Model name: model_name=EAM_Dynamo_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005
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=3.520000368356705
cohesive_energy=4.450349990424746
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018160114457014667
Energy: 0.8924486798207402
Energy: 0.018160114457345427
Energy: 0.8924486798207402
Energy: 0.018160114457345427
Energy: 0.892448679821034
Energy: 0.8924486798204092
Energy: 0.0188287123449469
Energy: 0.8924486798207402
Energy: 0.01882871234105123
Energy: 0.8924486798207402
Energy: 0.01882871234237429
Energy: 0.018160114457345427
Energy: 0.8924486798207402
Energy: 0.018160114457345427
Energy: 0.892448679821034
Energy: 0.018160114457345427
Energy: 0.8924486798216956
Energy: 0.8924486798207402
Energy: 0.01882871234237429
Energy: 0.892448679821034
Energy: 0.018828712342043526
Energy: 0.8924486798207402
Energy: 0.018828712342668304
Energy: 0.018160114457345427
Energy: 0.8924486798207402
Energy: 0.018160114457345427
Energy: 0.8924486798207402
Energy: 0.018160114457345427
Energy: 0.892448679821365
Energy: 0.892448679821034
Energy: 0.018828712341712763
Energy: 0.892448679821365
Energy: 0.01882871234237429
Energy: 0.892448679821365
Energy: 0.018828712341381997

minimum gb energy = 0.018160114457014667 eV
minimum distance =  2.486309719895 Angstroms
sigma value = 1


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

Energy: 1.201424027027749
Energy: 1.1642633187855724
Energy: 1.201424027026953
Energy: 1.1642633187847762
Energy: 1.201424027026953
Energy: 1.1642633187847762
Energy: 1.2968333049829663
Energy: 1.09605259565749
Energy: 1.2968333049853549
Energy: 1.096052595658286
Energy: 1.2968333049853549
Energy: 1.096052595658286
Energy: 1.138710106618373
Energy: 1.199554832756376
Energy: 1.1387101066191692
Energy: 1.1995548327571723
Energy: 1.1387101066199652
Energy: 1.1995548327579686
Energy: 1.203011507994095
Energy: 1.1342689925793312
Energy: 1.2030115079964838
Energy: 1.1342689925793312
Energy: 1.2030115079909107
Energy: 1.1342689925793312
Energy: 1.1587749467423585
Energy: 1.2470317689496035
Energy: 1.1587749467375814
Energy: 1.2470317689496035
Energy: 1.1587749467431547
Energy: 1.247031768945695
Energy: 1.2193324871154219
Energy: 1.0937533465225366
Energy: 1.2193324871154219
Energy: 1.093753346520148
Energy: 1.2193324871154219
Energy: 1.093753346520148
Energy: 1.1456946444034801
Energy: 1.1791002357236382
Energy: 1.145694644407461
Energy: 1.1791002357308038
Energy: 1.145694644402684
Energy: 1.1791002357308038
Energy: 1.1269142933673664
Energy: 1.2660132218047138
Energy: 1.1269142933649778
Energy: 1.266013221808695
Energy: 1.1269142933641816
Energy: 1.2660132218071025
Energy: 1.2447883961657629
Energy: 1.1888381530625958
Energy: 1.2447883961649664
Energy: 1.1888381530625958
Energy: 1.2447883961657629
Energy: 1.1888381530625958
Energy: 1.083690833818267
Energy: 1.2507990691825923
Energy: 1.0836908338190632
Energy: 1.2507990691841846
Energy: 1.083690833818267
Energy: 1.2507990691833883
Energy: 1.2526268009455797
Energy: 1.092934911946961
Energy: 1.2526268009479682
Energy: 1.092934911947757
Energy: 1.2526268009495605
Energy: 1.092934911946961
Energy: 1.0696903044821422
Energy: 1.1833226706081665
Energy: 1.0696903044821422
Energy: 1.1833226706073703
Energy: 1.0696903044829384
Energy: 1.1833226706073703
Energy: 1.3102106995687728
Energy: 1.0680624658713187
Energy: 1.3102106995687728
Energy: 1.0680624658705224
Energy: 1.3102106995687728
Energy: 1.0680624658705224
Energy: 1.110919445469329
Energy: 1.1462646035435538
Energy: 1.110919445469329
Energy: 1.1462646035459425
Energy: 1.110919445469329
Energy: 1.1462646035451463
Energy: 1.326043610128655
Energy: 1.0875554663864098
Energy: 1.3260436101294513
Energy: 1.0875554663887983
Energy: 1.3260436101302475
Energy: 1.087555466387206
Energy: 1.3258893673408907
Energy: 1.2065921233054342
Energy: 1.3258893673416867
Energy: 1.2065921233054342
Energy: 1.3258893673408907
Energy: 1.2065921233070265
Energy: 1.1685152842363902
Energy: 1.1778114428030086
Energy: 1.1685152842363902
Energy: 1.1778114428006201
Energy: 1.1685152842395747
Energy: 1.1778114428030086
Energy: 1.1686920776017935
Energy: 1.1444509131384857
Energy: 1.168692077595424
Energy: 1.1444509131368932
Energy: 1.168692077598609
Energy: 1.144450913135301
Energy: 1.0781628760119244
Energy: 1.1337465883817661
Energy: 1.0781628760119244
Energy: 1.1337465883809696
Energy: 1.078162876014313
Energy: 1.1337465883849507
Energy: 1.2121804704504486
Energy: 1.0934949880948985
Energy: 1.2121804704536334
Energy: 1.093494988096491
Energy: 1.2121804704520411
Energy: 1.093494988096491
Energy: 1.1046405009898668
Energy: 1.2883618996172173
Energy: 1.1046405009898668
Energy: 1.288361899620402
Energy: 1.1046405009890705
Energy: 1.2883618996227906
Energy: 1.2161144721621855
Energy: 1.1811738293199254
Energy: 1.2161144721637778
Energy: 1.1811738293191294
Energy: 1.2161144721661663
Energy: 1.1811738293199254
Energy: 1.0731518874945998
Energy: 1.292773835757823
Energy: 1.0731518874969883
Energy: 1.292773835757823
Energy: 1.073151887496192
Energy: 1.292773835758619

minimum gb energy = 1.0680624658705224 eV
minimum distance =  2.22095806997164 Angstroms
sigma value = 33


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

Energy: 1.2417228250126693
Energy: 1.2588224750810861
Energy: 1.1891536364963629
Energy: 1.258822475081539
Energy: 1.241722825011352
Energy: 1.2588224750797274
Energy: 1.2817845367412748
Energy: 1.1307852532089984
Energy: 1.2817845367394634
Energy: 1.1307852532112626
Energy: 1.2817845367412748
Energy: 1.1307852532112626
Energy: 1.085363223336653
Energy: 1.1299875059415596
Energy: 1.0853632233362
Energy: 1.1299875059411066
Energy: 1.0853632233384645
Energy: 1.1299875059388425
Energy: 1.2942883295567744
Energy: 1.2064063717152584
Energy: 1.2942883295531515
Energy: 1.2064063717152584
Energy: 1.2942883295531515
Energy: 1.206406371716617
Energy: 1.1767426466932003
Energy: 1.192158628927256
Energy: 1.1767426466932003
Energy: 1.192158628928162
Energy: 1.176742646694559
Energy: 1.1921586289240862
Energy: 1.1436989734948466
Energy: 1.0503712298502814
Energy: 1.1436989734962053
Energy: 1.050371229862015
Energy: 1.1436989734930352
Energy: 1.050371229849376
Energy: 1.259745338617945
Energy: 1.1894328445725972
Energy: 1.2597453386202093
Energy: 1.1894328445762203
Energy: 1.2597453386229265
Energy: 1.189432844576673
Energy: 1.04978272195377
Energy: 1.242865125800095
Energy: 1.0497827219573932
Energy: 1.2428651257991892
Energy: 1.049782721958299
Energy: 1.2428651257973777
Energy: 1.1265106643372444
Energy: 1.08914260292586
Energy: 1.1265106643381502
Energy: 1.0891426029308415
Energy: 1.1265106643404146
Energy: 1.0891426029308415
Energy: 1.0737409104347047
Energy: 1.181553911726904
Energy: 1.0737415397592447
Energy: 1.181478139777961
Energy: 1.0737409104337987
Energy: 1.1810190819346318
Energy: 1.2687683815347954
Energy: 1.0784217438778667
Energy: 1.268768381532984
Energy: 1.0784217438801311
Energy: 1.2687683815352484
Energy: 1.0784217438801311
Energy: 1.0853580201172304
Energy: 1.173528480315014
Energy: 1.085358335224713
Energy: 1.1735284803213544
Energy: 1.0853580201117956
Energy: 1.1735284803204487
Energy: 1.1907003530707951
Energy: 1.0930855876898162
Energy: 1.1907003530667195
Energy: 1.0930855876893635
Energy: 1.1907003530635496
Energy: 1.0930855876884575
Energy: 1.2017277083956583
Energy: 1.2651224213256285
Energy: 1.2017277083942999
Energy: 1.2651224213292513
Energy: 1.2017277083929412
Energy: 1.2651224213292513
Energy: 1.1786734206844418
Energy: 1.1309774112799793
Energy: 1.1786734206853478
Energy: 1.1309774112822437
Energy: 1.1786734206844418
Energy: 1.1309774112831494
Energy: 1.0856458676576397
Energy: 1.1303731442705676
Energy: 1.085645867657187
Energy: 1.1303731442719263
Energy: 1.0856458676589984
Energy: 1.1303731442696618
Energy: 1.245032386208492
Energy: 1.2088203007170555
Energy: 1.2450323862107564
Energy: 1.208820300721584
Energy: 1.245032386212115
Energy: 1.2088203007197726
Energy: 1.1754066049226382
Energy: 1.03870308913194
Energy: 1.1754066049221852
Energy: 1.0387030890332554
Energy: 1.1754066049194678
Energy: 1.038703089236059
Energy: 1.1454283714054012
Energy: 1.1575659009917205
Energy: 1.1454283714085713
Energy: 1.157565900993532
Energy: 1.1454283714103828
Energy: 1.1575659009912675
Energy: 1.2607666796269483
Energy: 1.1928159053276997
Energy: 1.260766679627401
Energy: 1.1928159053317755
Energy: 1.2607666796278538
Energy: 1.1928159053317755
Energy: 1.0470836053411274
Energy: 1.3076572796354684
Energy: 1.0470836053406745
Energy: 1.3076572796318455
Energy: 1.047083605339316
Energy: 1.30765727963411
Energy: 1.129816189648917
Energy: 1.089186530572635
Energy: 1.12981618965254
Energy: 1.0891865305744464
Energy: 1.1298161896548042
Energy: 1.0891865305744464
Energy: 1.0742743847357386
Energy: 1.2942913337285202
Energy: 1.0742683183814785
Energy: 1.2942913337276143
Energy: 1.0742743847348326
Energy: 1.2942913337271613
Energy: 1.2736746725807315
Energy: 1.174938929933973
Energy: 1.2736746725766557
Energy: 1.17493892993035
Energy: 1.2736746725771084
Energy: 1.1749389299298971
Energy: 1.0852202149800767
Energy: 1.1439938640800538
Energy: 1.0853518125017052
Energy: 1.1439938640778309
Energy: 1.0852202149782653
Energy: 1.143993864076925
Energy: 1.2432727648280164
Energy: 1.2308745362248383
Energy: 1.189685221139017
Energy: 1.230874536225291
Energy: 1.2432727648234876
Energy: 1.2308745362234796
Energy: 1.2429742846930396
Energy: 1.2151224200135828
Energy: 1.1897930956184006
Energy: 1.2151224200135828
Energy: 1.2429742846930396
Energy: 1.2151224200122241
Energy: 1.0852833734840874
Energy: 1.1233787536865667
Energy: 1.0852833734854461
Energy: 1.123378753685661
Energy: 1.0852833734863518
Energy: 1.1233787536815851
Energy: 1.1823282171456193
Energy: 1.1300347428019475
Energy: 1.1823276342848539
Energy: 1.1300347428064763
Energy: 1.18232559090457
Energy: 1.1300347428082878
Energy: 1.074232139544442
Energy: 1.2705770902052353
Energy: 1.0742321395453478
Energy: 1.2705770902138396
Energy: 1.0742321395435361
Energy: 1.2705770902174627
Energy: 1.1753262252195662
Energy: 1.0893079613893797
Energy: 1.175326225220019
Energy: 1.0893079613898324
Energy: 1.1753262252182073
Energy: 1.0893079613889267
Energy: 1.0912928299294014
Energy: 1.2470481692597037
Energy: 1.0912928299316658
Energy: 1.2470481692615152
Energy: 1.091292829930307
Energy: 1.2470481692597037
Energy: 1.260567708546218
Energy: 1.1928282522859444
Energy: 1.2605677085448594
Energy: 1.1928282522845859
Energy: 1.2605677085444065
Energy: 1.1928282522845859
Energy: 1.1315980505334313
Energy: 1.1785608763682824
Energy: 1.13159805053479
Energy: 1.1785608763637947
Energy: 1.1315980505356957
Energy: 1.1785608763673765
Energy: 1.1300172563524107
Energy: 1.0854326473851936
Energy: 1.1300172563519577
Energy: 1.0854326473842881
Energy: 1.130017256351052
Energy: 1.0854326473847407
Energy: 1.2118738763151635
Energy: 1.2441139283484037
Energy: 1.2118738763174277
Energy: 1.244113928351574
Energy: 1.2118738763142578
Energy: 1.244113928351574
Energy: 1.0855732003792795
Energy: 1.1750082738854342
Energy: 1.085570136731813
Energy: 1.1750082738886043
Energy: 1.0855732003797325
Energy: 1.1750082738867926
Energy: 1.1587715264366754
Energy: 1.1446939559915978
Energy: 1.158771526435317
Energy: 1.1446939559947678
Energy: 1.158771526434864
Energy: 1.1446939559947678
Energy: 1.201642647748265
Energy: 1.2652923425850482
Energy: 1.2016426477464535
Energy: 1.2652923425864069
Energy: 1.2016426477432833
Energy: 1.265292342585954
Energy: 1.2443545138405716
Energy: 1.0486632019947246
Energy: 1.2443545138405716
Energy: 1.0486632019951776
Energy: 1.244354513842836
Energy: 1.0486632019951776
Energy: 1.0853819896500119
Energy: 1.1227706270609656
Energy: 1.0853819896527293
Energy: 1.1227706270577955
Energy: 1.0853819896558994
Energy: 1.1227706270582485

minimum gb energy = 1.0387030890332554 eV
minimum distance =  2.34911432124032 Angstroms
sigma value = 51


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

Energy: 1.1788757769095612
Energy: 1.2048379794552915
Energy: 1.1788757769095612
Energy: 1.2048379794552915
Energy: 1.1788757769095612
Energy: 1.2048379794552915
Energy: 1.2872958935222514
Energy: 1.142529006647224
Energy: 1.2872958935264482
Energy: 1.142529006647224
Energy: 1.287295893525399
Energy: 1.142529006647224
Energy: 1.100837569377446
Energy: 1.1860324310599122
Energy: 1.1008375693753472
Energy: 1.186032431056764
Energy: 1.1008375693753472
Energy: 1.1860324310578134
Energy: 1.179434745965608
Energy: 1.0596342952037927
Energy: 1.1794347459635095
Energy: 1.0596342952048419
Energy: 1.1794347459666574
Energy: 1.0596342952048419
Energy: 1.2051373347175804
Energy: 1.1416265851214755
Energy: 1.2051373347175804
Energy: 1.1416265851214755
Energy: 1.2051373347175804
Energy: 1.141626585122525
Energy: 1.2040445184848827
Energy: 1.1412484122839532
Energy: 1.2040445184838335
Energy: 1.1412484122839532
Energy: 1.2040445184859319
Energy: 1.141248412282904
Energy: 1.1779191431698983
Energy: 1.141210323195209
Energy: 1.1779191431698983
Energy: 1.141210323195209
Energy: 1.1779191431688492
Energy: 1.1412103231962587
Energy: 1.1105514102044165
Energy: 1.1424642282678839
Energy: 1.1105514102033673
Energy: 1.1424642282699347
Energy: 1.110551410206515
Energy: 1.1424642282678839
Energy: 1.3543129531905496
Energy: 1.05943402906087
Energy: 1.3543129531884988
Energy: 1.05943402906087
Energy: 1.3543129531884988
Energy: 1.05943402906087
Energy: 1.0852531010882096
Energy: 1.3538457026485262
Energy: 1.0852531010882096
Energy: 1.3538457026485262
Energy: 1.0852531010882096
Energy: 1.3538457026485262
Energy: 1.2791526835866345
Energy: 1.075786364120141
Energy: 1.2791526835855853
Energy: 1.075786364120141
Energy: 1.2791526835866345
Energy: 1.0757863641211902
Energy: 1.1770806210516573
Energy: 1.2072243635071476
Energy: 1.177080621050608
Energy: 1.2072243635060984
Energy: 1.1770806210516573
Energy: 1.2072243635060984
Energy: 1.2814200852419346
Energy: 1.1417340823840922
Energy: 1.281419926747307
Energy: 1.1417340823840922
Energy: 1.2814194148166458
Energy: 1.1417340823840922
Energy: 1.1320868644907147
Energy: 1.125747444445471
Energy: 1.1320868644896656
Energy: 1.1257474444433722
Energy: 1.1320868644907147
Energy: 1.125747444442323
Energy: 1.2091861644665636
Energy: 1.1885201156798966
Energy: 1.2091861644665636
Energy: 1.1885201156809457
Energy: 1.2091861644665636
Energy: 1.1885201156809457
Energy: 1.2044624931749108
Energy: 1.1413429984845311
Energy: 1.2044624931749108
Energy: 1.141342998483482
Energy: 1.20446249317596
Energy: 1.1413429984855803
Energy: 1.2060007343462724
Energy: 1.2353067415381227
Energy: 1.2060007343452228
Energy: 1.235306741534975
Energy: 1.2060007343452228
Energy: 1.2353067415339254
Energy: 1.1778715165372178
Energy: 1.1462507458959004
Energy: 1.1778715165361686
Energy: 1.1462507458959004
Energy: 1.1778715165372178
Energy: 1.1462507458959004

minimum gb energy = 1.05943402906087 eV
minimum distance =  2.21524247422047 Angstroms
sigma value = 19


