113
Energy: 1.2230126257826162
Energy: 1.2129101235643616
Energy: 1.2115285614491569
Energy: 1.2233991050588284
Energy: 1.208501879113358
Energy: 1.211648005177111
Energy: 1.2260030955132497
Energy: 1.215474340940485
Energy: 1.2168239168004824
Energy: 1.2236954073004913
Energy: 1.2802843235434007
Energy: 1.2109311709801511
Energy: 1.219346004610139
Energy: 1.2808075134370727
Energy: 1.2067173571946062
Energy: 1.2144867252030263
Energy: 1.279707049464154
Energy: 1.220000026465943
Energy: 1.2237857974866566
Energy: 1.2139301458761413
Energy: 1.206619209762778
Energy: 1.224356674350728
Energy: 1.2584471510922648
Energy: 1.2155739791323525
Energy: 1.2105223897131723
Energy: 1.1909383708107817
Energy: 1.2115201596388387
Energy: 1.211721171273236
Energy: 1.258744391504562
Energy: 1.2146601979275622
Energy: 1.2102379589613002
Energy: 1.1906634491126906
Energy: 1.209924915580328
Energy: 1.2115827179139413
Energy: 1.2796099426413472
Energy: 1.217737927983487
Energy: 1.2246739672104088
Energy: 1.214704225195917
Energy: 1.2088292466328732
Energy: 1.2241597047656338
Energy: 1.267186675597355
Energy: 1.2102083129550352
Energy: 1.2227088782453353
Energy: 1.2669168171459457
Energy: 1.2060421051019194
Energy: 1.2139010204670464
Energy: 1.2198026423190007
Energy: 1.2160021623644819
Energy: 1.2259658342692135
Energy: 1.2118023089175263
Energy: 1.2137987627249789
Energy: 1.2213758091055966
Energy: 1.2090542223594316
Energy: 1.2880493463801683
Energy: 1.2119092395603595
Energy: 1.2158401249268316
Energy: 1.2815056250740928
Energy: 1.2228241239490611
Energy: 1.2062037665955205
Energy: 1.2078131613261374
Energy: 1.2223388888487026
Energy: 1.2124720407734446
Energy: 1.2083140325443245
Energy: 1.2215796692941157
Energy: 1.2875892057392955
Energy: 1.208308125052458
Energy: 1.2086531797064255
Energy: 1.2877955337941243
Energy: 1.2091699326518786
Energy: 1.2250279010373213
Energy: 1.1890864352440664
Energy: 1.215397986058709
Energy: 1.2245981150769008
Energy: 1.1923082745125688
Energy: 1.213387663423358
Energy: 1.2227834897462755

minimum gb energy = 1.1890864352440664 eV
minimum distance =  2.30818537242727 Angstroms
sigma value = 9