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

Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 1.1456277381333284
Energy: 1.1765617078914827
Energy: 1.1456277381345734
Energy: 1.1765617078914827
Energy: 1.1456277381333284
Energy: 1.1765617078921051
Energy: 0.9657048085540652
Energy: 1.1761088740980212
Energy: 0.9657048085540652
Energy: 1.1761088741005108
Energy: 0.9657048085553098
Energy: 1.1761088740998884
Energy: 1.0459463714754749
Energy: 0.9658086916838169
Energy: 1.0459463714748525
Energy: 0.9658086916831945
Energy: 1.0459463714736077
Energy: 0.9658086916831945
Energy: 0.9814838222259826
Energy: 0.9840582059812096
Energy: 0.9814838222272274
Energy: 0.9840582059805874
Energy: 0.9814838222297171
Energy: 0.984058205978126
Energy: 0.9813680114203249
Energy: 0.9843203156579254
Energy: 0.9813680114234369
Energy: 0.9843203156585478
Energy: 0.9813680114228147
Energy: 0.9843203156579254
Energy: 1.0459210570767044
Energy: 0.9657960307233326
Energy: 1.0459210570785713
Energy: 0.9657960307233326
Energy: 1.045921057077949
Energy: 0.9657960307233326
Energy: 0.9656909181850124
Energy: 1.1760691091376534
Energy: 0.9656909181850124
Energy: 1.1760691091370308
Energy: 0.9656909181856348
Energy: 1.1760691091370308
Energy: 1.145724260401214
Energy: 1.176568444266343
Energy: 1.145724260406193
Energy: 1.1765684442669657
Energy: 1.145724260401836
Energy: 1.176568444266343
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 1.1456277381308388
Energy: 1.1765617078921051
Energy: 1.145627738133951
Energy: 1.1765617078914827
Energy: 1.1456277381333284
Energy: 1.1765617078927273
Energy: 0.9657048085546873
Energy: 1.1761088740986436
Energy: 0.9657048085540652
Energy: 1.1761088740998884
Energy: 0.9657048085553098
Energy: 1.1761088740998884
Energy: 1.0459463714742303
Energy: 0.9658086916838169
Energy: 1.0459463714754749
Energy: 0.9658086916838169
Energy: 1.0459463714748525
Energy: 0.9658086916831945
Energy: 0.9814838222259826
Energy: 0.9840582059805874
Energy: 0.9814838222272274
Energy: 0.984058205979965
Energy: 0.9814838222278499
Energy: 0.984058205978126
Energy: 0.9813680114215698
Energy: 0.9843203156579254
Energy: 0.9813680114221922
Energy: 0.9843203156566804
Energy: 0.9813680114240594
Energy: 0.9843203156573029
Energy: 1.0459210570773267
Energy: 0.9657960307233326
Energy: 1.045921057079194
Energy: 0.9657960307227101
Energy: 1.0459210570773267
Energy: 0.9657960307233326
Energy: 0.9656909181850124
Energy: 1.1760691091376534
Energy: 0.9656909181850124
Energy: 1.1760691091376534
Energy: 0.9656909181850124
Energy: 1.1760691091370308
Energy: 1.1457242604005915
Energy: 1.176568444266343
Energy: 1.1457242604068154
Energy: 1.176568444266343
Energy: 1.145724260401214
Energy: 1.176568444266343
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 1.1456277381327062
Energy: 1.1765617078921051
Energy: 1.1456277381351958
Energy: 1.1765617078921051
Energy: 1.1456277381320839
Energy: 1.1765617078921051
Energy: 0.9657048085540652
Energy: 1.1761088740973986
Energy: 0.9657048085540652
Energy: 1.1761088740998884
Energy: 0.9657048085553098
Energy: 1.176108874099266
Energy: 1.0459463714760973
Energy: 0.9658086916838169
Energy: 1.0459463714760973
Energy: 0.9658086916831945
Energy: 1.0459463714754749
Energy: 0.9658086916831945
Energy: 0.9814838222266051
Energy: 0.9840582059812096
Energy: 0.9814838222284724
Energy: 0.984058205979965
Energy: 0.9814838222297171
Energy: 0.984058205978126
Energy: 0.9813680114221922
Energy: 0.9843203156566804
Energy: 0.9813680114234369
Energy: 0.9843203156579254
Energy: 0.9813680114203249
Energy: 0.9843203156566804
Energy: 1.0459210570785713
Energy: 0.9657960307233326
Energy: 1.0459210570785713
Energy: 0.9657960307233326
Energy: 1.045921057077949
Energy: 0.9657960307233326
Energy: 0.9656909181850124
Energy: 1.1760691091376534
Energy: 0.9656909181850124
Energy: 1.1760691091364084
Energy: 0.9656909181850124
Energy: 1.1760691091370308
Energy: 1.1457242604005915
Energy: 1.176568444266343
Energy: 1.1457242604068154
Energy: 1.1765684442669657
Energy: 1.145724260403081
Energy: 1.1765684442669657
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 0.9856486196277245
Energy: 1.032748856927514
Energy: 1.1456277381327062
Energy: 1.1765617078921051
Energy: 1.1456277381351958
Energy: 1.1765617078914827
Energy: 1.1456277381327062
Energy: 1.1765617078927273
Energy: 0.9657048085546873
Energy: 1.1761088740986436
Energy: 0.9657048085540652
Energy: 1.176108874099266
Energy: 0.9657048085553098
Energy: 1.1761088740998884

minimum gb energy = 0.9656909181850124 eV
minimum distance =  2.24541327625783 Angstroms
sigma value = 27


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

Energy: 0.9743900539514498
Energy: 0.9486507999874451
Energy: 0.9743900539514498
Energy: 0.9486507999889696
Energy: 0.9743900539514498
Energy: 0.9486507999889696
Energy: 1.1256802227867624
Energy: 0.9886292908543043
Energy: 1.1256802227867624
Energy: 0.9886292908558288
Energy: 1.1256802227867624
Energy: 0.9886292908558288
Energy: 0.9964694324504165
Energy: 1.1056538341151476
Energy: 0.9964694324580394
Energy: 1.1056538341151476
Energy: 0.9964694324534656
Energy: 1.1056538341166722
Energy: 1.0886844194643526
Energy: 0.9154736979632772
Energy: 1.0886844194643526
Energy: 0.9154736979617526
Energy: 1.0886844194643526
Energy: 0.9154736979632772
Energy: 1.166582918175528
Energy: 0.9152917333862594
Energy: 1.166582918175528
Energy: 0.9152917333893084
Energy: 1.166582918175528
Energy: 0.9152917333877838
Energy: 1.1124468879119986
Energy: 1.1571513472047759
Energy: 1.1124468879135232
Energy: 1.1571513472063004
Energy: 1.1124468879119986
Energy: 1.157151347207825
Energy: 1.0287342450266825
Energy: 0.9905286805985442
Energy: 1.0287342450266825
Energy: 0.9905286805985442
Energy: 1.0287342450266825
Energy: 0.9905286805985442
Energy: 0.971321045809795
Energy: 0.9500168050876292
Energy: 0.971321045809795
Energy: 0.9500168050876292
Energy: 0.9713210458082703
Energy: 0.9500168050845799
Energy: 1.042326384704664
Energy: 0.9965769839365594
Energy: 1.042326384704664
Energy: 0.9965769894333227
Energy: 1.042326384704664
Energy: 0.9965769840858995
Energy: 1.0965200856520214
Energy: 1.1119620174572893
Energy: 1.0965200856520214
Energy: 1.1119620174603386
Energy: 1.0965200856520214
Energy: 1.1119620174603386
Energy: 0.9495868078654621
Energy: 0.915466392415619
Energy: 0.9495868078654621
Energy: 0.915466392415619
Energy: 0.9495868078654621
Energy: 0.915466392415619
Energy: 1.1647202816886106
Energy: 1.0426219504481367
Energy: 1.164720281687086
Energy: 1.0426219504481367
Energy: 1.164720281687086
Energy: 1.042621950446612

minimum gb energy = 0.9152917333862594 eV
minimum distance =  2.2030902025799 Angstroms
sigma value = 9


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

Energy: 0.9615190695964653
Energy: 0.9612184966215628
Energy: 0.9615190695968935
Energy: 0.9612184966219912
Energy: 0.9615190695968935
Energy: 0.9612184966219912
Energy: 0.9236961152308288
Energy: 0.9231533319436551
Energy: 0.923696115232114
Energy: 0.9231533319436551
Energy: 0.9236961152316855
Energy: 0.9231533319436551
Energy: 0.8663645232469442
Energy: 0.9589932788885265
Energy: 0.8663645232460875
Energy: 0.9589932788893833
Energy: 0.8663645232448025
Energy: 0.9589932788906684
Energy: 0.8905794327154706
Energy: 0.8479816964313073
Energy: 0.8905794327150424
Energy: 0.8479816964325922
Energy: 0.8905794327141855
Energy: 0.8479816964300221
Energy: 0.9652170072556533
Energy: 0.9291118699956528
Energy: 0.9652170072556533
Energy: 0.9291118699960813
Energy: 0.9652170072565099
Energy: 0.9291118699960813
Energy: 0.9540619554664302
Energy: 0.9442910780901863
Energy: 0.9540619554642885
Energy: 0.9442910780983255
Energy: 0.9540619554655735
Energy: 0.9442910780957553
Energy: 0.8909350522675077
Energy: 1.0147694777589038
Energy: 0.8909350522722199
Energy: 1.0147694777593321
Energy: 0.8909350522773603
Energy: 1.0147694777593321
Energy: 0.8272300545575785
Energy: 0.9564228256536227
Energy: 0.8272300545571503
Energy: 0.9564228256549078
Energy: 0.8272300545567218
Energy: 0.9564228256565822
Energy: 0.977672805046916
Energy: 0.9280142353051243
Energy: 0.9776728050456309
Energy: 0.9280142353046958
Energy: 0.9776728050443458
Energy: 0.9280142353051243
Energy: 0.9692550742869193
Energy: 1.0218328242384547
Energy: 0.969255074287776
Energy: 1.0218328242363128
Energy: 0.9692550742907746
Energy: 1.0218328242371695
Energy: 0.8891985902262338
Energy: 0.8538559562181587
Energy: 0.889198590229661
Energy: 0.8538559562185869
Energy: 0.8891985902292325
Energy: 0.8538559562185869
Energy: 0.9148784154542131
Energy: 0.9516716125268464
Energy: 0.9148784154542131
Energy: 0.9516716125324153
Energy: 0.9148784154542131
Energy: 0.9516716125255613
Energy: 0.922502062610643
Energy: 0.9282103497565369
Energy: 0.9225020626114997
Energy: 0.9282103497582505
Energy: 0.9225020626149267
Energy: 0.9282103497573937
Energy: 0.9587465513009775
Energy: 0.9014112780082327
Energy: 0.9587465513026909
Energy: 0.9014112780090895
Energy: 0.9587465513001208
Energy: 0.9014112780150868
Energy: 0.8634000532350553
Energy: 0.9488019822990543
Energy: 0.8634000532350553
Energy: 0.9488019822994828
Energy: 0.8634000532350553
Energy: 0.9488019822994828
Energy: 0.8761131561240705
Energy: 0.8925341014655302
Energy: 0.8761131561223571
Energy: 0.8925341014625316
Energy: 0.8761131561249274
Energy: 0.8925341014651018
Energy: 1.0823339132115577
Energy: 0.8490250100434957
Energy: 1.0823339132102725
Energy: 0.8490250100404971
Energy: 1.0823339132102725
Energy: 0.849025010043924
Energy: 0.8790155546566222
Energy: 0.9229759802195393
Energy: 0.8790155546566222
Energy: 0.9229759802195393
Energy: 0.8790155546557655
Energy: 0.9229759802195393
Energy: 0.8243504647585457
Energy: 0.9465176457032702
Energy: 0.8243504647564038
Energy: 0.9465176456977014
Energy: 0.8243504647534052
Energy: 0.9465176456981297
Energy: 1.015740756953703
Energy: 0.8931544361629219
Energy: 1.0157407569545598
Energy: 0.8931544361637785
Energy: 1.0157407569545598
Energy: 0.8931544361633501
Energy: 0.8243527109836508
Energy: 0.9463487076687812
Energy: 0.8243527109836508
Energy: 0.9463487076662109
Energy: 0.8243527109849359
Energy: 0.9463487076568257
Energy: 0.8790189641149238
Energy: 0.9229774867558632
Energy: 0.8790189641162088
Energy: 0.92297748675672
Energy: 0.8790189641144952
Energy: 0.9229774867558632
Energy: 1.0836907406778393
Energy: 0.848928351933697
Energy: 1.0836907406782676
Energy: 0.8489283519255578
Energy: 1.0836907406782676
Energy: 0.8489283519247012
Energy: 0.8763718055359132
Energy: 0.9413271810431976
Energy: 0.8763718055359132
Energy: 0.941327181040199
Energy: 0.8763718055359132
Energy: 0.9413271810380571
Energy: 0.8634341115684708
Energy: 0.9485150153902847
Energy: 0.8634341115684708
Energy: 0.9485150153907129
Energy: 0.8634341115684708
Energy: 0.9485150153898563
Energy: 0.9586187654877965
Energy: 0.945828094127665
Energy: 0.9586187654869397
Energy: 0.9458280941272365
Energy: 0.9586187654839411
Energy: 0.9458280941272365
Energy: 0.9226357839845897
Energy: 0.928108024309893
Energy: 0.9226357839897301
Energy: 0.9281080243073228
Energy: 0.9226357839841612
Energy: 0.9281080243120348
Energy: 0.9148795550684825
Energy: 0.9123003239430345
Energy: 0.9148795550676256
Energy: 0.9123003239387509
Energy: 0.9148795550680541
Energy: 0.912300323936609
Energy: 0.8889613123051201
Energy: 0.8538646435851571
Energy: 0.888961312303835
Energy: 0.8538646435851571
Energy: 0.8889613123021214
Energy: 0.8538646435851571
Energy: 0.9687273330272121
Energy: 0.8777178843911195
Energy: 0.9687273330280688
Energy: 0.8777178843859791
Energy: 0.9687273330302109
Energy: 0.8777178843911195
Energy: 0.9778687414307612
Energy: 0.9280064149125801
Energy: 0.9778687414290478
Energy: 0.9280064149125801
Energy: 0.9778687414311896
Energy: 0.9280064149130086
Energy: 0.8272442245077427
Energy: 0.956037040790473
Energy: 0.8272442245077427
Energy: 0.9560370407926148
Energy: 0.8272442245077427
Energy: 0.9560370407900446
Energy: 0.8911076400308264
Energy: 1.0148704607755554
Energy: 0.891107640030398
Energy: 1.0148704607755554
Energy: 0.8911076400269711
Energy: 1.014870460775984
Energy: 0.9539634048295739
Energy: 0.9305564719894496
Energy: 0.9539634048270036
Energy: 0.9305564719885928
Energy: 0.9539634048312874
Energy: 0.9383008658022264
Energy: 0.9653554369769699
Energy: 0.9287904125657854
Energy: 0.9653554369778267
Energy: 0.9287904125653572
Energy: 0.9653554369778267
Energy: 0.9287904125657854
Energy: 0.8905435186423212
Energy: 0.8484444463173922
Energy: 0.8905435186436064
Energy: 0.8484444463199624
Energy: 0.8905435186423212
Energy: 0.8484444463161072
Energy: 0.8663147356091319
Energy: 0.9590704532775416
Energy: 0.8663147356082751
Energy: 0.9590704532762564
Energy: 0.8663147356078467
Energy: 0.9590704532766847
Energy: 0.9236700253476345
Energy: 0.8621142875029509
Energy: 0.9236700253467777
Energy: 0.8621142875038076
Energy: 0.9236700253416373
Energy: 0.8920363148124656
Energy: 0.9615190695973219
Energy: 0.9612184966232764
Energy: 0.9615190695977502
Energy: 0.9612184966232764
Energy: 0.9615190695973219
Energy: 0.9612184966232764
Energy: 0.923696115231257
Energy: 0.9231533319427985
Energy: 0.9236961152342558
Energy: 0.92315333194237
Energy: 0.9236961152265449
Energy: 0.92315333194237
Energy: 0.8663645232456592
Energy: 0.9589932788885265
Energy: 0.8663645232439457
Energy: 0.9589932788880982
Energy: 0.8663645232448025
Energy: 0.9589932788893833
Energy: 0.890579432715899
Energy: 0.8479816964304505
Energy: 0.8905794327146139
Energy: 0.8479816964330208
Energy: 0.8905794327154706
Energy: 0.8479816964308788
Energy: 0.9652170072582235
Energy: 0.9291118699956528
Energy: 0.9652170072582235
Energy: 0.9291118699956528
Energy: 0.9652170072590802
Energy: 0.9291118699956528

minimum gb energy = 0.8243504647534052 eV
minimum distance =  2.29480462834581 Angstroms
sigma value = 57


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

Energy: 0.4116510426636363
Energy: 0.42436599660083796
Energy: 0.4116510426646114
Energy: 0.42436599660083796
Energy: 0.4116510426646114
Energy: 0.42436599660181307
Energy: 0.5407268221409722
Energy: 0.41229186377911964
Energy: 0.5407268221409722
Energy: 0.41229186377911964
Energy: 0.5407268221409722
Energy: 0.41229186377911964
Energy: 0.46988701215986817
Energy: 0.5339451871569998
Energy: 0.46988701215986817
Energy: 0.533945187157975
Energy: 0.46988701215986817
Energy: 0.533945187157975
Energy: 0.42563195103957957
Energy: 0.41082501990020204
Energy: 0.42563195103957957
Energy: 0.41082501990020204
Energy: 0.42563195104152984
Energy: 0.41082501990020204
Energy: 0.5409956192386817
Energy: 0.5496320810224223
Energy: 0.5409956192396569
Energy: 0.5496320810224223
Energy: 0.5409956192396569
Energy: 0.5496320810224223
Energy: 0.41104224007293333
Energy: 0.4704950278739068
Energy: 0.4110422400719582
Energy: 0.47049502787488195
Energy: 0.4110422400719582
Energy: 0.47049502787488195
Energy: 0.411057659299218
Energy: 0.4704017131693095
Energy: 0.411057659299218
Energy: 0.47040171317028456
Energy: 0.411057659299218
Energy: 0.4704017131712597
Energy: 0.5409854166005831
Energy: 0.5496009650902515
Energy: 0.5409854166005831
Energy: 0.5496009650902515
Energy: 0.5409854166015582
Energy: 0.5496009650912265
Energy: 0.42562526155387526
Energy: 0.41082260330219333
Energy: 0.42562526155387526
Energy: 0.41082260330219333
Energy: 0.42562526155387526
Energy: 0.41082260330219333
Energy: 0.46981483761882303
Energy: 0.5319839007486706
Energy: 0.46981483761882303
Energy: 0.5319839007486706
Energy: 0.46981483761882303
Energy: 0.5319839007486706
Energy: 0.5410411727925994
Energy: 0.41242074336011536
Energy: 0.5410411727925994
Energy: 0.4124207433610905
Energy: 0.5410411727925994
Energy: 0.4124207433610905
Energy: 0.4116510426646114
Energy: 0.42436599660083796
Energy: 0.4116510426646114
Energy: 0.42436599660083796
Energy: 0.4116510426646114
Energy: 0.42436599660181307
Energy: 0.5407268221409722
Energy: 0.41229186377911964
Energy: 0.5407268221409722
Energy: 0.41229186377911964
Energy: 0.5407268221399971
Energy: 0.41229186377911964
Energy: 0.46988701215986817
Energy: 0.533945187157975
Energy: 0.4698870121608432
Energy: 0.5339451871569998
Energy: 0.46988701215986817
Energy: 0.533945187157975
Energy: 0.4256319510405547
Energy: 0.41082501990020204
Energy: 0.42563195103957957
Energy: 0.41082501990020204
Energy: 0.4256319510405547
Energy: 0.41082501990020204
Energy: 0.5409956192386817
Energy: 0.5496320810224223
Energy: 0.5409956192386817
Energy: 0.5496320810214471
Energy: 0.5409956192386817
Energy: 0.5496320810214471
Energy: 0.4110422400719582
Energy: 0.4704950278758571
Energy: 0.4110422400719582
Energy: 0.4704950278739068
Energy: 0.4110422400719582
Energy: 0.47049502787488195
Energy: 0.411057659299218
Energy: 0.47040171317028456
Energy: 0.411057659299218
Energy: 0.47040171317028456
Energy: 0.411057659299218
Energy: 0.47040171317028456
Energy: 0.5409854166005831
Energy: 0.5496009650902515
Energy: 0.5409854166015582
Energy: 0.5496009650902515
Energy: 0.5409854166015582
Energy: 0.5496009650902515

minimum gb energy = 0.41082260330219333 eV
minimum distance =  2.42230272476315 Angstroms
sigma value = 11


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

Energy: 0.8286787752098782
Energy: 0.9416757495176411
Energy: 0.8286787752098782
Energy: 0.9416757495169268
Energy: 0.8286787752098782
Energy: 0.9416757495162125
Energy: 0.9778783322900226
Energy: 0.8372626288751238
Energy: 0.9778783322900226
Energy: 0.8372626288751238
Energy: 0.9778783322893083
Energy: 0.8372626288744096
Energy: 0.9372652429670324
Energy: 1.1014208356159185
Energy: 0.9372652429677466
Energy: 1.1014208356137756
Energy: 0.9372652429677466
Energy: 1.1014208356137756
Energy: 0.9628073900169498
Energy: 0.7666715278246854
Energy: 0.9628073900162356
Energy: 0.7666715278253998
Energy: 0.9628073900176641
Energy: 0.7666715278253998
Energy: 0.7619988525983903
Energy: 0.726875770467939
Energy: 0.7619988525998188
Energy: 0.7268757704672247
Energy: 0.7619988525998188
Energy: 0.7268757704672247
Energy: 0.9073880712125839
Energy: 0.7630146784035529
Energy: 0.9073880712125839
Energy: 0.7630146784028387
Energy: 0.9073880712125839
Energy: 0.7630146784035529
Energy: 0.7342212953094325
Energy: 0.8198426405349377
Energy: 0.7342212953087183
Energy: 0.8198426405363664
Energy: 0.7342212953087183
Energy: 0.8198426405342234
Energy: 0.9683899609347073
Energy: 0.7017252776656083
Energy: 0.9683899609354216
Energy: 0.7017252776663228
Energy: 0.9683899609347073
Energy: 0.7017252776663228
Energy: 0.9641899787823384
Energy: 0.7024164134230128
Energy: 0.9641899787830527
Energy: 0.7024164134237271
Energy: 0.9641899787823384
Energy: 0.7024164134237271
Energy: 0.7213785608476491
Energy: 1.0269806078744323
Energy: 0.7213785608476491
Energy: 1.0269806078744323
Energy: 0.7213785608476491
Energy: 1.0269806078744323
Energy: 0.9351346974184114
Energy: 0.947832918684042
Energy: 0.9351346974191257
Energy: 0.947832918684042
Energy: 0.9351346974205542
Energy: 0.947832918684042
Energy: 0.7612603257349772
Energy: 0.7283898944297515
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Energy: 0.7612603257328343
Energy: 0.7283898944297515
Energy: 0.7881055821031157
Energy: 0.7708611589859974
Energy: 0.788105582103765
Energy: 0.7708611589874261
Energy: 0.7881055821130509
Energy: 0.7708611589874261
Energy: 0.9286222332361237
Energy: 1.0718738309613114
Energy: 0.9286222332361237
Energy: 1.0718738309598828
Energy: 0.928622233236838
Energy: 1.0718738309620257
Energy: 0.977685888496781
Energy: 0.8403987112491286
Energy: 0.977685888496781
Energy: 0.8403987112505572
Energy: 0.9776858884974952
Energy: 0.8403987112498429
Energy: 0.8041278199697077
Energy: 0.8667897537018687
Energy: 0.8041278199704222
Energy: 0.8667897537011544
Energy: 0.8041278199704222
Energy: 0.8667897536997258
Energy: 0.7708199681425831
Energy: 0.8345060135499195
Energy: 0.7708199681425831
Energy: 0.8345060135499195
Energy: 0.7708199681425831
Energy: 0.8345060135506337
Energy: 1.1758609775518203
Energy: 0.8688130594463386
Energy: 1.1758609775496773
Energy: 0.8688130594519881
Energy: 1.1758609775518203
Energy: 0.8688130594519881
Energy: 0.9010635293271116
Energy: 0.7636623320291559
Energy: 0.9010635293271116
Energy: 0.7636623320298702
Energy: 0.9010635293228257
Energy: 0.7636623320291559
Energy: 0.7619718855038983
Energy: 0.8637088723544426
Energy: 0.7619718855053268
Energy: 0.8637088723537283
Energy: 0.761971885503184
Energy: 0.8637088723544426
Energy: 0.7198947311408712
Energy: 0.764677582567361
Energy: 0.7198947311401569
Energy: 0.7646775825652181
Energy: 0.7198947311401569
Energy: 0.7646775825659324
Energy: 0.7857778004808866
Energy: 0.8185767732406685
Energy: 0.785777800481601
Energy: 0.8185767732406685
Energy: 0.7857778004808866
Energy: 0.8185767732435258
Energy: 0.8565496877128692
Energy: 0.8575528398924217
Energy: 0.8565496877128692
Energy: 0.8575528398917074
Energy: 0.8565496877128692
Energy: 0.8575528398924217
Energy: 0.7854442520935594
Energy: 0.819578402648374
Energy: 0.7854442520899878
Energy: 0.819578402648374
Energy: 0.7854442520907021
Energy: 0.819578402648374
Energy: 0.7200089313546809
Energy: 1.0267735359106185
Energy: 0.7200089313546809
Energy: 1.026773536115558
Energy: 0.7200089313546809
Energy: 1.0267735358870465
Energy: 1.3072769387089094
Energy: 0.9495069218201108
Energy: 1.3072769387089094
Energy: 0.9495069218208251
Energy: 1.3072769387089094
Energy: 0.9495069218201108

minimum gb energy = 0.7017252776656083 eV
minimum distance =  2.27767308704381 Angstroms
sigma value = 41


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

Energy: 0.9181584447126815
Energy: 0.7901594374411414
Energy: 0.9181584447132444
Energy: 0.7901594374411414
Energy: 0.9181584447126815
Energy: 0.7901594374411414
Energy: 1.0590687998814072
Energy: 0.8754824006023032
Energy: 1.0590687998814072
Energy: 0.8754824006028663
Energy: 1.0590687998814072
Energy: 0.8754824006023032
Energy: 0.927752440727521
Energy: 0.9849599537801553
Energy: 0.9277524407269581
Energy: 0.9849599537812812
Energy: 0.9277524407263952
Energy: 0.9849599537807182
Energy: 0.8768092078301135
Energy: 0.7883429528822824
Energy: 0.8768092078295504
Energy: 0.7883429528822824
Energy: 0.8768092078295504
Energy: 0.7883429528822824
Energy: 0.7551939260918437
Energy: 0.8220039672841843
Energy: 0.7551939260918437
Energy: 0.8220039672836214
Energy: 0.7551939260918437
Energy: 0.8220039672841843
Energy: 0.9106673219760977
Energy: 0.8576732479868532
Energy: 0.9106673219744086
Energy: 0.8576732479868532
Energy: 0.9106673219738456
Energy: 0.8576732479868532
Energy: 0.8081669771285913
Energy: 1.119524122246785
Energy: 0.8081669771274654
Energy: 1.119524122246222
Energy: 0.8081669771285913
Energy: 1.119524122246785
Energy: 0.7827480886251931
Energy: 0.7882218724303328
Energy: 0.7827480886251931
Energy: 0.7882218724303328
Energy: 0.7827480886251931
Energy: 0.7882218724303328
Energy: 0.7705386406223158
Energy: 0.8066867091405835
Energy: 0.7705386406223158
Energy: 0.8066867091405835
Energy: 0.7705386406223158
Energy: 0.8066867091405835
Energy: 0.8649455534724145
Energy: 0.9108347076769138
Energy: 0.8649455534729775
Energy: 0.9108347076780396
Energy: 0.8649455534729775
Energy: 0.9108347076780396
Energy: 0.864367275732364
Energy: 0.9107184883726938
Energy: 0.864367275732364
Energy: 0.9107184883726938
Energy: 0.864367275732364
Energy: 0.9107184883732568
Energy: 0.7654537414305836
Energy: 0.8113957804034431
Energy: 0.7654537414305836
Energy: 0.8113957804023171
Energy: 0.7654537414305836
Energy: 0.8113957804011911
Energy: 0.7858699899166531
Energy: 0.7896994218812934
Energy: 0.7858699899166531
Energy: 0.7896994218812934
Energy: 0.7858699899166531
Energy: 0.7896994218812934
Energy: 0.7546893748185309
Energy: 0.8954181393201793
Energy: 0.754689374819094
Energy: 0.8954181393190533
Energy: 0.754689374819094
Energy: 0.8954181393179274
Energy: 0.8643798838972351
Energy: 0.8541490525121178
Energy: 0.8643798838949832
Energy: 0.8541490525115548
Energy: 0.8643798838977981
Energy: 0.8541490525121178
Energy: 0.7529837875848996
Energy: 0.7976511658940654
Energy: 0.7529837875843366
Energy: 0.7976511658923764
Energy: 0.7529837875848996
Energy: 0.7976511658929394
Energy: 0.7960531796571099
Energy: 0.7897197835922153
Energy: 0.796053179657673
Energy: 0.7897197835922153
Energy: 0.7960531796571099
Energy: 0.7897197835922153
Energy: 0.8483445582430026
Energy: 0.9838519975354596
Energy: 0.8483445582441285
Energy: 0.9838519975337707
Energy: 0.8483445582435656
Energy: 0.9838519975399637
Energy: 0.895396415549243
Energy: 0.8770134935334737
Energy: 0.895396415549243
Energy: 0.8770134935351626
Energy: 0.895396415549243
Energy: 0.8770134935345997
Energy: 0.8646781050255772
Energy: 0.8230821308081241
Energy: 0.8646781050255772
Energy: 0.8230821308075611
Energy: 0.8646781050250142
Energy: 0.8230821308081241
Energy: 0.7713462174168921
Energy: 0.877234470157071
Energy: 0.771346217417455
Energy: 0.877234470157634
Energy: 0.7713462174163292
Energy: 0.8772344701565081
Energy: 0.8393172518689396
Energy: 1.137343768488303
Energy: 0.8393172518644356
Energy: 1.137343768486051
Energy: 0.8393172518695025
Energy: 1.1373437684854881
Energy: 0.8733435005115926
Energy: 0.7925688373048857
Energy: 0.8733435005110296
Energy: 0.7925688373048857
Energy: 0.8733435005115926
Energy: 0.7925688373048857
Energy: 0.7531943107171674
Energy: 0.9380289524098457
Energy: 0.7531943107171674
Energy: 0.8534135333884659
Energy: 0.7531943107171674
Energy: 0.9380289524109717
Energy: 0.7522754847910803
Energy: 0.870495643428664
Energy: 0.7522754847916433
Energy: 0.870495643428664
Energy: 0.7522754847916433
Energy: 0.870495643428101
Energy: 0.8062948716893189
Energy: 0.8059553587409869
Energy: 0.8062948716893189
Energy: 0.805955358740424
Energy: 0.8062948716893189
Energy: 0.8059553587409869
Energy: 0.7836655975511552
Energy: 0.7923512310936267
Energy: 0.7836655975511552
Energy: 0.7923512310936267
Energy: 0.7836655975511552
Energy: 0.7923512310941897
Energy: 0.7727030947084982
Energy: 0.8843262882967345
Energy: 0.7727030947079353
Energy: 0.8402455083186917
Energy: 0.7727030947079353
Energy: 0.8402455083181288
Energy: 0.8728056358527527
Energy: 0.9012616755765256
Energy: 0.8728056358533157
Energy: 0.9012616755731476
Energy: 0.8728056358538787
Energy: 0.9012616755737106
Energy: 0.9575880416315942
Energy: 0.7543687976600673
Energy: 0.9575880416338459
Energy: 0.7543687976600673
Energy: 0.9575880416327199
Energy: 0.7543687976600673
Energy: 0.7644411494872705
Energy: 0.8265984890020179
Energy: 0.7644411494872705
Energy: 0.8265984889975141
Energy: 0.7644411494872705
Energy: 0.8265984890020179
Energy: 0.7888490609510702
Energy: 0.7923285566148227
Energy: 0.7888490609510702
Energy: 0.7923285566148227
Energy: 0.7888490609510702
Energy: 0.7923285566148227
Energy: 0.7523031685654825
Energy: 0.839602623284161
Energy: 0.7523031685654825
Energy: 0.839602623283598
Energy: 0.7523031685654825
Energy: 0.839602623284724

minimum gb energy = 0.7522754847910803 eV
minimum distance =  2.29812296131385 Angstroms
sigma value = 33


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

Energy: 0.8877930979180165
Energy: 0.8171064915598361
Energy: 0.8877930979188068
Energy: 0.8171064915594769
Energy: 0.8877930979183758
Energy: 0.8171064915598361
Energy: 0.9502185807763044
Energy: 0.8169002383547237
Energy: 0.9502185807770945
Energy: 0.8169002383547237
Energy: 0.9502185807766634
Energy: 0.8169002383547237
Energy: 0.8738825201843521
Energy: 0.989112500120064
Energy: 0.8738825201843521
Energy: 0.9891125001197048
Energy: 0.8738825201843521
Energy: 0.989112500120064
Energy: 0.9447887877252681
Energy: 0.8146429139616029
Energy: 0.9447887877256993
Energy: 0.8146429139620339
Energy: 0.9447887877244779
Energy: 0.8146429139620339
Energy: 0.8186012648058351
Energy: 0.9589171459971698
Energy: 0.8186012648074156
Energy: 0.9589171459999716
Energy: 0.8186012648070563
Energy: 0.9589171460062933
Energy: 0.9917938952039135
Energy: 0.8353563864726666
Energy: 0.9917938952058529
Energy: 0.8353563864730258
Energy: 0.9917938952098041
Energy: 0.8353563864722355
Energy: 0.8688893611745738
Energy: 0.9508603993723821
Energy: 0.8688893611737837
Energy: 0.9508603993728131
Energy: 0.868889361175795
Energy: 0.9508603993728131
Energy: 0.8980619482951769
Energy: 0.9394637551132126
Energy: 0.8980619482951769
Energy: 0.9394637551140028
Energy: 0.898061948294746
Energy: 0.9394637551136438
Energy: 0.9965143753487438
Energy: 0.8456494146682608
Energy: 0.9965143753547064
Energy: 0.8456494146670397
Energy: 0.9965143753503243
Energy: 0.8456494146674706
Energy: 1.2506650638706616
Energy: 0.8403358646355954
Energy: 1.250665063872242
Energy: 0.8403358646355954
Energy: 1.250665063872673
Energy: 0.8403358646355954
Energy: 0.9014875427530338
Energy: 0.9044497980284344
Energy: 0.9014875427526747
Energy: 0.9044497980287937
Energy: 0.9014875427526747
Energy: 0.9044497980287937
Energy: 0.9594165516557309
Energy: 0.8146136689902286
Energy: 0.9594165516501993
Energy: 0.8146136689902286
Energy: 0.9594165516557309
Energy: 0.8146136689902286
Energy: 0.8426241343815236
Energy: 0.9971784886984384
Energy: 0.8426241343818827
Energy: 0.9971784886984384
Energy: 0.8426241343807334
Energy: 0.9971784886987977
Energy: 0.9334579449122141
Energy: 0.8962646621045691
Energy: 0.9334579449110648
Energy: 0.8962646621050002
Energy: 0.9334579449114239
Energy: 0.8962646621045691
Energy: 0.9261694045254502
Energy: 0.8711231098347114
Energy: 0.9261694045266715
Energy: 0.8711231098350706
Energy: 0.9261694045258814
Energy: 0.8711231098350706
Energy: 0.8350655994393893
Energy: 0.99214433532568
Energy: 0.8350655994393893
Energy: 0.9921443353240996
Energy: 0.8350655994398203
Energy: 0.9921443353248898
Energy: 0.9600093016311759
Energy: 0.8164662399055349
Energy: 0.9600093016283743
Energy: 0.8164662399055349
Energy: 0.9600093016295955
Energy: 0.8164662399055349
Energy: 0.8171281858434399
Energy: 0.8871650113632966
Energy: 0.8171281858434399
Energy: 0.8871650113625064
Energy: 0.8171281858442302
Energy: 0.8871650113620755
Energy: 0.9882994739491964
Energy: 0.8750283922343329
Energy: 0.9882994739484061
Energy: 0.8750283922335427
Energy: 0.9882994739495556
Energy: 0.8750283922335427
Energy: 1.0010435688274422
Energy: 0.8460981656381402
Energy: 1.0010435688274422
Energy: 0.8460981656381402
Energy: 1.0010435688286636
Energy: 0.8460981656369908
Energy: 0.8166624046439843
Energy: 0.885761285657644
Energy: 0.8166624046439843
Energy: 0.885761285657644
Energy: 0.8166624046431941
Energy: 0.885761285657644
Energy: 0.8189449763338446
Energy: 0.9548730547497162
Energy: 0.8189449763342754
Energy: 0.9548730547500754
Energy: 0.8189449763334853
Energy: 0.9548730547500754
Energy: 0.9260941594520824
Energy: 0.8260187520300007
Energy: 0.9260941594516515
Energy: 0.8260187520304317
Energy: 0.9260941594520824
Energy: 0.8260187520296415
Energy: 0.814305261496321
Energy: 0.9430021169221949
Energy: 0.8143052614967521
Energy: 0.9430021169225542
Energy: 0.8143052614967521
Energy: 0.9430021169225542
Energy: 0.9590990319886437
Energy: 0.8165215491822698
Energy: 0.9590990319977669
Energy: 0.816521549182701
Energy: 0.9590990319925947
Energy: 0.8165215491822698
Energy: 0.838394567311607
Energy: 0.9285755666118745
Energy: 0.8383945673119664
Energy: 0.9285755666118745
Energy: 0.838394567311607
Energy: 0.9285755666118745
Energy: 0.9502731742207248
Energy: 0.8676301678664476
Energy: 0.9502731742211559
Energy: 0.8676301678656574
Energy: 0.9502731742207248
Energy: 0.8676301678664476
Energy: 0.8830370883112231
Energy: 0.815353981566364
Energy: 0.8830370883115823
Energy: 0.8153539815671542
Energy: 0.8830370883115823
Energy: 0.8153539815671542
Energy: 0.8484159361756856
Energy: 0.997092418919439
Energy: 0.8484159361768349
Energy: 0.9970924189178586
Energy: 0.8484159361756856
Energy: 0.9970924189186489
Energy: 0.8429978996152151
Energy: 1.2620336086425727
Energy: 0.8429978996152151
Energy: 1.2620336086422135
Energy: 0.8429978996144248
Energy: 1.2620336086425727
Energy: 0.8830328340197974
Energy: 0.8214208411444306
Energy: 0.8830328340197974
Energy: 0.8214208411452207
Energy: 0.8830328340202286
Energy: 0.821420841146011
Energy: 0.8142496211670922
Energy: 0.9596723683666549
Energy: 0.8142496211674513
Energy: 0.9596723683685945
Energy: 0.8142496211682415
Energy: 0.9596723683678042
Energy: 1.0022970753976927
Energy: 0.8380278570647066
Energy: 1.002297075398914
Energy: 0.8380278570650658
Energy: 1.0022970753992733
Energy: 0.8380278570650658
Energy: 0.8966243688446021
Energy: 0.9284495285762838
Energy: 0.8966243688453923
Energy: 0.9284495285762838
Energy: 0.8966243688446021
Energy: 0.9284495285762838
Energy: 0.8965494995997331
Energy: 0.9286109835651859
Energy: 0.8965494995985838
Energy: 0.9286109835639645
Energy: 0.8965494995997331
Energy: 0.9286109835647549
Energy: 1.0022493574181583
Energy: 0.8380473720311904
Energy: 1.0022493574189486
Energy: 0.8380473720319807
Energy: 1.0022493574181583
Energy: 0.8380473720315496
Energy: 0.8143123938274939
Energy: 0.9608834012584492
Energy: 0.8143123938274939
Energy: 0.9608834012580899
Energy: 0.8143123938274939
Energy: 0.9608834012584492
Energy: 0.8829894050899977
Energy: 0.8213203329328769
Energy: 0.8829894050895668
Energy: 0.821320332933308
Energy: 0.8829894050892074
Energy: 0.821320332933308
Energy: 0.8430016011865404
Energy: 1.262551551268611
Energy: 0.8430016011868996
Energy: 1.2625515512678207
Energy: 0.8430016011868996
Energy: 1.2625515512681802
Energy: 0.8484104876274629
Energy: 0.9972485199179946
Energy: 0.8484104876270318
Energy: 0.9972485199192159
Energy: 0.8484104876266726
Energy: 0.9972485199176354
Energy: 0.8830099156323428
Energy: 0.815138889878487
Energy: 0.8830099156319835
Energy: 0.8151388898788461
Energy: 0.8830099156323428
Energy: 0.8151388898780558
Energy: 0.950244078450066
Energy: 0.867885327431196
Energy: 0.950244078450066
Energy: 0.8678853274319862
Energy: 0.9502440784508561
Energy: 0.867885327431196
Energy: 0.8383664620187736
Energy: 0.9288743138839591
Energy: 0.8383664620183425
Energy: 0.9288743138828097
Energy: 0.8383664620175523
Energy: 0.9288743138843902
Energy: 0.9592476004559499
Energy: 0.8165244221662225
Energy: 0.9592476004559499
Energy: 0.8165244221657914
Energy: 0.9592476004555189
Energy: 0.8165244221662225
Energy: 0.8142979925740701
Energy: 0.9428885165308449
Energy: 0.81429799257328
Energy: 0.9428885165280431
Energy: 0.8142979925736392
Energy: 0.9428885165300547
Energy: 0.9266196183197934
Energy: 0.8163347039843165
Energy: 0.9266196183194343
Energy: 0.8163347039851068
Energy: 0.9266196183190033
Energy: 0.8163347039846757
Energy: 0.8190632710496939
Energy: 0.9548932388775475
Energy: 0.819063271050053
Energy: 0.9548932388783378
Energy: 0.819063271050053
Energy: 0.954893238875608

minimum gb energy = 0.8142496211670922 eV
minimum distance =  2.31837961091981 Angstroms
sigma value = 67


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

Energy: 0.8991995169599206
Energy: 0.8596824873818623
Energy: 0.8991995169599206
Energy: 0.8596824873818623
Energy: 0.8991995169625613
Energy: 0.8596824873818623
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 0.9328566927646047
Energy: 1.0739452529411486
Energy: 0.9328566927646047
Energy: 1.0739452529411486
Energy: 0.9328566927646047
Energy: 1.0739452529411486
Energy: 0.8852089105773456
Energy: 0.8489752700499964
Energy: 0.8852089105773456
Energy: 0.8489752700499964
Energy: 0.8852089105773456
Energy: 0.8489752700499964
Energy: 0.8991995169625613
Energy: 0.8596824873818623
Energy: 0.8991995169625613
Energy: 0.8596824873818623
Energy: 0.8991995169625613
Energy: 0.8596824873818623
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 0.885215749842977
Energy: 0.8489759696709673
Energy: 1.218156930104902
Energy: 1.0739452529411486
Energy: 0.9328566927672456
Energy: 1.0739452529411486
Energy: 0.9328566927672456
Energy: 1.0739452529411486

minimum gb energy = 0.8489752700499964 eV
minimum distance =  2.33766688370528 Angstroms
sigma value = 3