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

Energy: 1.9207920782294094
Energy: 1.2696982978535052
Energy: 1.2838572850111138
Energy: 1.2822948646086991
Energy: 1.3479051257067032
Energy: 1.2837329179896861
Energy: 1.3134154422679993
Energy: 1.285557976359271
Energy: 1.2856594223701159
Energy: 1.2933486480044272
Energy: 1.2805889366118837
Energy: 1.285492985393109
Energy: 1.3134963010246583
Energy: 1.2836705895993397
Energy: 1.2844698337508347
Energy: 1.2706937603933162
Energy: 1.287862255667901
Energy: 1.2843095565208626
Energy: 1.290696684150173
Energy: 1.288032486952792
Energy: 1.2848980273367148
Energy: 1.2861348402544934
Energy: 1.292954295444909
Energy: 1.2836372187952187
Energy: 1.2943664741876932
Energy: 1.2748956151370323
Energy: 1.276265723058673
Energy: 1.2913861543645129
Energy: 1.2736583227875278
Energy: 1.2767457410965166
Energy: 1.2786773404731284
Energy: 1.2768379583060099
Energy: 1.2747677777520248
Energy: 1.2809376115404445
Energy: 1.2805785468278184
Energy: 1.2742968138924342
Energy: 1.287513836466615
Energy: 1.2643723132833289
Energy: 1.2869278657116074
Energy: 1.2698913470682867
Energy: 1.2657532300997993
Energy: 1.2896593952766053
Energy: 1.3307026399282678
Energy: 1.285958843743955
Energy: 1.2765725098765885
Energy: 1.2848276282331201
Energy: 1.2702452229565162
Energy: 1.2737847069429218
Energy: 1.4535500267319041
Energy: 1.2676308563365275
Energy: 1.2686742632976473
Energy: 1.2907925739181942
Energy: 1.2694138198770522
Energy: 1.2800737097319015
Energy: 1.44042122998041
Energy: 1.2679479521141643
Energy: 1.268676791837342
Energy: 1.2930133667645192
Energy: 1.2684912494582827
Energy: 1.2705700057806828
Energy: 1.3298986970244455
Energy: 1.2761831512164967
Energy: 1.2724614818029483
Energy: 1.2832862483634109
Energy: 1.282084046106086
Energy: 1.2703668696671635
Energy: 1.3305260554182374
Energy: 1.288546417407312
Energy: 1.2873915677379788
Energy: 1.2736627234815392
Energy: 1.292104750723834
Energy: 1.2836341419502202
Energy: 1.4667621075228972
Energy: 1.285220536329927
Energy: 1.2852229747710042
Energy: 1.2751076338154832
Energy: 1.289521640950619
Energy: 1.271625991479577
Energy: 1.3451920782574205
Energy: 1.2861051846064808
Energy: 1.284131243428979
Energy: 1.288098579108876
Energy: 1.289979566026319
Energy: 1.2842487942837033
Energy: 1.3306970480463134
Energy: 1.2736348562088902
Energy: 1.2694951212467782
Energy: 1.2729191151347279
Energy: 1.2795158462266358
Energy: 1.2765601257119379
Energy: 1.3118711134950902
Energy: 1.2818019776877991
Energy: 1.268680102660878
Energy: 1.2719750147794289
Energy: 1.2871190563843895
Energy: 1.2659306134822321
Energy: 1.3148997968591265
Energy: 1.2892327131848702
Energy: 1.2855686161578754
Energy: 1.2925656806397046
Energy: 1.2917689698567123
Energy: 1.2840814944514782
Energy: 1.382124544945628
Energy: 1.2768187834492777
Energy: 1.2764025597014619
Energy: 1.2885710214351445
Energy: 1.276210220533763
Energy: 1.290300633048966
Energy: 1.3141710176947472
Energy: 1.2905050892183894
Energy: 1.2866353866494349
Energy: 1.2766952133817828
Energy: 1.2836409509657454
Energy: 1.2844465900019422
Energy: 1.312921840241434
Energy: 1.2893948210654
Energy: 1.285337396405057
Energy: 1.2690895698482005
Energy: 1.2947160350276385
Energy: 1.282883766193955
Energy: 1.308783262589882
Energy: 1.275310740163042
Energy: 1.2844456841436058
Energy: 1.2955128265251175
Energy: 1.2755723864419226
Energy: 1.2862957644121025

minimum gb energy = 1.2643723132833289 eV
minimum distance =  2.25077251751495 Angstroms
sigma value = 27