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

Energy: 1.2704015082775948
Energy: 1.0359287240817001
Energy: 1.2704015082775948
Energy: 1.0359287240817001
Energy: 1.2704015082775948
Energy: 1.0359287240817001
Energy: 1.0692769163703932
Energy: 1.0076358506802134
Energy: 1.0692769163703932
Energy: 1.0076358506802134
Energy: 1.0692769163703932
Energy: 1.0076358506802134
Energy: 1.0536873813275398
Energy: 1.0970751751470373
Energy: 1.0536873813275398
Energy: 1.0970751751470373
Energy: 1.0536873813275398
Energy: 1.0970751751470373
Energy: 1.048447112381757
Energy: 1.0245090418708562
Energy: 1.0484471123853503
Energy: 1.0245090418744496
Energy: 1.0484471123853503
Energy: 1.0245090418744496
Energy: 1.1254245417925135
Energy: 1.0698352404527587
Energy: 1.1254245417925135
Energy: 1.0698352404455718
Energy: 1.1254245417925135
Energy: 1.0698352404491653
Energy: 1.0129489440027561
Energy: 1.0736240380742228
Energy: 1.0129489440027561
Energy: 1.0736240380742228
Energy: 1.0129489440027561
Energy: 1.0736240380742228
Energy: 1.0765038759491492
Energy: 1.1068673983014434
Energy: 1.0765038759491492
Energy: 1.1068673983050368
Energy: 1.0765038759491492
Energy: 1.1068673983050368
Energy: 0.9902958900031541
Energy: 1.050965738743378
Energy: 0.9902958900031541
Energy: 1.050965738743378
Energy: 0.9902958900031541
Energy: 1.050965738743378
Energy: 1.0287856641435562
Energy: 1.0628242134448402
Energy: 1.0287856641435562
Energy: 1.0628242134448402
Energy: 1.0287856641435562
Energy: 1.0628242134412467
Energy: 1.0482014879376478
Energy: 1.0734319000899883
Energy: 1.0482014879376478
Energy: 1.0734319000899883
Energy: 1.0482014879376478
Energy: 1.0734319000899883
Energy: 1.0492194266722916
Energy: 1.1235723086804124
Energy: 1.0492194266722916
Energy: 1.1235723086804124
Energy: 1.0492194266722916
Energy: 1.1235723086804124
Energy: 1.0107460115281117
Energy: 1.0440559463312031
Energy: 1.0107460115281117
Energy: 1.084229854132256
Energy: 1.0107460115281117
Energy: 1.0544121770813513
Energy: 1.0415024688053323
Energy: 1.0216502917131152
Energy: 1.0415024688053323
Energy: 1.0216502917131152
Energy: 1.0415024688053323
Energy: 1.0216502917095216
Energy: 1.0444925650595396
Energy: 1.0427887777253806
Energy: 1.0444925650595396
Energy: 1.0427887777325675
Energy: 1.044492565063133
Energy: 1.0427887777289742
Energy: 1.0932641338824833
Energy: 1.0732735152209543
Energy: 1.093264133886077
Energy: 1.0732735152209543
Energy: 1.093264133886077
Energy: 1.0732735152209543
Energy: 1.0714716139922762
Energy: 1.033615473829568
Energy: 1.0714716139922762
Energy: 1.005311124627349
Energy: 1.0714716139958695
Energy: 1.005311124627349
Energy: 1.094204695034916
Energy: 0.9947291444167444
Energy: 1.094204695034916
Energy: 0.9947291444167444
Energy: 1.094204695034916
Energy: 0.9947291444167444
Energy: 1.0278601241581447
Energy: 1.0679115023545833
Energy: 1.0278601241581447
Energy: 1.0679115023545833
Energy: 1.0278601241581447
Energy: 1.0679115023545833
Energy: 1.0755597956413316
Energy: 1.0737237465087175
Energy: 1.0755597956413316
Energy: 1.0737237465087175
Energy: 1.0755597956413316
Energy: 1.0737237465087175
Energy: 1.0110188860639897
Energy: 1.0492375361291015
Energy: 1.0110188860639897
Energy: 1.0492375361291015
Energy: 1.0110188860639897
Energy: 1.0492375361291015
Energy: 1.085098564531332
Energy: 1.0755595223863332
Energy: 1.085098564531332
Energy: 1.0755595223863332
Energy: 1.085098564531332
Energy: 1.0755595223863332
Energy: 0.989656721292499
Energy: 1.1190601196151149
Energy: 0.989656721292499
Energy: 1.1190601196151149
Energy: 0.989656721292499
Energy: 1.1190601196151149
Energy: 1.0485647016403028
Energy: 1.005957936374197
Energy: 1.0485647016403028
Energy: 1.005957936374197
Energy: 1.0485647016403028
Energy: 1.005957936374197
Energy: 1.0001085387136164
Energy: 1.040846681736797
Energy: 1.0001085387136164
Energy: 1.040846681736797
Energy: 1.0001085387136164
Energy: 1.040846681736797
Energy: 1.027239021142667
Energy: 1.0753739871849493
Energy: 1.0272390211534475
Energy: 1.0753739871849493
Energy: 1.0272390211498539
Energy: 1.0753739871849493
Energy: 1.0214757942894233
Energy: 1.0847863363038048
Energy: 1.0214757942930168
Energy: 1.0847863363073984
Energy: 1.0214757942930168
Energy: 1.0847863363073984
Energy: 1.082154204509596
Energy: 1.044095057365427
Energy: 1.082154204509596
Energy: 1.044095057365427
Energy: 1.0821542045060024
Energy: 1.044095057365427
Energy: 1.0169304315655272
Energy: 0.9783139338946426
Energy: 1.0169304315655272
Energy: 0.9783139338946426
Energy: 1.0169304315655272
Energy: 0.9783139338946426
Energy: 1.034625559386698
Energy: 0.9947409110163432
Energy: 1.034625559386698
Energy: 0.9947409110163432
Energy: 1.034625559386698
Energy: 0.9947409110163432
Energy: 1.1052024538073826
Energy: 1.0210375693383542
Energy: 1.105202453810976
Energy: 1.0210375693383542
Energy: 1.105202453810976
Energy: 1.0210375693383542
Energy: 1.1180160075088952
Energy: 0.9968102707272699
Energy: 1.1180160075088952
Energy: 0.9968102707272699
Energy: 1.1180160075088952
Energy: 0.9968102707272699
Energy: 1.0466405664312135
Energy: 0.993735886122917
Energy: 1.0466405664312135
Energy: 0.993735886122917
Energy: 1.0466405664312135
Energy: 0.993735886122917
Energy: 1.0287691267755867
Energy: 1.0109262774565384
Energy: 1.0287691267755867
Energy: 1.0109262774529446
Energy: 1.02876912677918
Energy: 1.0109262774529446
Energy: 1.0856045035022173
Energy: 1.0734090762931596
Energy: 1.0856045035022173
Energy: 1.0734090762931596
Energy: 1.0856045035022173
Energy: 1.0734090762931596
Energy: 1.066058774101728
Energy: 1.0448807283777013
Energy: 1.066058774101728
Energy: 1.0448807283777013
Energy: 1.066058774101728
Energy: 1.0448807283777013
Energy: 1.0544226718742575
Energy: 1.0739390026813511
Energy: 1.0544226718742575
Energy: 1.0739390026813511
Energy: 1.0544226718742575
Energy: 1.0739390026813511
Energy: 0.9855533478074153
Energy: 1.085742880255714
Energy: 0.9855533478074153
Energy: 1.0857428802521205
Energy: 0.9855533478074153
Energy: 1.085742880255714
Energy: 1.0932868067317614
Energy: 1.0276890202271813
Energy: 1.093286806735355
Energy: 1.0276890202271813
Energy: 1.093286806728168
Energy: 1.0276890202271813
Energy: 0.9945204294872313
Energy: 1.1082704246124648
Energy: 0.9945204294872313
Energy: 1.1082704246124648
Energy: 0.9945204294872313
Energy: 1.1082704246124648
Energy: 1.1119187203312528
Energy: 1.0740604784506738
Energy: 1.1119187203312528
Energy: 1.0740604784506738
Energy: 1.1119187203312528
Energy: 1.0740604784506738
Energy: 1.0129880643579663
Energy: 1.0943027628310555
Energy: 1.0129880643579663
Energy: 1.0943027628346491
Energy: 1.0129880643579663
Energy: 1.0943027628346491
Energy: 1.1485797721060482
Energy: 0.9829730072072338
Energy: 1.1485797721060482
Energy: 0.9829730072072338
Energy: 1.1485797720952677
Energy: 0.9829730072072338
Energy: 1.000803429343357
Energy: 1.088742508190639
Energy: 1.000803429343357
Energy: 1.088742508190639
Energy: 1.000803429343357
Energy: 1.0887425081942324
Energy: 1.0777085715112866
Energy: 0.9933538794585046
Energy: 1.0777085715112866
Energy: 0.9933538794585046
Energy: 1.0777085715112866
Energy: 0.9933538794585046
Energy: 1.0723831839906317
Energy: 1.0858847716695332
Energy: 1.0723831839870381
Energy: 1.0858847716695332
Energy: 1.0723831839906317
Energy: 1.0858847716695332
Energy: 1.1445672380126282
Energy: 0.9984508187285587
Energy: 1.1445672380126282
Energy: 0.9984508187285587
Energy: 1.1445672380162217
Energy: 0.9984508187285587
Energy: 1.029781211292108
Energy: 1.0426890235408783
Energy: 1.029781211292108
Energy: 1.0426890235408783
Energy: 1.029781211292108
Energy: 1.0426890235408783
Energy: 1.0585016561205154
Energy: 0.9985930241725588
Energy: 1.0585016561205154
Energy: 0.9985930241725588
Energy: 1.058501656116922
Energy: 0.9985930241725588
Energy: 1.0129001526446044
Energy: 1.0893425775476715
Energy: 1.0129001526446044
Energy: 1.0893425775476715
Energy: 1.0129001526446044
Energy: 1.089342577551265
Energy: 1.0809875804896365
Energy: 1.0491000863102506
Energy: 1.0809875804896365
Energy: 1.0491000863066573
Energy: 1.0809875804896365
Energy: 1.0491000863102506
Energy: 1.0251218533364268
Energy: 1.088968688072928
Energy: 1.0251218533364268
Energy: 1.088968688072928
Energy: 1.0251218533364268
Energy: 1.0889686880693346

minimum gb energy = 0.9783139338946426 eV
minimum distance =  2.25053005421528 Angstroms
sigma value = 81


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

Energy: 1.1402812886647335
Energy: 1.0385471984791226
Energy: 1.084440987688766
Energy: 1.0385471984786292
Energy: 1.1402812886647335
Energy: 1.0385471984810952
Energy: 1.0187378322048057
Energy: 0.9901855552560818
Energy: 1.018737832203326
Energy: 0.9901855552560818
Energy: 1.0187378322048057
Energy: 0.9901855552550953
Energy: 1.1299546266641125
Energy: 1.1010938086910915
Energy: 1.130453891074861
Energy: 1.1010938086905986
Energy: 1.1299546266636193
Energy: 1.1010938086891189
Energy: 1.0056944154000864
Energy: 1.0959107047132326
Energy: 1.0056944153956475
Energy: 1.0959107047132326
Energy: 1.005694415401566
Energy: 1.0959107047112597
Energy: 1.0661036294038486
Energy: 1.034662406046998
Energy: 1.0661036294033557
Energy: 1.034662406046998
Energy: 1.0661036294033557
Energy: 1.0346624060460117
Energy: 0.9939849547292225
Energy: 0.9490556006127451
Energy: 0.9939849547297157
Energy: 0.9490556006122518
Energy: 0.9939849547292225
Energy: 0.949055600610279
Energy: 0.9373061000828968
Energy: 0.9524986056206364
Energy: 0.9373061000819104
Energy: 0.9524986056211295
Energy: 0.9373061000819104
Energy: 0.9524986056240888
Energy: 0.9903148845929886
Energy: 0.9943304375442306
Energy: 0.9903146102249513
Energy: 0.9943304375457103
Energy: 0.9903148845934818
Energy: 0.9943304375417644
Energy: 1.17973219618981
Energy: 1.073241653237681
Energy: 1.179732196187344
Energy: 1.0732416532366946
Energy: 1.1797321961893168
Energy: 1.0732416532371878
Energy: 1.1196939841769857
Energy: 1.2248689068191132
Energy: 1.119693984177972
Energy: 1.224868906820593
Energy: 1.1196939841769857
Energy: 1.2248689068225656
Energy: 1.0172398616496612
Energy: 1.0013237109917077
Energy: 1.0172398616481817
Energy: 1.0013237109917077
Energy: 1.017239861649168
Energy: 1.0013237109907211
Energy: 0.9492652967201326
Energy: 0.9905144458168302
Energy: 0.9492652967201326
Energy: 0.9905144458168302
Energy: 0.9492652967201326
Energy: 0.990514445811405
Energy: 1.0193169650781704
Energy: 0.9923564499283037
Energy: 1.0193169650811296
Energy: 0.9923564499283037
Energy: 1.0193169650781704
Energy: 0.9923564499312629
Energy: 1.0802753610947526
Energy: 0.9501367342998178
Energy: 1.0802753610947526
Energy: 0.9501367342998178
Energy: 1.0802753610947526
Energy: 0.9501367343008041
Energy: 1.0987895571361574
Energy: 0.9875421960315731
Energy: 1.098789557137144
Energy: 0.9875421960310798
Energy: 1.0987895571356645
Energy: 0.9875421960325595
Energy: 0.990090053708509
Energy: 0.95462963888894
Energy: 0.9900900537090022
Energy: 0.95462963888894
Energy: 0.990090053708509
Energy: 0.9546296388894332
Energy: 1.068022226612771
Energy: 0.9499005914227296
Energy: 1.0680222266137573
Energy: 0.9499005914232229
Energy: 1.068022226612771
Energy: 0.9499005914256888
Energy: 1.0146861353090766
Energy: 1.0766014003878164
Energy: 1.0146946517408455
Energy: 1.0766014003883098
Energy: 1.0146861353090766
Energy: 1.0766014003853506
Energy: 1.0987693535988299
Energy: 1.0010517466530404
Energy: 1.098769353599323
Energy: 1.001051746652054
Energy: 1.0987693535983365
Energy: 1.0010517466495878
Energy: 1.0937103771810204
Energy: 1.1341179195365194
Energy: 1.093710377184966
Energy: 1.1341179195370126
Energy: 1.0937103771825
Energy: 1.1341179195389852
Energy: 0.995847182117344
Energy: 0.9932088679918557
Energy: 0.9958471821188235
Energy: 0.9932088679918557
Energy: 0.9958471821168506
Energy: 0.9932088679943217
Energy: 1.0174500757413276
Energy: 1.0016137294330927
Energy: 0.9489420048883849
Energy: 1.0016137294335856
Energy: 1.0174500757408342
Energy: 1.0016137294325993
Energy: 1.0177200884182633
Energy: 0.937602583982875
Energy: 0.9490952211606473
Energy: 0.9376025839833683
Energy: 1.0177200884187565
Energy: 0.9376025839873138
Energy: 1.0612585831356371
Energy: 1.0801033030361924
Energy: 1.0612585831346508
Energy: 1.0801033030356992
Energy: 1.0612585831361303
Energy: 1.0801033030356992
Energy: 1.072485650985263
Energy: 1.1526169802888435
Energy: 1.072485650985263
Energy: 1.1526169802883506
Energy: 1.072485650985263
Energy: 1.1526169802908166
Energy: 1.0984622066434535
Energy: 1.280700925886798
Energy: 1.0984622066444398
Energy: 1.2807009258872915
Energy: 1.0984622066434535
Energy: 1.2807009258872915
Energy: 1.0146046938200808
Energy: 1.013563911300027
Energy: 1.0146046938195874
Energy: 1.013563911300027
Energy: 1.0146046938200808
Energy: 1.0135639112980541
Energy: 1.0497414281481818
Energy: 0.9498808666322159
Energy: 1.0497414281481818
Energy: 0.9498808666322159
Energy: 1.0497414281481818
Energy: 0.9498808666287637
Energy: 0.9902216273338237
Energy: 1.0191929578211691
Energy: 0.9902182785753624
Energy: 1.0191929578206762
Energy: 0.9902216273338237
Energy: 1.0191929578206762
Energy: 1.046828753027961
Energy: 0.988571089230474
Energy: 1.0468287530309202
Energy: 0.988571089230474
Energy: 1.0468287530289473
Energy: 0.9885710892270217
Energy: 1.1001973867342103
Energy: 1.0983416513665956
Energy: 1.10019738673569
Energy: 1.0983416513665956
Energy: 1.1001973867342103
Energy: 1.098341651365609
Energy: 0.9533815044177725
Energy: 1.0802565754118922
Energy: 0.9533815044202386
Energy: 1.0802565754104128
Energy: 0.9533815044187589
Energy: 1.0802565754074536
Energy: 0.9492905319528288
Energy: 0.9934281853081062
Energy: 0.9492905319523356
Energy: 0.9934281853085993
Energy: 0.9492905319523356
Energy: 0.9934281853105721
Energy: 0.9489945445558656
Energy: 0.9351390411438092
Energy: 0.9489945445548792
Energy: 0.9351390411438092
Energy: 0.9489945445558656
Energy: 0.9351390411462752
Energy: 1.1304152731341008
Energy: 1.2249475803789371
Energy: 1.130486235935894
Energy: 1.2249475803784442
Energy: 1.130415273134594
Energy: 1.2249475803789371
Energy: 1.158716953299048
Energy: 1.0968632121099422
Energy: 1.1587169532980617
Energy: 1.0968632121084625
Energy: 1.1587169532985548
Energy: 1.0968632121079693
Energy: 0.9904554423979065
Energy: 1.0215782785737562
Energy: 0.9904554423983996
Energy: 1.0215782785727696
Energy: 0.9904554423979065
Energy: 1.0215782785688239
Energy: 1.0030180389210668
Energy: 0.9525340105468721
Energy: 1.0030180389190941
Energy: 0.9525340105468721
Energy: 1.0030180389210668
Energy: 0.9525340105493382

minimum gb energy = 0.9351390411438092 eV
minimum distance =  2.3614945014525 Angstroms
sigma value = 43


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

Energy: 1.2558828892109744
Energy: 1.0165853953722197
Energy: 1.2558828892109744
Energy: 1.0165853953722197
Energy: 1.2558828892103684
Energy: 1.0165853953728257
Energy: 1.0477346881457967
Energy: 0.9634464932353276
Energy: 1.047734688145191
Energy: 0.9634464932353276
Energy: 1.0477346881457967
Energy: 0.9634464932353276
Energy: 1.1335815753541891
Energy: 1.1523394418040613
Energy: 1.1335815753541891
Energy: 1.1523394418040613
Energy: 1.133581575354795
Energy: 1.1523394418040613
Energy: 0.960685128993867
Energy: 0.9979907904605024
Energy: 0.960685128993867
Energy: 0.9979907904605024
Energy: 0.960685128993867
Energy: 0.9979907904605024
Energy: 1.1036675594700573
Energy: 1.0365939554840422
Energy: 1.1036675594700573
Energy: 1.0365939554828307
Energy: 1.1036675594700573
Energy: 1.0365939554840422
Energy: 0.991215153774967
Energy: 1.0353412656758216
Energy: 0.9912151537761787
Energy: 1.0353412656758216
Energy: 0.991215153774967
Energy: 1.0353412656758216
Energy: 1.04608521000067
Energy: 1.0849272782836827
Energy: 1.0460852100018816
Energy: 1.0849272782836827
Energy: 1.0460852100018816
Energy: 1.0849272782836827
Energy: 0.9935377413485581
Energy: 1.0370069869450664
Energy: 0.993537741349164
Energy: 1.037006986943855
Energy: 0.9935377413485581
Energy: 1.037006986943855
Energy: 1.1161929794152095
Energy: 0.949528857468326
Energy: 1.1161929794152095
Energy: 0.949528857468326
Energy: 1.116192979416421
Energy: 0.9495288574677202
Energy: 1.0040156381410241
Energy: 1.0338858881284374
Energy: 1.0040156381410241
Energy: 1.0338858881290431
Energy: 1.0040156381410241
Energy: 1.0338858881290431
Energy: 1.0382699245803317
Energy: 0.9745926201962045
Energy: 1.0382699245803317
Energy: 0.9745926201968101
Energy: 1.0382699245803317
Energy: 0.9745926201962045
Energy: 0.9935107284315245
Energy: 1.0260426942493326
Energy: 0.9935107284321303
Energy: 1.0260426942487266
Energy: 0.9935107284321303
Energy: 1.0260426942517558
Energy: 1.114860969507407
Energy: 1.035621479532302
Energy: 1.1148609695080127
Energy: 1.0356214795316963
Energy: 1.1148609695080127
Energy: 1.0356214795316963
Energy: 0.9520221166441202
Energy: 1.1364887315276673
Energy: 0.952022116644726
Energy: 1.1364887315270613
Energy: 0.9520221166441202
Energy: 1.1364887315270613
Energy: 1.0556792984308914
Energy: 1.039850812918669
Energy: 1.0556792984314969
Energy: 1.039850812918669
Energy: 1.0556792984308914
Energy: 1.039850812918669
Energy: 1.0081584950909395
Energy: 1.0741832886303249
Energy: 1.0081584950915452
Energy: 1.0741832886309304
Energy: 1.0081584950915452
Energy: 1.0741832886303249
Energy: 1.048846618739029
Energy: 0.9640425853338076
Energy: 1.048846618738423
Energy: 0.9640425853338076
Energy: 1.048846618739029
Energy: 0.9640425853338076
Energy: 1.1001168326272306
Energy: 1.0070170660703268
Energy: 1.1001168326272306
Energy: 1.0070170660709328
Energy: 1.1001168326272306
Energy: 1.0070170660709328
Energy: 1.1003735035333297
Energy: 0.9780918882321744
Energy: 1.1003735035333297
Energy: 0.9780918882327801
Energy: 1.1003735035333297
Energy: 0.9780918882327801
Energy: 1.0486438086867473
Energy: 0.9641101747682347
Energy: 1.0486438086861416
Energy: 0.9641101747682347
Energy: 1.0486438086849301
Energy: 0.9641101747682347
Energy: 1.0078912586470192
Energy: 1.0244143174671334
Energy: 1.0078912586470192
Energy: 1.0244143174677394
Energy: 1.0078912586470192
Energy: 1.0244143174677394
Energy: 1.0959104058336877
Energy: 1.0817355560599107
Energy: 1.0959104058336877
Energy: 1.0817355560599107
Energy: 1.0959104058342937
Energy: 1.0817355560599107
Energy: 0.9520229056886956
Energy: 1.0634491369122174
Energy: 0.9520229056886956
Energy: 1.063449136911612
Energy: 0.9520229056880898
Energy: 1.0634491369122174
Energy: 1.081062083633603
Energy: 1.0360166886530306
Energy: 1.081062083632391
Energy: 1.0360166886530306
Energy: 1.0810620836317855
Energy: 1.0360166886530306
Energy: 0.9937491120987441
Energy: 0.9909901478034885
Energy: 0.9937491120987441
Energy: 0.9909901478034885
Energy: 0.9937491120987441
Energy: 0.9909901478040942
Energy: 1.0974238955242455
Energy: 1.0432065643849135
Energy: 1.0974238955242455
Energy: 1.0432065643843076
Energy: 1.097423895524851
Energy: 1.0432065643843076
Energy: 1.0566168209701743
Energy: 0.9629354168345268
Energy: 1.0566168209695683
Energy: 0.9629354168345268
Energy: 1.0368580037146011
Energy: 0.9629354168345268
Energy: 1.0476304779884558
Energy: 0.9505378732954815
Energy: 1.047630477990879
Energy: 0.9505378732948757
Energy: 1.0476304779926964
Energy: 0.9505378732948757
Energy: 0.9936834589109735
Energy: 1.0370560525600296
Energy: 0.9936834589109735
Energy: 1.0370560525600296
Energy: 0.9936834589109735
Energy: 1.037056052559424
Energy: 1.044071255189686
Energy: 1.073585092853832
Energy: 1.0440712551890803
Energy: 1.073585092853832
Energy: 1.044071255189686
Energy: 1.073585092853832
Energy: 0.9912712781006265
Energy: 1.0352905157270904
Energy: 0.9912712781006265
Energy: 1.0352905157270904
Energy: 0.9912712781012322
Energy: 1.0352905157270904

minimum gb energy = 0.9495288574677202 eV
minimum distance =  2.30105225375226 Angstroms
sigma value = 57


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

Energy: 1.2397987825361727
Energy: 1.0092330580268247
Energy: 1.0702742400009515
Energy: 1.0092330580283937
Energy: 1.2397987825361727
Energy: 1.0092330580283937
Energy: 1.0942681054084669
Energy: 0.9650961091104956
Energy: 1.0942681054061139
Energy: 0.9650961091104956
Energy: 1.094268105406898
Energy: 0.9650961091104956
Energy: 1.1151569716247922
Energy: 1.1053903781807626
Energy: 1.115431365007537
Energy: 1.1053903781799783
Energy: 1.1151569716247922
Energy: 1.1053903781799783
Energy: 0.9787613139324031
Energy: 1.0585816742176193
Energy: 0.9787613139316185
Energy: 1.0585816742199723
Energy: 0.9787613139292654
Energy: 1.0585816742199723
Energy: 1.1044206465247963
Energy: 1.0221157743351201
Energy: 1.1044206465240118
Energy: 1.0221157743335514
Energy: 1.1044206465247963
Energy: 1.0221157743335514
Energy: 1.1606639685849938
Energy: 0.948496310663389
Energy: 1.160663968587347
Energy: 0.9484963106657422
Energy: 1.160663968585778
Energy: 0.9484963106657422
Energy: 1.0703655027488617
Energy: 1.1768576862484985
Energy: 1.0703655027488617
Energy: 1.1768576862524205
Energy: 1.0703655027488617
Energy: 1.1768576862516358
Energy: 0.9788136204969712
Energy: 1.0275800303464184
Energy: 0.9788136204977554
Energy: 1.0275800303479874
Energy: 0.9788136204977554
Energy: 1.0275800303479874
Energy: 1.1228937842174744
Energy: 0.9654952820763091
Energy: 1.1228937842166902
Energy: 0.9654952820755247
Energy: 1.1228937842190432
Energy: 0.9654952820763091
Energy: 0.9772429953476344
Energy: 0.9950042578747831
Energy: 0.9771865090709458
Energy: 0.9950042578755675
Energy: 0.9772429953460657
Energy: 0.9950042578771362
Energy: 1.033259635113565
Energy: 1.059573848778125
Energy: 1.033259635113565
Energy: 1.0595738487836157
Energy: 1.0332596351112118
Energy: 1.0595738487836157
Energy: 1.0643616055414613
Energy: 1.1242215726263198
Energy: 1.0643616055406768
Energy: 1.1242215726255353
Energy: 1.0643616055422456
Energy: 1.1242215726255353
Energy: 1.1071254224707743
Energy: 0.9665533043702415
Energy: 1.107125422472343
Energy: 0.9665533043733788
Energy: 1.10712542246999
Energy: 0.9665533043725946
Energy: 1.0686521093734733
Energy: 0.9744066929837027
Energy: 1.0163478961513797
Energy: 0.9744066929868404
Energy: 1.0686521093711203
Energy: 0.9744066929868404
Energy: 1.1131225887242389
Energy: 0.9705333185611462
Energy: 1.0156231012996766
Energy: 0.9705333185603975
Energy: 1.1131225887234544
Energy: 0.9705333185596129
Energy: 1.1251820550592175
Energy: 1.1523236538511046
Energy: 1.1251820550592175
Energy: 1.1523236538495358
Energy: 1.125182055058433
Energy: 1.1523236538495358
Energy: 0.9771588658182083
Energy: 0.9937959459258627
Energy: 0.9771783883847371
Energy: 0.9937959459227251
Energy: 0.977158865817424
Energy: 0.9937959459227251
Energy: 1.030784411322467
Energy: 0.9950091942344834
Energy: 1.0307844113240356
Energy: 1.0877275373517694
Energy: 1.0307844113279576
Energy: 1.0877275373517694
Energy: 0.9767225055723509
Energy: 0.9942608235995104
Energy: 0.9767225055739196
Energy: 0.9942608236018635
Energy: 0.9767225055715664
Energy: 0.994260823601079
Energy: 1.0312414294073051
Energy: 1.1521421423160616
Energy: 1.031241429408874
Energy: 1.1521421423176306
Energy: 1.031241429408874
Energy: 1.152142142316846
Energy: 1.0155896427023534
Energy: 0.9717141466083724
Energy: 1.0155896427000004
Energy: 0.97171414661151
Energy: 1.0155896427007847
Energy: 0.97171414661151
Energy: 1.135003601171645
Energy: 1.0340870927443957
Energy: 1.1350036011724294
Energy: 1.0708853581440605
Energy: 1.1350036011732136
Energy: 1.070885358144845
Energy: 1.1180494574658817
Energy: 0.9651069860540606
Energy: 1.1172634634075524
Energy: 0.9651069860548451
Energy: 1.1180494574650974
Energy: 0.9651069860548451
Energy: 1.0739994374633188
Energy: 1.1529209535778528
Energy: 1.0613678723273408
Energy: 1.1529209535778528
Energy: 1.073999437464103
Energy: 1.1529209535778528

minimum gb energy = 0.948496310663389 eV
minimum distance =  2.2299660774241 Angstroms
sigma value = 17


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

Energy: 1.028428345497943
Energy: 0.9014030551486037
Energy: 1.028428345496834
Energy: 0.9014030551486037
Energy: 1.0284283454957246
Energy: 0.9014030551486037
Energy: 0.8724888762528129
Energy: 0.8516454026335166
Energy: 0.8724888762528129
Energy: 0.8516454026335166
Energy: 0.8724888762517036
Energy: 0.8516454026335166
Energy: 0.9929355594543744
Energy: 1.0087475806527173
Energy: 0.9929355594510465
Energy: 1.008747580651608
Energy: 0.9929355594499372
Energy: 1.008747580651608
Energy: 0.8197035299408468
Energy: 0.9844430442239293
Energy: 0.8197035299408468
Energy: 0.9844430442239293
Energy: 0.8197035299397375
Energy: 0.9844430442239293
Energy: 1.0109991149583895
Energy: 0.9436269823632784
Energy: 1.0109991149606081
Energy: 0.9436269823632784
Energy: 1.0109991149617177
Energy: 0.9436269823654969
Energy: 0.9194623871609809
Energy: 0.985785400697482
Energy: 0.9194623871609809
Energy: 0.985785400697482
Energy: 0.9194623871609809
Energy: 0.985785400697482
Energy: 0.8196865820512375
Energy: 0.8797611523870253
Energy: 0.8196865820512375
Energy: 0.8797611523881346
Energy: 0.8196865820501281
Energy: 0.8797611523870253
Energy: 0.81955920527285
Energy: 0.9826943707920118
Energy: 0.8195592052717408
Energy: 0.982694370793121
Energy: 0.81955920527285
Energy: 0.982694370793121
Energy: 0.9607621277064825
Energy: 0.8511443023485235
Energy: 0.9607621277064825
Energy: 0.8511443023485235
Energy: 0.9607621277053733
Energy: 0.8511443023485235
Energy: 0.9272243399695114
Energy: 0.874622985614503
Energy: 0.927224339968402
Energy: 0.874622985614503
Energy: 0.927224339968402
Energy: 0.874622985614503
Energy: 0.9090695282256863
Energy: 0.9958645303955658
Energy: 0.9090695282267957
Energy: 0.9958645303955658
Energy: 0.9090695282256863
Energy: 0.9958645303955658
Energy: 0.961395572032201
Energy: 0.8513694077907921
Energy: 0.9613955720344195
Energy: 0.8513694077907921
Energy: 0.961395572035529
Energy: 0.8513694077907921
Energy: 0.819342727655791
Energy: 0.9891131164858558
Energy: 0.8193427276546817
Energy: 0.9891131164858558
Energy: 0.8193427276546817
Energy: 0.9891131164858558
Energy: 0.9271756501007985
Energy: 0.9863889824749664
Energy: 0.9271756501007985
Energy: 0.9863889824749664
Energy: 0.9271756501007985
Energy: 0.9863889824749664
Energy: 0.9187812189148035
Energy: 0.9685860453870401
Energy: 0.9187812189148035
Energy: 0.9685860453859307
Energy: 0.9187812189159128
Energy: 0.9685860453859307
Energy: 0.9184429918341249
Energy: 0.9859081186950849
Energy: 0.9184429918330156
Energy: 0.9859081186950849
Energy: 0.9184429918341249
Energy: 0.985908118696194
Energy: 0.9250744300807987
Energy: 0.9858243636113984
Energy: 0.9250744300807987
Energy: 0.9858243636113984
Energy: 0.9250744300807987
Energy: 0.9858243636125077

minimum gb energy = 0.8193427276546817 eV
minimum distance =  2.29665896032961 Angstroms
sigma value = 17


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

Energy: 0.9409149551337184
Energy: 0.8357949297036783
Energy: 0.9409149551328616
Energy: 0.8357949297036783
Energy: 0.9409149551332899
Energy: 0.8357949297041067
Energy: 0.8452219843778074
Energy: 0.8003845868717476
Energy: 0.8452219843778074
Energy: 0.8003845868717476
Energy: 0.8452219843786641
Energy: 0.8003845868713193
Energy: 0.9274427846103318
Energy: 0.891774566015796
Energy: 0.9274427846103318
Energy: 0.8917745660162242
Energy: 0.9274427846099034
Energy: 0.8917745660166527
Energy: 0.7713710994961804
Energy: 0.8916654345304312
Energy: 0.771371099495752
Energy: 0.8916654345321448
Energy: 0.7713710994966088
Energy: 0.8916654345342865
Energy: 0.9682091168894531
Energy: 0.7999575621376159
Energy: 0.9682091168890247
Energy: 0.7999575621380443
Energy: 0.9682091168898816
Energy: 0.7999575621376159
Energy: 0.888499998189977
Energy: 0.8747266832419794
Energy: 0.888499998189977
Energy: 0.8747266832415511
Energy: 0.8884999981904054
Energy: 0.8747266832428363
Energy: 0.8496711035538244
Energy: 0.8347113781680867
Energy: 0.8496711035529678
Energy: 0.8347113781663732
Energy: 0.8496711035538244
Energy: 0.8347113781668015
Energy: 0.8435247025298014
Energy: 0.8770767312295079
Energy: 0.8435247025319433
Energy: 0.8770767312269376
Energy: 0.8435247025306583
Energy: 0.8770767312175135
Energy: 0.8729588087651439
Energy: 0.8834355183496362
Energy: 0.8729588087660006
Energy: 0.8834355183521675
Energy: 0.8729588087655722
Energy: 0.8834355183509214
Energy: 0.8479767577155451
Energy: 0.7666817712152477
Energy: 0.8479767577155451
Energy: 0.7666817712148194
Energy: 0.8479767577164018
Energy: 0.7666817712148194
Energy: 0.7718526290475568
Energy: 0.889169272572207
Energy: 0.7718526290475568
Energy: 0.8891692725734922
Energy: 0.7718526290484136
Energy: 0.8891692725704935
Energy: 0.9219967482246705
Energy: 0.8095756610866898
Energy: 0.921996748224242
Energy: 0.8095756610875464
Energy: 0.921996748224242
Energy: 0.809575661087975
Energy: 0.8514254221509457
Energy: 0.8179252205356012
Energy: 0.8514254221505172
Energy: 0.8179252205351728
Energy: 0.8514254221505172
Energy: 0.8179252205351728
Energy: 0.835498299553948
Energy: 0.9297922400958364
Energy: 0.835498299553948
Energy: 0.9297922400962649
Energy: 0.8354982995543764
Energy: 0.9297922400962649
Energy: 0.8960644265631061
Energy: 0.8087896468411394
Energy: 0.8960644265618598
Energy: 0.8087896468415677
Energy: 0.8960644265639628
Energy: 0.8087896468424245
Energy: 0.7701670559095465
Energy: 0.8757281456547861
Energy: 0.7701670559095465
Energy: 0.8757281456552144
Energy: 0.7701670559099749
Energy: 0.8757281456547861
Energy: 0.85104701974215
Energy: 0.869949110303323
Energy: 0.8510470197430067
Energy: 0.8699491103037514
Energy: 0.851047019745577
Energy: 0.869949110303323
Energy: 0.8740047548998467
Energy: 1.0537728263137855
Energy: 0.87400475489899
Energy: 1.0537728263137855
Energy: 0.8740047549007035
Energy: 1.0537728263137855
Energy: 0.8423309634258012
Energy: 0.8767958041554091
Energy: 0.8423309634228024
Energy: 0.8767958041545524
Energy: 0.8423309634219457
Energy: 0.8767958041558376
Energy: 0.8496141909537241
Energy: 0.7790541001457427
Energy: 0.8496141909541525
Energy: 0.7790541001470279
Energy: 0.8496141909545808
Energy: 0.9317803882405656
Energy: 0.8421853235283638
Energy: 0.8764053255301079
Energy: 0.8421853235266503
Energy: 0.8764053255339631
Energy: 0.8421853235253651
Energy: 0.876405325517724
Energy: 0.8739894288294126
Energy: 1.0537696649599668
Energy: 0.8739894288273097
Energy: 1.0537696649595385
Energy: 0.8739894288285559
Energy: 1.0537696649599668
Energy: 0.8510042767234632
Energy: 0.8697482086398074
Energy: 0.8510042767230348
Energy: 0.8697482086398074
Energy: 0.851004276722178
Energy: 0.8697482086398074
Energy: 0.7701563979048096
Energy: 0.9488847572919176
Energy: 0.7701563979043812
Energy: 0.948884757291489
Energy: 0.7701563979048096
Energy: 0.9488847572919176
Energy: 0.8959936630019886
Energy: 0.8086664033250043
Energy: 0.8959936629989901
Energy: 0.808666403324576
Energy: 0.8959936629998466
Energy: 0.8086664033254326
Energy: 0.8354841848812112
Energy: 0.9296566503773024
Energy: 0.8354841848812112
Energy: 0.9296566503773024
Energy: 0.8354841848812112
Energy: 0.9296566503773024
Energy: 0.8515400466391639
Energy: 0.817935953881943
Energy: 0.8515400466387354
Energy: 0.8179359538823713
Energy: 0.851540046638307
Energy: 0.817935953881943
Energy: 0.9220284574908901
Energy: 0.8096393381045128
Energy: 0.9220284574900336
Energy: 0.8096393381036561
Energy: 0.9220284574891766
Energy: 0.8096393381045128
Energy: 0.7716861766596673
Energy: 0.9008332958962626
Energy: 0.7716861766600568
Energy: 0.9008332958932641
Energy: 0.7716861766600568
Energy: 0.9008332958941206
Energy: 0.8480426128719757
Energy: 0.7663500001811829
Energy: 0.848042612872404
Energy: 0.7663500001807546
Energy: 0.8480426128715471
Energy: 0.7663500001807546
Energy: 0.8730434124426065
Energy: 0.8837134404398845
Energy: 0.873043412443035
Energy: 0.8837134404398845
Energy: 0.8730434124434634
Energy: 0.8837134404407413
Energy: 0.8435585151530623
Energy: 0.8778619904890264
Energy: 0.8435585151594877
Energy: 0.8778619904881696
Energy: 0.843558515158631
Energy: 0.8778619904885979
Energy: 0.8494245309198499
Energy: 0.8345587750027239
Energy: 0.8494245309202785
Energy: 0.8345587750031523
Energy: 0.8494245309202785
Energy: 0.8345587750044374
Energy: 0.8879288735742817
Energy: 0.8147872564552139
Energy: 0.8879288735742817
Energy: 0.8147872564552139
Energy: 0.8879288735742817
Energy: 0.8147872564552139
Energy: 0.9681118355987786
Energy: 0.8000028336296124
Energy: 0.9681118355983501
Energy: 0.8000028336296124
Energy: 0.9681118355983501
Energy: 0.8000028336296124
Energy: 0.7719164449530869
Energy: 0.8828095136444984
Energy: 0.7719164449535153
Energy: 0.8828095136436419
Energy: 0.7719164449526585
Energy: 0.8828095136440701
Energy: 0.927424414662573
Energy: 0.8917774666204394
Energy: 0.9274244146621448
Energy: 0.8917774666204394
Energy: 0.9274244146621448
Energy: 0.891777466620011
Energy: 0.8450641092777491
Energy: 0.7986462475514042
Energy: 0.8450641092790343
Energy: 0.798646247552261
Energy: 0.845064109276464
Energy: 0.798646247552261
Energy: 0.9409149551362886
Energy: 0.8357949297062486
Energy: 0.9409149551362886
Energy: 0.8357949297062486
Energy: 0.9409149551367169
Energy: 0.8357949297058201
Energy: 0.845221984376094
Energy: 0.8003845868721761
Energy: 0.845221984374809
Energy: 0.8003845868726045
Energy: 0.8452219843773789
Energy: 0.8003845868717476
Energy: 0.9274427846111885
Energy: 0.8917745660170809
Energy: 0.9274427846111885
Energy: 0.8917745660179378
Energy: 0.927442784611617
Energy: 0.8917745660170809
Energy: 0.7713710994961804
Energy: 0.868635859673119
Energy: 0.7713710994953238
Energy: 0.868635859673119
Energy: 0.7713710994966088
Energy: 0.8686358596722622
Energy: 0.9682091168894531
Energy: 0.7999575621359024
Energy: 0.9682091168903099
Energy: 0.7999575621354742
Energy: 0.9682091168894531
Energy: 0.7999575621354742

minimum gb energy = 0.7663500001807546 eV
minimum distance =  2.31211723455248 Angstroms
sigma value = 57