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

Energy: 1.1615849473159023
Energy: 1.323416981532495
Energy: 1.1988913453344803
Energy: 1.1646345762633787
Energy: 6.609013619924443
Energy: 1.1936720347047283
Energy: 1.313852846453044
Energy: 1.2177024316091094
Energy: 1.2178399974790197
Energy: 1.215121011935566
Energy: 1.2160374565651009
Energy: 1.2161911772837737
Energy: 1.2367223201709743
Energy: 1.2084123247497314
Energy: 1.213610555645071
Energy: 1.212371333518278
Energy: 1.171580844230972
Energy: 1.2143329568556032
Energy: 1.252522804621134
Energy: 1.212773256705262
Energy: 1.2158907201746356
Energy: 1.2112353406277907
Energy: 1.210564605203914
Energy: 1.219045898853241
Energy: 1.1955049956565211
Energy: 1.219314456116601
Energy: 1.2136317546573419
Energy: 1.2013027069462203
Energy: 1.209771119273511
Energy: 1.2079980674814756
Energy: 1.218206515782507
Energy: 1.2178982065821522
Energy: 1.2142454734687063
Energy: 1.214210161475097
Energy: 1.2228424257362367
Energy: 1.2115799287153703
Energy: 1.26100688678352
Energy: 1.1840771116119273
Energy: 1.1904032572338052
Energy: 1.2080379553636176
Energy: 1.1710534768550214
Energy: 1.197326187337558
Energy: 1.2701290656359787
Energy: 1.220183655578799
Energy: 1.2173744560093354
Energy: 1.235942341363626
Energy: 1.223952479312496
Energy: 1.2186723848389458
Energy: 1.352784100593445
Energy: 1.2111667158900377
Energy: 1.2145009637186164
Energy: 1.196958178150309
Energy: 1.211822554618621
Energy: 1.2121413034841286
Energy: 1.3519289549423508
Energy: 1.2128090348087455
Energy: 1.2170366654261313
Energy: 1.197763911604541
Energy: 1.2099108465594428
Energy: 1.2141591331780628
Energy: 1.2763673321336968
Energy: 1.2126360091195432
Energy: 1.2128936626582352
Energy: 1.2359712909753
Energy: 1.206850329775077
Energy: 1.2149250716304174
Energy: 1.2711346073003214
Energy: 1.2126987702974417
Energy: 1.212874849255429
Energy: 1.2358458965243229
Energy: 1.207316390278229
Energy: 1.2140659862366114
Energy: 1.174646844992476
Energy: 1.2185945074383973
Energy: 1.1972408417832088
Energy: 1.164403900721624
Energy: 1.2268545318681503
Energy: 1.1961847188462094
Energy: 1.1642656244796799
Energy: 1.2215436435681413
Energy: 1.2168282951523166
Energy: 1.1809453662470548
Energy: 1.2329828890813637
Energy: 1.2125331452355832
Energy: 1.238348507967267
Energy: 1.2085506562330697
Energy: 1.21340925622144
Energy: 1.2086272411112082
Energy: 1.2000008948899108
Energy: 1.2173095383189287
Energy: 1.220350005768657
Energy: 1.20933278245367
Energy: 1.2107614320274063
Energy: 1.2136591473615554
Energy: 1.1997460394146306
Energy: 1.2115628231926159
Energy: 1.1978253938279886
Energy: 1.2245285082878172
Energy: 1.219215430395312
Energy: 1.204692131998782
Energy: 1.2099822948370986
Energy: 1.2169592896498729
Energy: 1.1786072936101706
Energy: 1.2230821240431893
Energy: 1.2165087090932465
Energy: 1.202972931085903
Energy: 1.2096339839264445
Energy: 1.2134776266730392
Energy: 1.2509218778692557
Energy: 1.1873211301504332
Energy: 1.201990481769821
Energy: 1.240099938569978
Energy: 1.1757014388225653
Energy: 1.2056604805081528
Energy: 1.2711254900195925
Energy: 1.1878099903080805
Energy: 1.2028119597341704
Energy: 1.213193259504559
Energy: 1.1773776171828207
Energy: 1.2062600404103845
Energy: 1.3540400092707237
Energy: 1.2129990923065577
Energy: 1.221134223286581
Energy: 1.1973935808120562
Energy: 1.233479328741385
Energy: 1.2179313798516538
Energy: 1.1683163887959593
Energy: 1.2161382603777404
Energy: 1.2150277566873982
Energy: 1.1824787601888633
Energy: 1.210422575778206
Energy: 1.2139895211247114
Energy: 1.2710474234473967
Energy: 1.2163377497370127
Energy: 1.2156366322928838
Energy: 1.2135627521984622
Energy: 1.2147533067480307
Energy: 1.2161626802816485
Energy: 1.2726953576459241
Energy: 1.199512314471152
Energy: 1.2070052901134287
Energy: 1.2099725676172874
Energy: 1.1978061781767988
Energy: 1.2113261654583987
Energy: 1.1640793014880264
Energy: 1.2219249364336886
Energy: 1.2166144220129145
Energy: 1.179900172979404
Energy: 1.2320210317134959
Energy: 1.2119025173467826

minimum gb energy = 1.1615849473159023 eV
minimum distance =  2.27271398374466 Angstroms
sigma value = 19