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

Energy: 0.8810624680078653
Energy: 0.7777159625005186
Energy: 0.8810624680078653
Energy: 0.7777159624998211
Energy: 0.8810624680085628
Energy: 0.7777159624998211
Energy: 0.7783730655678516
Energy: 0.7480793876981767
Energy: 0.778373065565759
Energy: 0.7480793876981767
Energy: 0.7783730655636666
Energy: 0.7480793876974793
Energy: 0.9081923730947862
Energy: 0.8356016595538134
Energy: 0.9081923730933912
Energy: 0.8356016595531158
Energy: 0.9081923730940886
Energy: 0.8356016595545108
Energy: 0.7339675969886807
Energy: 0.8436303993779151
Energy: 0.7339675969879833
Energy: 0.8436303993772175
Energy: 0.7339675969872859
Energy: 0.8436303993772175
Energy: 0.7828940388871765
Energy: 0.7139867373377948
Energy: 0.7828940388913614
Energy: 0.7139867373377948
Energy: 0.7828940388934539
Energy: 0.7139867373377948
Energy: 0.8347669616059785
Energy: 0.7626666988109567
Energy: 0.8347669616059785
Energy: 0.7626666988109567
Energy: 0.834766961606676
Energy: 0.7626666988109567
Energy: 0.7328626324003729
Energy: 0.8083058605365593
Energy: 0.7328626324003729
Energy: 0.8083058605351643
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Energy: 0.8083058605351643
Energy: 0.9876008072433439
Energy: 0.7877003344714005
Energy: 0.9876008072433439
Energy: 0.7877003344679131
Energy: 0.9876008072433439
Energy: 0.7877003344679131
Energy: 0.7733950880235378
Energy: 0.7646523986240259
Energy: 0.7733950880228403
Energy: 0.7646523986240259
Energy: 0.7733950880228403
Energy: 0.7646523986247235
Energy: 0.7833747183204893
Energy: 0.7799894087695682
Energy: 0.7833747183204893
Energy: 0.7799894087702658
Energy: 0.7833747183204893
Energy: 0.7799894087695682
Energy: 0.7331786628759934
Energy: 0.8256581336110028
Energy: 0.733178662875296
Energy: 0.8256581336103054
Energy: 0.7331786628759934
Energy: 0.8256581336096078
Energy: 0.805070827307022
Energy: 0.7327307665607968
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Energy: 0.7327307665600993
Energy: 0.8050708273063244
Energy: 0.7327307665594017
Energy: 0.7816659341120756
Energy: 0.883962218251589
Energy: 0.781665934112773
Energy: 0.8839622182508915
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Energy: 0.883962218251589
Energy: 0.7326077594034459
Energy: 0.9320251013344583
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Energy: 0.9320251013337608
Energy: 0.8632309389277208
Energy: 0.7678268569526683
Energy: 0.8632309389277208
Energy: 0.7678268569533658
Energy: 0.8632309389270233
Energy: 0.7678268569533658
Energy: 0.7798987242263996
Energy: 0.7808760299880451
Energy: 0.7798987242270972
Energy: 0.7808760299873476
Energy: 0.7798987242263996
Energy: 0.7808760299880451
Energy: 0.78097061168912
Energy: 0.8928631554681252
Energy: 0.7809706116898174
Energy: 0.8928631554681252
Energy: 0.7809706116898174
Energy: 0.8928631554681252
Energy: 0.830331972081199
Energy: 0.8564851545463249
Energy: 0.830331972079804
Energy: 0.8564851545484174
Energy: 0.8303319720832915
Energy: 0.8564851545484174
Energy: 0.7452898124694197
Energy: 0.8367066684480479
Energy: 0.7452898124701173
Energy: 0.8367066684487453
Energy: 0.7452898124694197
Energy: 0.8367066684473504
Energy: 0.7326715075339211
Energy: 0.8379214549643365
Energy: 0.7326715075353161
Energy: 0.8379214549650339
Energy: 0.7326715075332235
Energy: 0.8379214549650339
Energy: 0.8527685991679321
Energy: 0.8341675501996211
Energy: 0.8527685991686297
Energy: 0.8341675501982261
Energy: 0.8527685991686297
Energy: 0.8341675501982261
Energy: 0.7292713792878897
Energy: 0.8379143841267136
Energy: 0.7292713792885872
Energy: 0.8379143841288061
Energy: 0.7292713792892848
Energy: 0.8379143841274111
Energy: 0.7940404083672966
Energy: 0.8060135993635869
Energy: 0.7940404083659016
Energy: 0.8060135993642843
Energy: 0.7940404083665992
Energy: 0.8060135993635869
Energy: 0.7899362198990123
Energy: 0.8354398819393549
Energy: 0.7899362198983148
Energy: 0.8354398819386574
Energy: 0.7899362199011049
Energy: 0.8354398819407499
Energy: 0.7897346096221186
Energy: 1.0014551509814298
Energy: 0.7897346096214212
Energy: 1.0014551509807323
Energy: 0.7897346096228162
Energy: 1.0014551509807323
Energy: 0.7787059309843238
Energy: 0.8062988676275408
Energy: 0.7787059309850212
Energy: 0.8062988676268433
Energy: 0.7787059309850212
Energy: 0.8062988676275408
Energy: 0.7424834158271703
Energy: 0.8371045870054423
Energy: 0.7424834158278678
Energy: 0.8371045870005598
Energy: 0.7424834158292628
Energy: 0.8371045869977698

minimum gb energy = 0.7139867373377948 eV
minimum distance =  2.28999332378089 Angstroms
sigma value = 43


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

Energy: 0.8297735344208405
Energy: 0.7092738246078054
Energy: 0.8297735344208405
Energy: 0.7092738246078054
Energy: 0.8297735344203321
Energy: 0.7092738246078054
Energy: 0.7735293239453203
Energy: 0.6859501500185868
Energy: 0.7735293239468448
Energy: 0.685950150019095
Energy: 0.7735293239453203
Energy: 0.6859501500185868
Energy: 0.7968583977638618
Energy: 0.7085138952061594
Energy: 0.7968583977643701
Energy: 0.7085138952056512
Energy: 0.7968583977638618
Energy: 0.7085138952061594
Energy: 0.8166498537573249
Energy: 0.7523120951000354
Energy: 0.8166498537659643
Energy: 0.7523120951005436
Energy: 0.8166498537629151
Energy: 0.7523120951005436
Energy: 0.7137021927274306
Energy: 0.6446668401423833
Energy: 0.7137021927279389
Energy: 0.644666840141875
Energy: 0.7137021927248897
Energy: 0.644666840141875
Energy: 0.7285339322680537
Energy: 0.6865338809292989
Energy: 0.728533932268562
Energy: 0.686533880929807
Energy: 0.7285339322680537
Energy: 0.686533880929807
Energy: 0.6787072135089582
Energy: 0.710843991401678
Energy: 0.6787072135074337
Energy: 0.7108439914037108
Energy: 0.6787072135084501
Energy: 0.7108439914021861
Energy: 0.713145449936378
Energy: 0.6279802528270313
Energy: 0.7131454499414599
Energy: 0.6279802528270313
Energy: 0.7131454499358698
Energy: 0.6279802528270313
Energy: 0.6983575493829919
Energy: 0.6820486602663157
Energy: 0.6983575493829919
Energy: 0.6820486602663157
Energy: 0.6983575493829919
Energy: 0.6820486602668239
Energy: 0.6991112771736104
Energy: 0.6785454129067992
Energy: 0.699111277175135
Energy: 0.6785454129067992
Energy: 0.6991112771756433
Energy: 0.6785454129063372
Energy: 0.8351968926361067
Energy: 0.6697193089376611
Energy: 0.8351968926355987
Energy: 0.6697193089386775
Energy: 0.8351968926350904
Energy: 0.6697193089381692
Energy: 0.6644517734505581
Energy: 0.6831120862264398
Energy: 0.6644517734505581
Energy: 0.6831120862259316
Energy: 0.6644517734505581
Energy: 0.6831120862264398
Energy: 0.699450389527333
Energy: 0.6523953344042996
Energy: 0.699450389527333
Energy: 0.6523953344032832
Energy: 0.6994503895268248
Energy: 0.6523953344048078
Energy: 0.8462351338734592
Energy: 0.6879364729949905
Energy: 0.8462351338734592
Energy: 0.6879364729929578
Energy: 0.8462351338739672
Energy: 0.6879364729944825
Energy: 0.6781324548590412
Energy: 0.6811678650685702
Energy: 0.6781324548570085
Energy: 0.6811678650685702
Energy: 0.6781324548590412
Energy: 0.6811678650690783
Energy: 0.7155151352076394
Energy: 0.7203468619255181
Energy: 0.7155151352081476
Energy: 0.7203468619260263
Energy: 0.7155151352071312
Energy: 0.7203468619260263
Energy: 0.6510958464273431
Energy: 0.7067282655224723
Energy: 0.6510958464268349
Energy: 0.7067282655229804
Energy: 0.6510958464263268
Energy: 0.7067282655214557
Energy: 0.702353858739641
Energy: 0.6441828269581964
Energy: 0.702353858739641
Energy: 0.6441828269576884
Energy: 0.702353858739641
Energy: 0.6441828269587045
Energy: 0.652427925467761
Energy: 0.7758373367643353
Energy: 0.652427925467761
Energy: 0.7758373367643353
Energy: 0.6524279254672528
Energy: 0.7758373367643353
Energy: 0.6778514156111034
Energy: 0.7565841726699121
Energy: 0.6778514156121199
Energy: 0.7565841726714367
Energy: 0.6778514156111034
Energy: 0.756584172672453
Energy: 0.7540156970203147
Energy: 0.7681736176751772
Energy: 0.7540156970198064
Energy: 0.7681736176751772
Energy: 0.7540156970192982
Energy: 0.7681736176751772
Energy: 0.715471750331044
Energy: 0.7696647607378625
Energy: 0.7154717503315522
Energy: 0.7696647607378625
Energy: 0.7154717503315522
Energy: 0.7696647607378625
Energy: 0.713427370830598
Energy: 0.7721540371560965
Energy: 0.7134273708311062
Energy: 0.7721540371560965
Energy: 0.7134273708311062
Energy: 0.7721540371555884
Energy: 0.7355389971142959
Energy: 0.7539357823950177
Energy: 0.7355389971132795
Energy: 0.753935782396034
Energy: 0.7355389971132795
Energy: 0.753935782396034
Energy: 0.6507612687226221
Energy: 0.6765616913549136
Energy: 0.6507612687226221
Energy: 0.676561691358471
Energy: 0.6507612687221139
Energy: 0.6765616913513562
Energy: 0.6744529545066484
Energy: 0.741426540739559
Energy: 0.6744529545071567
Energy: 0.741426540739559
Energy: 0.6744529545071567
Energy: 0.741426540739559
Energy: 0.7420265091620495
Energy: 0.670640660259123
Energy: 0.7420265091620495
Energy: 0.670640660259123
Energy: 0.742026509163066
Energy: 0.670640660259123
Energy: 0.6226211709311041
Energy: 0.7589534289945961
Energy: 0.6226211709311041
Energy: 0.7589534289945961
Energy: 0.6226211709305959
Energy: 0.7589534289951043
Energy: 0.6736442941033025
Energy: 0.6962454805619165
Energy: 0.6736442941033025
Energy: 0.6962454805619165
Energy: 0.6736442941033025
Energy: 0.6962454805619165
Energy: 0.6777255598888199
Energy: 0.793070421583673
Energy: 0.6777255598883116
Energy: 0.7930704215811321
Energy: 0.6777255598888199
Energy: 0.7930704215811321
Energy: 0.6281847225794458
Energy: 0.7553564124591787
Energy: 0.6281847225804622
Energy: 0.7553564124571459
Energy: 0.6281847225794458
Energy: 0.7553564124591787
Energy: 0.6741932586808147
Energy: 0.6816616243966873
Energy: 0.6741932586808147
Energy: 0.6816616243971955
Energy: 0.6741932586808147
Energy: 0.6816616243971955
Energy: 0.6589372922733939
Energy: 0.6796792592436309
Energy: 0.6589372922733939
Energy: 0.6796792592426145
Energy: 0.6589372922733939
Energy: 0.6796792592426145
Energy: 0.6879203505653978
Energy: 0.8256241406657305
Energy: 0.6879203505628568
Energy: 0.8256241406682715
Energy: 0.6879203505613324
Energy: 0.8256241406677634
Energy: 0.6997010882753594
Energy: 0.6620124306156909
Energy: 0.6997010882753594
Energy: 0.6620124306156909
Energy: 0.6997010882758675
Energy: 0.6620124306156909
Energy: 0.6162695359409794
Energy: 0.6771574690624744
Energy: 0.6162695359409794
Energy: 0.6771574690659856
Energy: 0.6162695359409794
Energy: 0.6771574690649692

minimum gb energy = 0.6162695359409794 eV
minimum distance =  2.28787218578712 Angstroms
sigma value = 81


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

Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.123100312634376
Energy: 0.070566431016432
Energy: 0.12310031263624326
Energy: 0.5737636805166646
Energy: 0.07178940516259918
Energy: 0.5737636805166646
Energy: 0.07178940516259918
Energy: 0.5737636805166646
Energy: 0.07178940516259918
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.5737627354227837
Energy: 0.07186411521378683
Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.070566431016432
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.5737636805166646
Energy: 0.0717894051644664
Energy: 0.5737636805166646
Energy: 0.0717894051644664
Energy: 0.5737636805166646
Energy: 0.0717894051644664
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.5737627354227837
Energy: 0.07186411521565406
Energy: 0.5737627354209166
Energy: 0.07186411521378683
Energy: 0.070566431016432
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.123100312634376
Energy: 0.5737636805166646
Energy: 0.07178940516259918
Energy: 0.5737636805166646
Energy: 0.07178940516259918
Energy: 0.5737636805166646
Energy: 0.07178940516073194
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.5737627354209166
Energy: 0.07186411521565406
Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.12310031263624326
Energy: 0.07056643101456476
Energy: 0.123100312634376

minimum gb energy = 0.07056643101456476 eV
minimum distance =  2.46420182110049 Angstroms
sigma value = 3


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

Energy: 0.7019308142698865
Energy: 0.6519720642901015
Energy: 0.7019308142693276
Energy: 0.6519720642901015
Energy: 0.7019308142693276
Energy: 0.6519720642901015
Energy: 0.6763939439922894
Energy: 0.6730166285769141
Energy: 0.6763939439928481
Energy: 0.6730166285769141
Energy: 0.6763939439922894
Energy: 0.6730166285774729
Energy: 0.7140582805723458
Energy: 0.5795648631475347
Energy: 0.714058280571787
Energy: 0.5795648631475347
Energy: 0.7140582805723458
Energy: 0.5795648631475347
Energy: 0.7227182407807314
Energy: 0.6605227520060803
Energy: 0.7227182407801727
Energy: 0.6605227520060803
Energy: 0.722718240779614
Energy: 0.6605227520055216
Energy: 0.5800353922257445
Energy: 0.6734791236411575
Energy: 0.5800353922257445
Energy: 0.6734791236411575
Energy: 0.5800353922257445
Energy: 0.673479123642275
Energy: 0.718852298398318
Energy: 0.5874733566410246
Energy: 0.7188522983977592
Energy: 0.5874733566410246
Energy: 0.7188522983972003
Energy: 0.5874733566410246
Energy: 0.7319600089272221
Energy: 0.6760331388410838
Energy: 0.7319600089277809
Energy: 0.6760331388410838
Energy: 0.7319600089272221
Energy: 0.6760331388410838
Energy: 0.5755761738434264
Energy: 0.6746796921854225
Energy: 0.5755761738434264
Energy: 0.6746796921854225
Energy: 0.5755761738434264
Energy: 0.6746796921848637
Energy: 0.7338757172951008
Energy: 0.7330747561837926
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Energy: 0.7338757172951008
Energy: 0.7330747561837926
Energy: 0.6593070773832397
Energy: 0.6259996676643513
Energy: 0.6593070773837985
Energy: 0.6259996676637924
Energy: 0.6593070773832397
Energy: 0.6259996676643513
Energy: 0.6169589907753062
Energy: 0.6758143306529434
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Energy: 0.6169589907747475
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Energy: 0.7590816004517259
Energy: 0.764775636748303
Energy: 0.7590816004517259
Energy: 0.7647756367488617
Energy: 0.759081600451167
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Energy: 0.6380174214613544
Energy: 0.592531219375186
Energy: 0.6380174214613544
Energy: 0.5925312193757447
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Energy: 0.5925312193763035
Energy: 0.6391947845194778
Energy: 0.7375242880497584
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Energy: 0.7375242880497584
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Energy: 0.6915259463884971
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Energy: 0.7362158094383573
Energy: 0.6915259463884971
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Energy: 0.6432355256190149
Energy: 0.579057270886856
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Energy: 0.5790572708862972
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Energy: 0.7531211729150759
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Energy: 0.6803185245341791
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Energy: 0.7033414770356499
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Energy: 0.5874706772716055
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Energy: 0.5874706772732818
Energy: 0.691746664166973
Energy: 0.587470677274958
Energy: 0.6629049755244125
Energy: 0.7019313108978879
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Energy: 0.6629049755244125
Energy: 0.7019313108973291
Energy: 0.7167192154488504
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Energy: 0.7167192154482918
Energy: 0.6781646468040667
Energy: 0.7167192154482918
Energy: 0.6781646468040667
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Energy: 0.685012567224529
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Energy: 0.7019346787171096
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Energy: 0.7689920147818998
Energy: 0.5758465511063765
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Energy: 0.6634113985920187
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Energy: 0.6450123247677901
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Energy: 0.6450123247689077
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Energy: 0.6206375416809653
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Energy: 0.7694137147973664
Energy: 0.6206375416809653
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Energy: 0.7608098318274864
Energy: 0.6789944125860273
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Energy: 0.6789944125860273
Energy: 0.6211217841562284
Energy: 0.6269873919636461
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Energy: 0.6269873919642049
Energy: 0.6211217841562284
Energy: 0.6269873919636461
Energy: 0.7362237423820576
Energy: 0.6753353263762223
Energy: 0.7362237423820576
Energy: 0.6753353263762223
Energy: 0.7362237423820576
Energy: 0.6753353263762223

minimum gb energy = 0.5755761738434264 eV
minimum distance =  2.31239627447082 Angstroms
sigma value = 67