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

Energy: 1.3010026698986488
Energy: 1.2139088255484785
Energy: 1.285152256581352
Energy: 1.2282656464420092
Energy: 1.2122490948010542
Energy: 1.1962722407846262
Energy: 1.345538179443528
Energy: 1.2133563603802293
Energy: 1.2154573730339346
Energy: 1.2138312608339819
Energy: 1.213599610552631
Energy: 1.2175611435371194
Energy: 1.3082817016930355
Energy: 1.2173379238029207
Energy: 1.2252896760069072
Energy: 1.2251809667816163
Energy: 1.2090704931078278
Energy: 1.2303544555516672
Energy: 1.2963143510341517
Energy: 1.219359426197669
Energy: 1.2383106584575179
Energy: 1.2399354953405086
Energy: 1.2196932478275604
Energy: 1.2442624586885267
Energy: 1.2164830893974963
Energy: 1.2242554883753312
Energy: 1.2232110222790855
Energy: 1.2227597554432383
Energy: 1.2438977970882668
Energy: 1.2275668436035625
Energy: 1.216174569502881
Energy: 1.2205440084797536
Energy: 1.2209083077097782
Energy: 1.2125889013168947
Energy: 1.2198500513402228
Energy: 1.2443522907208135
Energy: 1.2588275358437484
Energy: 1.2129188165985871
Energy: 1.2154347047124006
Energy: 1.2474258804162486
Energy: 1.210854017462012
Energy: 1.2092683264578057
Energy: 1.1980706391165297
Energy: 1.219208536498139
Energy: 1.2168529660521752
Energy: 1.2076864971990204
Energy: 1.2124566687278278
Energy: 1.2190211247099325
Energy: 1.198065022740776
Energy: 1.223128981994422
Energy: 1.2188745776530958
Energy: 1.2124164327866884
Energy: 1.243147339706004
Energy: 1.227491244388251
Energy: 1.1977805075125079
Energy: 1.2324617020795305
Energy: 1.2332336805378292
Energy: 1.2103006799154397
Energy: 1.2342915394557659
Energy: 1.2312085552989904
Energy: 1.2979965131830518
Energy: 1.1995304147328303
Energy: 1.206630850723655
Energy: 1.231110790674273
Energy: 1.1784842250143517
Energy: 1.2011299327294536
Energy: 1.2961121266417173
Energy: 1.193296094641813
Energy: 1.1960795073199666
Energy: 1.1735396525375006
Energy: 1.210794766139929
Energy: 1.232113478460859
Energy: 1.2496071720419029
Energy: 1.2402443252917315
Energy: 1.2323152758037392
Energy: 1.1992756886877918
Energy: 1.2185608855152037
Energy: 1.2277628421780973
Energy: 1.3110604544316895
Energy: 1.2082223045553995
Energy: 1.2230109193260486
Energy: 1.1877493428185368
Energy: 1.205678973978052
Energy: 1.2280670873853956
Energy: 1.2957889138062815
Energy: 1.1863186345706491
Energy: 1.2062979526542812
Energy: 1.2262198409150673
Energy: 1.176555254480151
Energy: 1.184527130798153
Energy: 1.315349552973866
Energy: 1.2037556611518436
Energy: 1.209141579182487
Energy: 1.199745524196594
Energy: 1.1865143033083556
Energy: 1.213116872950195
Energy: 1.2204358549698657
Energy: 1.2703708026764218
Energy: 1.2492856919134652
Energy: 1.174208502806084
Energy: 1.2431366355610372
Energy: 1.242172086760922
Energy: 1.2747493513268666
Energy: 1.2009381347314179
Energy: 1.2022224268288195
Energy: 1.172294828744929
Energy: 1.201126732863511
Energy: 1.2093148586758167
Energy: 1.288378411696693
Energy: 1.1709242986338861
Energy: 1.1699942923415696
Energy: 1.2216253935814816
Energy: 1.1700025236979101
Energy: 1.2388145665589905
Energy: 1.1715193488439362
Energy: 1.1712812131065533
Energy: 1.1703936872672962
Energy: 1.223715714860049
Energy: 1.1706409039735188
Energy: 1.2371414290965712
Energy: 1.181286619158499
Energy: 1.2111961362074704
Energy: 1.2111712542593303
Energy: 1.1803181196202233
Energy: 1.2126051959121764
Energy: 1.206071566654732
Energy: 1.1735306389499849
Energy: 1.1835343752475624
Energy: 1.1890907314822698
Energy: 1.1709595170699763
Energy: 1.1869023039739868
Energy: 1.1936320378662917
Energy: 1.171511673243401
Energy: 1.1923978822329755
Energy: 1.2006645072215771
Energy: 1.1890636988645975
Energy: 1.1610920622466263
Energy: 1.2075744612234367
Energy: 1.2344961728254125
Energy: 1.1953210094368485
Energy: 1.2048889782968875
Energy: 1.2055320638138955
Energy: 1.163078718537503
Energy: 1.2109188579300982
Energy: 1.2542668659928313
Energy: 1.1850742100235097
Energy: 1.1876308512780986
Energy: 1.174776505475151
Energy: 1.1855845683707276
Energy: 1.190208156231495
Energy: 1.2190906284778946
Energy: 1.2437443738543774
Energy: 1.2200088175934567
Energy: 1.20190923233527
Energy: 1.252199076698601
Energy: 1.2132468410125503
Energy: 1.3054090932988311
Energy: 1.2206138273510734
Energy: 1.2227867949925024
Energy: 1.2215547573867112
Energy: 1.2153384823449018
Energy: 1.2277533689497033
Energy: 1.307270169852295
Energy: 1.2161627713688563
Energy: 1.2168281258140383
Energy: 1.2168454086917666
Energy: 1.213110167387863
Energy: 1.2197940950792296
Energy: 1.2737875852400031
Energy: 1.214327394774865
Energy: 1.2427071768928446
Energy: 1.1596286620047367
Energy: 1.1987734416706712
Energy: 1.1744154266969504

minimum gb energy = 1.1596286620047367 eV
minimum distance =  2.22877944215717 Angstroms
sigma value = 101


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

Energy: 1.7574251032297403
Energy: 1.1516868028655705
Energy: 1.1789457567462436
Energy: 1.1077308968692898
Energy: 1.1542215803085094
Energy: 1.108829280855671
Energy: 1.3770363581396727
Energy: 1.165090365861004
Energy: 1.1461492111455103
Energy: 1.1479526188268323
Energy: 1.1543041144387798
Energy: 1.149234895439344
Energy: 1.2870658595407467
Energy: 1.1496266829278905
Energy: 1.1499469733265957
Energy: 1.205409952186746
Energy: 1.1463858934139635
Energy: 1.1487636167103885
Energy: 1.2394835554751784
Energy: 1.1488449071288331
Energy: 1.1701667998833332
Energy: 1.1727927001196798
Energy: 1.1491691923904477
Energy: 1.1730604004509584
Energy: 1.1566427822415821
Energy: 1.2009841149054792
Energy: 1.1979236246727882
Energy: 1.159950880960873
Energy: 1.2035377230333064
Energy: 1.1852721066792467
Energy: 1.1703748967612264
Energy: 1.146899205424422
Energy: 1.1728715294184222
Energy: 1.1366187273942183
Energy: 1.1481035835504179
Energy: 1.1621905543078481
Energy: 1.244712181943667
Energy: 1.1445558888147842
Energy: 1.141830453990137
Energy: 1.1943610671272162
Energy: 1.1402438223467233
Energy: 1.1425821137648036
Energy: 1.1352056155038763
Energy: 1.1495982309449853
Energy: 1.1507534813353169
Energy: 1.1850894146187567
Energy: 1.144400716479334
Energy: 1.1506843467766006
Energy: 1.1373377607216941
Energy: 1.1914076336488042
Energy: 1.1488863134695355
Energy: 1.1396729570261233
Energy: 1.1968501915381897
Energy: 1.1493210001293725
Energy: 1.135791486600601
Energy: 1.1971107105734808
Energy: 1.194164929637966
Energy: 1.1474883085920564
Energy: 1.1903816605391362
Energy: 1.1462573246247114
Energy: 1.2739871794439885
Energy: 1.1043604636978772
Energy: 1.1049133011037247
Energy: 1.199907215878229
Energy: 1.1100529584978533
Energy: 1.1063226518524552
Energy: 1.256650896268983
Energy: 1.155091504218028
Energy: 1.1469316702470773
Energy: 1.1473232747272155
Energy: 1.1471029690247032
Energy: 1.145922911897423
Energy: 1.171458407144038
Energy: 1.1951118708567414
Energy: 1.191335159998401
Energy: 1.1327080517910806
Energy: 1.1966492937231463
Energy: 1.1464587516222364
Energy: 1.1715983991773002
Energy: 1.1685101896182226
Energy: 1.1440288282393685
Energy: 1.145969718648702
Energy: 1.1561168788743168
Energy: 1.1501622304675707
Energy: 1.2869415756984837
Energy: 1.1562623752018284
Energy: 1.164065960068766
Energy: 1.2027660656951868
Energy: 1.1468382576801852
Energy: 1.1519704611040154
Energy: 1.2863392001241976
Energy: 1.1566243554074425
Energy: 1.1730180720276804
Energy: 1.1719750269023093
Energy: 1.15257303108321
Energy: 1.1821039888813007
Energy: 1.1803563836083755
Energy: 1.2387672455226952
Energy: 1.1893732115829339
Energy: 1.1048604883467965
Energy: 1.1504043242319126
Energy: 1.10174810558049
Energy: 1.311553356184364
Energy: 1.1471187903547362
Energy: 1.1467239159785898
Energy: 1.1806727924811826
Energy: 1.1554535798619927
Energy: 1.1856262288504662
Energy: 1.2863613593036376
Energy: 1.147683312911725
Energy: 1.1496388099138428
Energy: 1.1940436169385946
Energy: 1.14823584911315