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

Energy: 0.9289401434926727
Energy: 0.8158110286096365
Energy: 0.9289401434926727
Energy: 0.8158110286088404
Energy: 0.9289401434934689
Energy: 0.8158110286096365
Energy: 0.8190339673094023
Energy: 0.7953445215570287
Energy: 0.8190339673094023
Energy: 0.795344521557825
Energy: 0.8190339673101984
Energy: 0.7953445215570287
Energy: 0.8786502416105361
Energy: 0.8444430716110888
Energy: 0.8786502416105361
Energy: 0.8444430716102924
Energy: 0.8786502416105361
Energy: 0.8444430716102924
Energy: 0.8868139354586718
Energy: 0.8345755790089182
Energy: 0.8868139354586718
Energy: 0.8345755790081222
Energy: 0.886813935459468
Energy: 0.8345755790089182
Energy: 0.7226055022164426
Energy: 0.8051918888561362
Energy: 0.7226055022156463
Energy: 0.8051918888561362
Energy: 0.7226055022164426
Energy: 0.8051918888561362
Energy: 0.8800917604837442
Energy: 0.8828142722508199
Energy: 0.8800917604845404
Energy: 0.8828142722508199
Energy: 0.8800917604845404
Energy: 0.8828142722516161
Energy: 0.8105963693328189
Energy: 0.7911370250281234
Energy: 0.8105963693328189
Energy: 0.7911370250281234
Energy: 0.8105963693328189
Energy: 0.7911370250281234
Energy: 0.7797596258669199
Energy: 0.7949864114842099
Energy: 0.7797596258685124
Energy: 0.7949864114850062
Energy: 0.7797596258677162
Energy: 0.7949864114850062
Energy: 0.9135481223576606
Energy: 0.9222513042104445
Energy: 0.9135481223576606
Energy: 0.9222513042096485
Energy: 0.9135481223568643
Energy: 0.9222513042096485
Energy: 0.8175067428921987
Energy: 0.740323525873235
Energy: 0.8175067428914026
Energy: 0.740323525873235
Energy: 0.8175067428906064
Energy: 0.740323525873235
Energy: 0.8239103446812068
Energy: 0.8733903471260815
Energy: 0.8239103446804105
Energy: 0.8733903471260815
Energy: 0.8239103446812068
Energy: 0.8733903471260815
Energy: 0.817844400159355
Energy: 0.8570179652064841
Energy: 0.817844400159355
Energy: 0.8570179652072805
Energy: 0.817844400159355
Energy: 0.8570179652072805
Energy: 0.8241029254986788
Energy: 0.8102854143979565
Energy: 0.8241029254986788
Energy: 0.8102854143971602
Energy: 0.8241029254986788
Energy: 0.8102854143979565
Energy: 0.8035465924809764
Energy: 0.9409273563987062
Energy: 0.8035465924794565
Energy: 0.9409273563987062
Energy: 0.8035465924794565
Energy: 0.9409273563987062
Energy: 0.8192619733676303
Energy: 0.8085329447778459
Energy: 0.8192619733676303
Energy: 0.8085329447786419
Energy: 0.8192619733676303
Energy: 0.8085329447786419
Energy: 0.7235001405378477
Energy: 0.8358183683512539
Energy: 0.7235001405370515
Energy: 0.8358183683512539
Energy: 0.7235001405370515
Energy: 0.8358183683512539
Energy: 0.8285313893420229
Energy: 0.8890266040049862
Energy: 0.8285313893420229
Energy: 0.8890266040049862
Energy: 0.8285313893412266
Energy: 0.8890266040049862
Energy: 0.8319810310219005
Energy: 0.8030605639902356
Energy: 0.8319810310219005
Energy: 0.8030605639894395
Energy: 0.8319810310219005
Energy: 0.8030605639902356
Energy: 0.8736798009967274
Energy: 0.8080351083348273
Energy: 0.8736798009967274
Energy: 0.8080351083356235
Energy: 0.8736798009967274
Energy: 0.8080351083356235
Energy: 0.7218504866801064
Energy: 0.792769541752139
Energy: 0.7218504866801064
Energy: 0.792769541752139
Energy: 0.7218504866801064
Energy: 0.792769541752139
Energy: 0.8944620318433032
Energy: 0.7374853046369636
Energy: 0.8944620318433032
Energy: 0.7374853046377597
Energy: 0.8944620318433032
Energy: 0.7374853046369636
Energy: 0.9036634172895849
Energy: 0.8456203781042765
Energy: 0.9036634172879925
Energy: 0.8456203781090538
Energy: 0.9036634172895849
Energy: 0.8456203781074613
Energy: 0.7409152599812577
Energy: 0.7912296299999364
Energy: 0.7409152599804615
Energy: 0.7912296299999364
Energy: 0.740915259982054
Energy: 0.7912296299991403

minimum gb energy = 0.7218504866801064 eV
minimum distance =  2.32117378446008 Angstroms
sigma value = 33


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

Energy: 1.0068349962993455
Energy: 0.8686998347328604
Energy: 1.0068349962993455
Energy: 0.8686998347328604
Energy: 1.0068349962988403
Energy: 0.8686998347328604
Energy: 0.8928962883987482
Energy: 0.9207471598387839
Energy: 0.8928962883987482
Energy: 0.9207471598382788
Energy: 0.8928962883992533
Energy: 0.9207471598382788
Energy: 0.9604419747955351
Energy: 0.9612343021191124
Energy: 0.9604419747955351
Energy: 0.9612343021196175
Energy: 0.9604419747955351
Energy: 0.9612343021196175
Energy: 0.9722973679281738
Energy: 0.910588587079573
Energy: 0.9722973679281738
Energy: 0.910588587079573
Energy: 0.9722973679276686
Energy: 0.910588587079573
Energy: 0.8497071221856177
Energy: 0.9152104725011222
Energy: 0.8497071221876382
Energy: 0.9152104725011222
Energy: 0.8497071221856177
Energy: 0.9152104725011222
Energy: 0.9629606173828875
Energy: 1.024755021160387
Energy: 0.9629606173849079
Energy: 1.024755021160387
Energy: 0.9629606173838977
Energy: 1.024755021160387
Energy: 0.8902942210428011
Energy: 0.8658222055733663
Energy: 0.8902942210428011
Energy: 0.8658222055733663
Energy: 0.890294221042296
Energy: 0.8658222055738714
Energy: 0.8938401672744901
Energy: 0.9791400818674209
Energy: 0.8938401672734799
Energy: 0.9791400818674209
Energy: 0.8938401672729749
Energy: 0.9791400818674209
Energy: 0.9237174722567569
Energy: 0.9744396097500563
Energy: 0.9237174722562517
Energy: 0.9744396097505614
Energy: 0.9237174722562517
Energy: 0.9744396097505614
Energy: 0.9330490889085117
Energy: 0.9283920131346873
Energy: 0.9330490889080066
Energy: 0.9283920131346873
Energy: 0.9330490889085117
Energy: 0.9283920131346873
Energy: 0.9372712949639147
Energy: 0.9632411303346298
Energy: 0.9372712949639147
Energy: 0.9632411303341247
Energy: 0.9372712949649249
Energy: 0.9632411303341247
Energy: 0.8922193015528888
Energy: 0.9087129816258879
Energy: 0.8922193015518786
Energy: 0.9087129816263929
Energy: 0.8922193015523837
Energy: 0.9087129816263929
Energy: 1.0006350318031354
Energy: 0.8758202952290474
Energy: 1.0006350318031354
Energy: 0.8758202952290474
Energy: 1.0006350318031354
Energy: 0.8758202952290474
Energy: 0.9092493040825632
Energy: 0.9618763153769321
Energy: 0.9092493040825632
Energy: 0.9618763153774371
Energy: 0.9092493040825632
Energy: 0.9618763153774371
Energy: 0.9236388782524597
Energy: 0.9178180047751419
Energy: 0.9236388782519546
Energy: 0.9178180047746367
Energy: 0.9236388782519546
Energy: 0.9178180047751419
Energy: 0.9719732139348245
Energy: 0.9254156504896527
Energy: 0.9719732139353295
Energy: 0.9254156504886425
Energy: 0.9719732139348245
Energy: 0.9254156504896527
Energy: 0.8425232241847972
Energy: 0.9614728477249469
Energy: 0.8425232241853022
Energy: 0.9614728477249469
Energy: 0.8425232241858074
Energy: 0.9614728477249469
Energy: 0.9851572982182587
Energy: 1.0122145552276183
Energy: 0.9851572982182587
Energy: 1.0122145552276183
Energy: 0.9851572982177536
Energy: 1.0122145552281234
Energy: 0.8950245370363414
Energy: 0.9738583821100045
Energy: 0.8950245370358364
Energy: 0.9738583821100045
Energy: 0.8950245370358364
Energy: 0.9738583821105096
Energy: 0.9001026742275325
Energy: 0.9211102085606176
Energy: 0.9001026742280377
Energy: 0.9211102085611228
Energy: 0.9001026742280377
Energy: 0.9211102085611228
Energy: 0.9677272364699634
Energy: 0.9688959156942509
Energy: 0.9677272364694582
Energy: 0.9688959156937458
Energy: 0.9677272364694582
Energy: 0.9688959156942509
Energy: 0.9219775066424143
Energy: 0.8991463493310535
Energy: 0.9219775066419091
Energy: 0.8991463493305484
Energy: 0.9219775066434244
Energy: 0.8991463493305484
Energy: 0.9379095711115689
Energy: 0.9631942472111326
Energy: 0.9379095711115689
Energy: 0.9631942472111326
Energy: 0.937909571112074
Energy: 0.9631942472106274
Energy: 0.9568779875980037
Energy: 0.9065667878551827
Energy: 0.9568779875964886
Energy: 0.906566787855688
Energy: 0.9568779875969936
Energy: 0.906566787855688
Energy: 0.8900939232773125
Energy: 0.9092990098731014
Energy: 0.8900939232773125
Energy: 0.9092990098731014
Energy: 0.8900939232773125
Energy: 0.9092990098731014
Energy: 0.9342050389113865
Energy: 0.9727657495847329
Energy: 0.9342050389113865
Energy: 0.9727657495847329
Energy: 0.9342050389108815
Energy: 0.972765749585238
Energy: 0.8905747477187874
Energy: 0.8944799238177347
Energy: 0.8905747477187874
Energy: 0.8944799238182398
Energy: 0.8905747477192925
Energy: 0.8944799238177347
Energy: 0.8913701153136474
Energy: 1.0483437599489596
Energy: 0.8913701153131424
Energy: 1.0483437599489596
Energy: 0.8913701153131424
Energy: 1.0483437599489596
Energy: 0.8944305595430987
Energy: 0.9155390940082988
Energy: 0.8944305595436038
Energy: 0.9155390940082988
Energy: 0.8944305595430987
Energy: 0.9155390940077937
Energy: 0.8902516828810754
Energy: 0.8623795749956864
Energy: 0.8902516828820856
Energy: 0.8623795749966967
Energy: 0.8902516828805702
Energy: 0.8623795749951814
Energy: 1.0201082351662478
Energy: 1.0173179006980138
Energy: 1.0201082351662478
Energy: 1.0173179006975086
Energy: 1.0201082351662478
Energy: 1.0173179006980138
Energy: 0.8507949881148668
Energy: 0.9197567778334441
Energy: 0.8507949881143616
Energy: 0.9197567778334441
Energy: 0.8507949881143616
Energy: 0.9197567778329391
Energy: 0.9700475948338381
Energy: 0.9273082096962024
Energy: 0.970047594833333
Energy: 0.9273082096967075
Energy: 0.970047594833333
Energy: 0.9273082096967075
Energy: 0.9217929094863981
Energy: 0.9211043932207986
Energy: 0.9217929094863981
Energy: 0.9211043932207986
Energy: 0.921792909485893
Energy: 0.9211043932202934
Energy: 0.9048612947249964
Energy: 0.9623533493562826
Energy: 0.9048612947249964
Energy: 0.9623533493562826
Energy: 0.9048612947255015
Energy: 0.9623533493557775
Energy: 1.0283946958695278
Energy: 0.8705159834392862
Energy: 1.028394695870538
Energy: 0.870515983438781
Energy: 1.028394695870538
Energy: 0.870515983438781
Energy: 0.8938695054688507
Energy: 0.9116382794643113
Energy: 0.8938695054693557
Energy: 0.9116382794643113
Energy: 0.8938695054693557
Energy: 0.9116382794638063

minimum gb energy = 0.8425232241847972 eV
minimum distance =  2.2939721484211 Angstroms
sigma value = 41


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

Energy: 1.0996586300828706
Energy: 1.0496441333780382
Energy: 1.0996586300814915
Energy: 1.0496441333780382
Energy: 1.0996586300814915
Energy: 1.0496441333780382
Energy: 1.029111831141858
Energy: 1.082005584526543
Energy: 1.029111831141858
Energy: 1.0820055845279222
Energy: 1.029111831141858
Energy: 1.082005584526543
Energy: 1.1538482869162972
Energy: 1.0775306411300287
Energy: 1.1538482869121602
Energy: 1.0775306411300287
Energy: 1.1538482869162972
Energy: 1.0775306411300287
Energy: 1.1090307803088013
Energy: 1.0770600899960963
Energy: 1.1090307803088013
Energy: 1.0770600899974754
Energy: 1.1090307803074222
Energy: 1.0770600899974754
Energy: 1.012520472851902
Energy: 1.0669174128406098
Energy: 1.012520472851902
Energy: 1.0669174128406098
Energy: 1.012520472850523
Energy: 1.0669174128406098
Energy: 1.1369568410511735
Energy: 1.122772691019905
Energy: 1.1369568410497943
Energy: 1.122772691018526
Energy: 1.1369568410497943
Energy: 1.122772691018526
Energy: 1.100899030634561
Energy: 1.0248242105992282
Energy: 1.100899030634561
Energy: 1.0248242105978491
Energy: 1.100899030634561
Energy: 1.0248242105978491
Energy: 1.0845887174955826
Energy: 1.0822186533320246
Energy: 1.0845887174942037
Energy: 1.0822186533334037
Energy: 1.0845887174955826
Energy: 1.0822186533320246
Energy: 1.0319158722652484
Energy: 1.0269194336968084
Energy: 1.0319158722652484
Energy: 1.0269194336968084
Energy: 1.0319158722652484
Energy: 1.0269194336968084
Energy: 1.1025127807775101
Energy: 1.0635014185359648
Energy: 1.1025127807775101
Energy: 1.0635014185359648
Energy: 1.1025127807775101
Energy: 1.0635014185359648
Energy: 1.0313592367643938
Energy: 1.077158340169316
Energy: 1.0313592367643938
Energy: 1.077158340169316
Energy: 1.0313592367643938
Energy: 1.077158340169316
Energy: 1.0711823279810415
Energy: 1.0826806188655755
Energy: 1.0711823279824209
Energy: 1.0826806188655755
Energy: 1.0711823279810415
Energy: 1.0826806188655755
Energy: 1.1026975712317346
Energy: 1.112706567250145
Energy: 1.1026975712317346
Energy: 1.112706567250145
Energy: 1.1026975712317346
Energy: 1.112706567250145
Energy: 1.018081445457221
Energy: 1.0857821454491494
Energy: 1.018081445457221
Energy: 1.0857821454491494
Energy: 1.018081445455842
Energy: 1.0857821454491494

minimum gb energy = 1.012520472850523 eV
minimum distance =  2.25664231295188 Angstroms
sigma value = 11


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

Energy: 1.2422971995388663
Energy: 1.2362525835958662
Energy: 1.2422971995394723
Energy: 1.2362525835964717
Energy: 1.2422971995388663
Energy: 1.2362525835964717
Energy: 1.1272248067378918
Energy: 1.1908132523596442
Energy: 1.1272248067384976
Energy: 1.1908132523596442
Energy: 1.1272248067378918
Energy: 1.1908132523596442
Energy: 1.19552197546125
Energy: 1.180042892816886
Energy: 1.1955219754576152
Energy: 1.18004289281628
Energy: 1.1955219754594326
Energy: 1.18004289281628
Energy: 1.1921969111634434
Energy: 1.1544317702647928
Energy: 1.1921969111634434
Energy: 1.1544317702647928
Energy: 1.1921969111634434
Energy: 1.1544317702647928
Energy: 1.2008012309111404
Energy: 1.174505618127855
Energy: 1.200801230911746
Energy: 1.174505618127855
Energy: 1.200801230911746
Energy: 1.174505618127855
Energy: 1.1689959005440178
Energy: 1.2044695314307134
Energy: 1.168995900543412
Energy: 1.2044695314307134
Energy: 1.168995900543412
Energy: 1.2044695314295017
Energy: 1.185210865814059
Energy: 1.1689023397064848
Energy: 1.185210865814059
Energy: 1.1689023397064848
Energy: 1.185210865813453
Energy: 1.1689023397064848
Energy: 1.1753710845148142
Energy: 1.190569246841267
Energy: 1.1753710845148142
Energy: 1.190569246841267
Energy: 1.1753710845142082
Energy: 1.1905692468418727
Energy: 1.1838735659392923
Energy: 1.1904702922404504
Energy: 1.1838735659392923
Energy: 1.1904702922404504
Energy: 1.1838735659392923
Energy: 1.1904702922404504
Energy: 1.166463872490886
Energy: 1.1945648429137343
Energy: 1.166463872490886
Energy: 1.1945648429137343
Energy: 1.166463872490886
Energy: 1.1945648429131286
Energy: 1.147420693796314
Energy: 1.1829137334599371
Energy: 1.147420693796314
Energy: 1.182913733460543
Energy: 1.147420693795708
Energy: 1.1829137334599371
Energy: 1.175767934347946
Energy: 1.2019207314514415
Energy: 1.1757679343461283
Energy: 1.2019207314514415
Energy: 1.1757679343455223
Energy: 1.2019207314514415
Energy: 1.1911369454749068
Energy: 1.189069376179751
Energy: 1.1911369454749068
Energy: 1.189069376179751
Energy: 1.1911369454749068
Energy: 1.189069376179751
Energy: 1.1834657000900675
Energy: 1.2069182918034913
Energy: 1.18346570008825
Energy: 1.2069182918034913
Energy: 1.18346570008825
Energy: 1.2069182918034913
Energy: 1.1598453667554633
Energy: 1.1694015128311006
Energy: 1.1598453667554633
Energy: 1.1694015128311006
Energy: 1.1598453667554633
Energy: 1.1694015128311006
Energy: 1.1851848184186342
Energy: 1.1696311250011704
Energy: 1.1851848184186342
Energy: 1.1696311250017761
Energy: 1.1851848184186342
Energy: 1.1696311250096518
Energy: 1.1489932937049556
Energy: 1.1879036590707464
Energy: 1.1489932937049556
Energy: 1.1879036590707464
Energy: 1.1489932937055616
Energy: 1.1879036590707464
Energy: 1.2118903012926034
Energy: 1.2207562703699237
Energy: 1.2118903012926034
Energy: 1.2207562703693182
Energy: 1.2118903012926034
Energy: 1.2207562703693182
Energy: 1.1560271603258068
Energy: 1.1430297127339044
Energy: 1.1560271603264127
Energy: 1.1430297127339044
Energy: 1.1560271603258068
Energy: 1.1430297127339044
Energy: 1.170795895046766
Energy: 1.1784415039586222
Energy: 1.17079589504616
Energy: 1.1784415039586222
Energy: 1.1707958950455544
Energy: 1.1784415039586222
Energy: 1.1378441084822986
Energy: 1.1599048253272601
Energy: 1.1378441084816926
Energy: 1.1599048253272601
Energy: 1.1378441084816926
Energy: 1.1599048253272601
Energy: 1.2336894146954482
Energy: 1.219357247786009
Energy: 1.2336894146954482
Energy: 1.2193572477847976
Energy: 1.2336894146960542
Energy: 1.2193572477847976
Energy: 1.1820494222499949
Energy: 1.179048388803547
Energy: 1.1820494222499949
Energy: 1.179048388803547
Energy: 1.1820494222506006
Energy: 1.179048388803547
Energy: 1.2134787220824286
Energy: 1.1876793230636022
Energy: 1.2134787220824286
Energy: 1.1876793230642082
Energy: 1.2134787220824286
Energy: 1.1876793230636022
Energy: 1.1705883129230379
Energy: 1.184597400804568
Energy: 1.1705883129230379
Energy: 1.184597400804568
Energy: 1.1705883129236438
Energy: 1.184597400804568
Energy: 1.1545899586486073
Energy: 1.17882057732539
Energy: 1.1545899586486073
Energy: 1.17882057732539
Energy: 1.1545899586486073
Energy: 1.17882057732539
Energy: 1.1530595600913207
Energy: 1.2253758945730173
Energy: 1.153059560090715
Energy: 1.2253758945724116
Energy: 1.1530595600913207
Energy: 1.2253758945711999
Energy: 1.1907661449809683
Energy: 1.1605471237154477
Energy: 1.1907661449809683
Energy: 1.1605471237154477
Energy: 1.1907661449809683
Energy: 1.1605471237154477
Energy: 1.1844040242781029
Energy: 1.2141772492866052
Energy: 1.1844040242775247
Energy: 1.2141772492859992
Energy: 1.1844040242781029
Energy: 1.2141772492866052
Energy: 1.160312382833814
Energy: 1.1252486121293694
Energy: 1.160312382833814
Energy: 1.1252486121293694
Energy: 1.160312382833814
Energy: 1.1252486121293694
Energy: 1.1656696275531921
Energy: 1.1998996474175714
Energy: 1.1656696275531921
Energy: 1.1998996474169654
Energy: 1.1656696275531921
Energy: 1.1998996474175714

minimum gb energy = 1.1252486121293694 eV
minimum distance =  2.22712638014375 Angstroms
sigma value = 57