Energy: 1.150402637013267
Energy: 1.2550836581228237
Energy: 1.1483253999357106
Energy: 1.1502044489555072
Energy: 1.1456182657302556
Energy: 1.146609669560364
Energy: 1.1503781238324857
Energy: 1.159977773072387
Energy: 1.1950149541583228
Energy: 1.1908916702201982
Energy: 1.1595498509239364
Energy: 1.1960598071250466
Energy: 1.1816553236395386
Energy: 1.171732459404823
Energy: 1.1708603275082474
Energy: 1.168046837936325
Energy: 1.152234204248629
Energy: 1.171390868695948
Energy: 1.1471307287340144
Energy: 1.1712118544512478
Energy: 1.14091339402957
Energy: 1.1409123902757177
Energy: 1.1819342966784636
Energy: 1.1456115873911348
Energy: 1.14069555796531
Energy: 1.137476060651622
Energy: 1.1305336258073722
Energy: 1.1435276835566806
Energy: 1.1879982910425304
Energy: 1.1494577815976421
Energy: 1.1865456797872465
Energy: 1.1475395371997354
Energy: 1.1475909187719513
Energy: 1.1483888401589968
Energy: 1.1527196003332907
Energy: 1.1932265708781293
Energy: 1.1503233909972788
Energy: 1.1377410661963858
Energy: 1.136976762955201
Energy: 1.1484536464365704
Energy: 1.1464525301542112
Energy: 1.1482604663349854
Energy: 1.182433369510184
Energy: 1.1876737335517862
Energy: 1.1049616301548322
Energy: 1.105420106782517
Energy: 1.1660000174683212
Energy: 1.1093984846777527
Energy: 1.1057109292697904
Energy: 1.281817003094098
Energy: 1.1069729620747704
Energy: 1.1074068878049348
Energy: 1.1503422417072098
Energy: 1.1121825636651255
Energy: 1.151014062317766
Energy: 1.1702126716143548
Energy: 1.145400424353998
Energy: 1.148429263306047
Energy: 1.1408838581419847
Energy: 1.1655813193776585
Energy: 1.1487111112770076
Energy: 1.1733717764548972
Energy: 1.143310870840483
Energy: 1.1760955782787625
Energy: 1.1414396030401013
Energy: 1.1657892549976603
Energy: 1.1725735832562776
Energy: 1.2818636180173422
Energy: 1.159966857121651
Energy: 1.1545947045119078
Energy: 1.1499052743662
Energy: 1.1463310382009582
Energy: 1.1826414149975089
Energy: 1.286933887254042
Energy: 1.1483567329093156
Energy: 1.150929395598529
Energy: 1.148879715313056
Energy: 1.1509688339112716
Energy: 1.1499956920965217
Energy: 1.1825814788538167
Energy: 1.1391935962463573
Energy: 1.1138512545209658
Energy: 1.1016634957288596
Energy: 1.1362552077926455
Energy: 1.1857394622787816

minimum gb energy = 1.1016634957288596 eV
minimum distance =  2.24541118427379 Angstroms
sigma value = 33


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

Energy: 0.02079115936426499
Energy: 8.574009922328644
Energy: 0.021599073167957384
Energy: 0.0234071603292587
Energy: 8.605753183919552
Energy: 0.021487824175120893
Energy: 0.6532641581966474
Energy: 0.1755498684773859
Energy: 0.17294976405875143
Energy: 0.17181462627600985
Energy: 0.1732765520175697
Energy: 0.1725898737245265
Energy: 1.6501959945279137
Energy: 1.1637410802268733
Energy: 1.1602006753770755
Energy: 1.1564279386602674
Energy: 1.1604777490340403
Energy: 1.1598235134407395
Energy: 0.6532641581952472
Energy: 0.1755498684783193
Energy: 0.17294976405828472
Energy: 0.17181462627372818
Energy: 0.17327655201435457
Energy: 0.1725898737249932

minimum gb energy = 0.02079115936426499 eV
minimum distance =  2.45975780960636 Angstroms
sigma value = 1