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

Energy: 1.1281764553637141
Energy: 1.1432198598619099
Energy: 1.1281764553637141
Energy: 1.1432198598619099
Energy: 1.128176455364792
Energy: 1.1432198598619099
Energy: 1.1275420263516556
Energy: 1.1390628046648579
Energy: 1.1275420263516556
Energy: 1.1390628046648579
Energy: 1.1275420263516556
Energy: 1.1390628046637796
Energy: 1.2201782999819775
Energy: 1.189193571639235
Energy: 1.2201782999819775
Energy: 1.189193571639235
Energy: 1.2201782999819775
Energy: 1.189193571639235
Energy: 1.1405463699728522
Energy: 1.178214909790602
Energy: 1.1405463699739302
Energy: 1.1968480053485018
Energy: 1.1405463699739302
Energy: 1.1968480053485018
Energy: 1.2199652289159908
Energy: 1.1892512529271562
Energy: 1.2199652289170688
Energy: 1.1892512529271562
Energy: 1.2199652289170688
Energy: 1.1892512529282342
Energy: 1.1275145924246486
Energy: 1.1392172738184427
Energy: 1.1275145924246486
Energy: 1.1392172738184427
Energy: 1.1275145924246486
Energy: 1.1392172738184427
Energy: 1.128176455364792
Energy: 1.143219859862988
Energy: 1.128176455364792
Energy: 1.143219859862988
Energy: 1.128176455364792
Energy: 1.1432198598619099
Energy: 1.1275420263494993
Energy: 1.1390628046648579
Energy: 1.1275420263494993
Energy: 1.1390628046648579
Energy: 1.1275420263494993
Energy: 1.1390628046648579
Energy: 1.2201782999819775
Energy: 1.189193571638157
Energy: 1.2201782999819775
Energy: 1.189193571638157
Energy: 1.2201782999819775
Energy: 1.189193571638157
Energy: 1.1405463699717742
Energy: 1.159433458880943
Energy: 1.1405463699728522
Energy: 1.159433458879865
Energy: 1.1405463699728522
Energy: 1.2487997294625315
Energy: 1.2199652289149128
Energy: 1.1892512529282342
Energy: 1.2199652289149128
Energy: 1.1892512529282342
Energy: 1.2199652289149128
Energy: 1.1892512529282342
Energy: 1.1275145924246486
Energy: 1.1392172738173647
Energy: 1.1275145924257266
Energy: 1.1392172738173647
Energy: 1.1275145924257266
Energy: 1.1392172738184427
Energy: 1.128176455364792
Energy: 1.1432198598619099
Energy: 1.128176455364792
Energy: 1.1432198598619099
Energy: 1.128176455364792
Energy: 1.1432198598619099
Energy: 1.1275420263516556
Energy: 1.1390628046648579
Energy: 1.1275420263516556
Energy: 1.1390628046637796
Energy: 1.1275420263527336
Energy: 1.1390628046648579
Energy: 1.2201782999808994
Energy: 1.189193571639235
Energy: 1.2201782999808994
Energy: 1.189193571639235
Energy: 1.2201782999819775
Energy: 1.189193571639235
Energy: 1.1405463699728522
Energy: 1.159433458882021
Energy: 1.1405463699728522
Energy: 1.159433458880943
Energy: 1.1405463699728522
Energy: 1.2104340628937786
Energy: 1.2199652289181468
Energy: 1.1892512529271562
Energy: 1.2199652289170688
Energy: 1.1892512529271562
Energy: 1.2199652289170688
Energy: 1.1892512529271562

minimum gb energy = 1.1275145924246486 eV
minimum distance =  2.27601321428666 Angstroms
sigma value = 9


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

Energy: 1.2444722667278278
Energy: 1.1959204500632672
Energy: 1.244472266728708
Energy: 1.1959204500632672
Energy: 1.2444722667278278
Energy: 1.1959204500632672
Energy: 1.2488043141940823
Energy: 1.2098474182477024
Energy: 1.2488043141940823
Energy: 1.209847418246822
Energy: 1.2488043141940823
Energy: 1.2098474182477024
Energy: 1.2268174753340455
Energy: 1.2122739210769544
Energy: 1.2268174753340455
Energy: 1.2122739210769544
Energy: 1.2268174753340455
Energy: 1.2122739210769544
Energy: 1.1911869806082507
Energy: 1.3256580319107956
Energy: 1.1911869806082507
Energy: 1.3256580319116755
Energy: 1.1911869806082507
Energy: 1.3256580319107956
Energy: 1.2280056487077127
Energy: 1.2148994181062107
Energy: 1.2280056487077127
Energy: 1.2148994181062107
Energy: 1.2280056487068325
Energy: 1.2148994181062107
Energy: 1.2389681333307498
Energy: 1.1984028674651725
Energy: 1.23896813333163
Energy: 1.1984028674651725
Energy: 1.23896813333163
Energy: 1.1984028674651725
Energy: 1.1886134733940492
Energy: 1.2514588046586619
Energy: 1.1886134733940492
Energy: 1.2514588046586619
Energy: 1.1886134733940492
Energy: 1.2514588046586619
Energy: 1.1961725217353323
Energy: 1.2522162105863024
Energy: 1.196172521734452
Energy: 1.2522162105871826
Energy: 1.196172521734452
Energy: 1.2522162105871826
Energy: 1.313806838004505
Energy: 1.2170426088614072
Energy: 1.3138068380036247
Energy: 1.2170426088622877
Energy: 1.3138068380036247
Energy: 1.2170426088622877
Energy: 1.1919028391826028
Energy: 1.2152563418984565
Energy: 1.1919028391826028
Energy: 1.2152563418984565
Energy: 1.1919028391826028
Energy: 1.2152563418984565
Energy: 1.2314656219822817
Energy: 1.2517487719176492
Energy: 1.2314656219822817
Energy: 1.2517487719185294
Energy: 1.231465621983162
Energy: 1.2517487719185294
Energy: 1.2703708161911924
Energy: 1.2038846250973874
Energy: 1.2703708161920728
Energy: 1.2038846250982675
Energy: 1.270370816189432
Energy: 1.2038846250973874
Energy: 1.1938648643441034
Energy: 1.288541016425669
Energy: 1.1938648643441034
Energy: 1.288541016425669
Energy: 1.1938648643441034
Energy: 1.288541016425669
Energy: 1.2312306902705528
Energy: 1.225296565227691
Energy: 1.231230690271433
Energy: 1.225296565227691
Energy: 1.2312306902705528
Energy: 1.225296565227691
Energy: 1.2950064415240554
Energy: 1.1983917589998072
Energy: 1.2950064415249358
Energy: 1.1983917589998072
Energy: 1.2502752285146588
Energy: 1.1983917589998072
Energy: 1.2218667773706005
Energy: 1.241948830585492
Energy: 1.2218667773714804
Energy: 1.2419488305846118
Energy: 1.2218667773714804
Energy: 1.2419488305846118
Energy: 1.224412100917261
Energy: 1.2389417137964076
Energy: 1.224412100917261
Energy: 1.2389417137937668
Energy: 1.224412100917261
Energy: 1.2389417137946472
Energy: 1.3583614983252905
Energy: 1.20155232588951
Energy: 1.3583614983244103
Energy: 1.20155232588951
Energy: 1.3583614983252905
Energy: 1.20155232588951
Energy: 1.202933539064073
Energy: 1.2282830498437467
Energy: 1.2029335390631928
Energy: 1.2282830498446267
Energy: 1.2029335390631928
Energy: 1.2282830498446267
Energy: 1.2022465775415727
Energy: 1.2006189720578264
Energy: 1.2022465775424531
Energy: 1.2006189720578264
Energy: 1.2022465775424531
Energy: 1.2006189720578264
Energy: 1.3026996803149924
Energy: 1.203827046571762
Energy: 1.3026996803149924
Energy: 1.2038270465708818
Energy: 1.3026996803149924
Energy: 1.203827046571762

minimum gb energy = 1.1886134733940492 eV
minimum distance =  2.24852365045846 Angstroms
sigma value = 27


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

Energy: 1.215271091003997
Energy: 1.2427056532497578
Energy: 1.1685813970934202
Energy: 1.2427056532490155
Energy: 1.215271091003997
Energy: 1.2427056532497578
Energy: 1.2285030897229388
Energy: 1.175053130123764
Energy: 1.2285030897236808
Energy: 1.1750531301245057
Energy: 1.2285030897229388
Energy: 1.1750531301245057
Energy: 1.217359729103302
Energy: 1.1820371828769527
Energy: 1.217359729104786
Energy: 1.1820371828769527
Energy: 1.217359729103302
Energy: 1.1820371828776948
Energy: 1.1434811228000192
Energy: 1.2327291135149534
Energy: 1.1434811228000192
Energy: 1.2327291135142115
Energy: 1.1434811228007613
Energy: 1.2327291135171792
Energy: 1.167050932050167
Energy: 1.2061786246741313
Energy: 1.167050932050167
Energy: 1.2061786246741313
Energy: 1.167050932050167
Energy: 1.206178624677099
Energy: 1.2452548701692796
Energy: 1.140904459115353
Energy: 1.2452548701700215
Energy: 1.1409044591146111
Energy: 1.2452548701700215
Energy: 1.1409044591190627
Energy: 1.1675875011598031
Energy: 1.2371540437193635
Energy: 1.1675875011575774
Energy: 1.2371540437193635
Energy: 1.1675875011590613
Energy: 1.2371540437186215
Energy: 1.2796820387746357
Energy: 1.1706716917485518
Energy: 1.2796820387753778
Energy: 1.1706716917485518
Energy: 1.2796820387753778
Energy: 1.170671691747068
Energy: 1.1674952807318453
Energy: 1.1413443980794753
Energy: 1.1674952807311032
Energy: 1.1413443980794753
Energy: 1.1674952807311032
Energy: 1.1413443980787334
Energy: 1.160420236377758
Energy: 1.1627329208269914
Energy: 1.1604202363785001
Energy: 1.1627329208269914
Energy: 1.160420236377758
Energy: 1.1627329208255075
Energy: 1.164296964779022
Energy: 1.2065958233758332
Energy: 1.164296964781248
Energy: 1.2065958233758332
Energy: 1.164296964779022
Energy: 1.2065958233743492
Energy: 1.2360509224684504
Energy: 1.1402369649626733
Energy: 1.2360509224684504
Energy: 1.1402369649634152
Energy: 1.2360509224684504
Energy: 1.1402369649604476
Energy: 1.2218807470726363
Energy: 1.2342459309290108
Energy: 1.2218807470726363
Energy: 1.2342459309290108
Energy: 1.2218807470733781
Energy: 1.2342459309297529
Energy: 1.167694078739405
Energy: 1.1627772956024227
Energy: 1.167694078739405
Energy: 1.1627772956024227
Energy: 1.1676940787401473
Energy: 1.1627772956031648
Energy: 1.2519601951865973
Energy: 1.1411317400220602
Energy: 1.2519601951880475
Energy: 1.141131740022802
Energy: 1.2519601951865973
Energy: 1.141131740022802
Energy: 1.1660744757728103
Energy: 1.1738369697932047
Energy: 1.1660744757728103
Energy: 1.1738369697954305
Energy: 1.1660744757728103
Energy: 1.1738369697932047
Energy: 1.138435090160617
Energy: 1.2001298092418444
Energy: 1.1384350901576492
Energy: 1.2001298092418444
Energy: 1.138435090159875
Energy: 1.2001298092374262
Energy: 1.236851413635866
Energy: 1.1825312333615408
Energy: 1.236851413634382
Energy: 1.1825312333615408
Energy: 1.2368514136373499
Energy: 1.1825312333600568
Energy: 1.1805344817798864
Energy: 1.1669645956487593
Energy: 1.144939647906797
Energy: 1.1669645956487593
Energy: 1.1805344817798864
Energy: 1.1669645956502435
Energy: 1.215271091003997
Energy: 1.2427056532497578
Energy: 1.1685813970934202
Energy: 1.2427056532490155
Energy: 1.215271091003997
Energy: 1.2427056532497578
Energy: 1.2285030897229388
Energy: 1.1750531301245057
Energy: 1.2285030897236808
Energy: 1.1750531301245057
Energy: 1.2285030897229388
Energy: 1.175053130125248
Energy: 1.217359729104786
Energy: 1.1820371828739848
Energy: 1.2173597291062697
Energy: 1.1820371828739848
Energy: 1.217359729104786
Energy: 1.1820371828747267
Energy: 1.1434811228000192
Energy: 1.2327291135127274
Energy: 1.1434811227992774
Energy: 1.2327291135127274
Energy: 1.1434811228000192
Energy: 1.2327291135149534
Energy: 1.167050932050167
Energy: 1.2061786246733892
Energy: 1.167050932050167
Energy: 1.2061786246733892
Energy: 1.167050932050167
Energy: 1.2061786246763573
Energy: 1.2452548701685375
Energy: 1.1409044591131272
Energy: 1.2452548701692796
Energy: 1.1409044591146111
Energy: 1.2452548701685375
Energy: 1.140904459116837

minimum gb energy = 1.1384350901576492 eV
minimum distance =  2.27170897050459 Angstroms
sigma value = 19


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

Energy: 1.1551006030761004
Energy: 1.2121989380813663
Energy: 1.1551006030761004
Energy: 1.2121989380813663
Energy: 1.1551006030761004
Energy: 1.2121989380813663
Energy: 1.1695594639495943
Energy: 1.1253517542879605
Energy: 1.1695594639495943
Energy: 1.1253517542879605
Energy: 1.1695594639489537
Energy: 1.1253517542879605
Energy: 1.204103224438569
Energy: 1.0971489792413147
Energy: 1.204103224438569
Energy: 1.0971489792413147
Energy: 1.204103224438569
Energy: 1.0971489792413147
Energy: 1.1221030021200504
Energy: 1.2058614646455996
Energy: 1.1221030021206906
Energy: 1.2058614646455996
Energy: 1.1221030021206906
Energy: 1.2058614646455996
Energy: 1.1530205112310214
Energy: 1.1648174838279841
Energy: 1.1530205112303809
Energy: 1.1648174838279841
Energy: 1.1530205112303809
Energy: 1.1648174838279841
Energy: 1.2019853306265895
Energy: 1.1236018353413795
Energy: 1.2019853306265895
Energy: 1.1236018353413795
Energy: 1.2019853306265895
Energy: 1.1236018353413795
Energy: 1.1080312978575146
Energy: 1.2001873100476879
Energy: 1.1080312978568743
Energy: 1.2001873100476879
Energy: 1.1080312978575146
Energy: 1.2001873100470473
Energy: 1.1454324028280065
Energy: 1.2048247064428694
Energy: 1.1454324028280065
Energy: 1.2048247064428694
Energy: 1.1454324028280065
Energy: 1.2048247064428694
Energy: 1.2411493220133365
Energy: 1.1017155239213234
Energy: 1.2411493220133365
Energy: 1.1017155239219638
Energy: 1.2411493220139769
Energy: 1.1017155239219638
Energy: 1.162751666384255
Energy: 1.1537456034307194
Energy: 1.162751666384255
Energy: 1.1537456034307194
Energy: 1.162751666384255
Energy: 1.1537456034307194
Energy: 1.1085326480302164
Energy: 1.2207543273500832
Energy: 1.1085326480302164
Energy: 1.2207543273500832
Energy: 1.1085326480302164
Energy: 1.2207543273500832
Energy: 1.1765081303156202
Energy: 1.1017428147108874
Energy: 1.1765081303162608
Energy: 1.101742814711528
Energy: 1.1765081303169012
Energy: 1.101742814711528
Energy: 1.1095706691054774
Energy: 1.1305497555884325
Energy: 1.1095706691061178
Energy: 1.1305497555890727
Energy: 1.1095706691054774
Energy: 1.1305497555890727
Energy: 1.1186236715419777
Energy: 1.2060843335034654
Energy: 1.1186236715419777
Energy: 1.2060843335041058
Energy: 1.1186236715426183
Energy: 1.2060843335053868
Energy: 1.190113147968938
Energy: 1.1023413287714423
Energy: 1.190113147968938
Energy: 1.1023413287714423
Energy: 1.1901131479682974
Energy: 1.1023413287714423
Energy: 1.2164334544786695
Energy: 1.096228471062012
Energy: 1.21643345447931
Energy: 1.096228471062012
Energy: 1.2164334544799504
Energy: 1.096228471062012
Energy: 1.1210302078578724
Energy: 1.174450470659504
Energy: 1.1210302078585128
Energy: 1.174450470659504
Energy: 1.1210302078578724
Energy: 1.1744504706588634
Energy: 1.1696587921958395
Energy: 1.1893198542315124
Energy: 1.1696587921958395
Energy: 1.1893198542315124
Energy: 1.1696587921958395
Energy: 1.1893198542315124
Energy: 1.2087571468882456
Energy: 1.1231512847204097
Energy: 1.2087571468869647
Energy: 1.1231512847204097
Energy: 1.208757146887605
Energy: 1.12315128472105
Energy: 1.1209594809055587
Energy: 1.200246494210424
Energy: 1.1209594809055587
Energy: 1.200246494210424
Energy: 1.1209594809055587
Energy: 1.200246494210424
Energy: 1.0993404568275686
Energy: 1.218389584472051
Energy: 1.0993404568275686
Energy: 1.218389584472051
Energy: 1.0993404568275686
Energy: 1.2183895844714105
Energy: 1.248585236360552
Energy: 1.1025229093763176
Energy: 1.2485852363599115
Energy: 1.102522909375677
Energy: 1.248585236359271
Energy: 1.1025229093763176
Energy: 1.1905959696682535
Energy: 1.155097780188826
Energy: 1.1905959696688937
Energy: 1.155097780188826
Energy: 1.1905959696688937
Energy: 1.155097780188826
Energy: 1.157354953057289
Energy: 1.2187071727041576
Energy: 1.1573549530579297
Energy: 1.2187071727041576
Energy: 1.157354953057289
Energy: 1.218707172704798
Energy: 1.2093987114393783
Energy: 1.1014617400030695
Energy: 1.209398711438738
Energy: 1.1014617400030695
Energy: 1.2093987114393783
Energy: 1.1014617400030695
Energy: 1.148025888516291
Energy: 1.117438740320407
Energy: 1.148025888516291
Energy: 1.1174387403197663
Energy: 1.148025888516291
Energy: 1.117438740320407
Energy: 1.0972323113804328
Energy: 1.2191127693354569
Energy: 1.0972323113810734
Energy: 1.2191127693348165
Energy: 1.0972323113804328
Energy: 1.2191127693354569
Energy: 1.191368321149374
Energy: 1.122924844403237
Energy: 1.191368321149374
Energy: 1.122924844403237
Energy: 1.191368321149374
Energy: 1.122924844403237
Energy: 1.2011086643124405
Energy: 1.123435092466818
Energy: 1.2011086643124405
Energy: 1.123435092466818
Energy: 1.2011086643124405
Energy: 1.123435092466818

minimum gb energy = 1.096228471062012 eV
minimum distance =  2.24308272462101 Angstroms
sigma value = 101


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

Energy: 1.0907839235961825
Energy: 1.187586924582541
Energy: 1.0907839235961825
Energy: 1.187586924582541
Energy: 1.0907839235961825
Energy: 1.187586924582541
Energy: 1.1327989407882146
Energy: 1.0892875481821869
Energy: 1.1327989407876515
Energy: 1.0892875481816238
Energy: 1.1327989407876515
Energy: 1.0892875481816238
Energy: 1.1198009996537581
Energy: 1.0522872007748156
Energy: 1.119800999655447
Energy: 1.0522872007748156
Energy: 1.1198009996515061
Energy: 1.0522872007748156
Energy: 1.0436925873608636
Energy: 1.1272715756539746
Energy: 1.0436925873608636
Energy: 1.1272715756545377
Energy: 1.0436925873608636
Energy: 1.1272715756539746
Energy: 1.0866616003774305
Energy: 1.0804628594282641
Energy: 1.0866616003774305
Energy: 1.0804628594288272
Energy: 1.0866616003768677
Energy: 1.0804628594288272
Energy: 1.1373128059427486
Energy: 1.0514779468603415
Energy: 1.1373128059416229
Energy: 1.0514779468609043
Energy: 1.1373128059433115
Energy: 1.0514779468603415
Energy: 1.089196022043212
Energy: 1.1312933362951834
Energy: 1.089196022043212
Energy: 1.1312933362951834
Energy: 1.089196022043775
Energy: 1.1312933362951834
Energy: 1.0446404076046825
Energy: 1.1307804532916546
Energy: 1.0446404076052453
Energy: 1.1307804532916546
Energy: 1.0446404076046825
Energy: 1.1307804532916546
Energy: 1.1715368656210483
Energy: 1.0500981019247337
Energy: 1.1715368656210483
Energy: 1.0500981019247337
Energy: 1.1715368656210483
Energy: 1.0500981019247337
Energy: 1.1051419817911934
Energy: 1.1350572370473717
Energy: 1.1051419817900674
Energy: 1.1350572370484977
Energy: 1.1051419817900674
Energy: 1.1350572370473717
Energy: 1.0450332954100225
Energy: 1.2984777864161066
Energy: 1.0450332954100225
Energy: 1.2984777864161066
Energy: 1.0450332954100225
Energy: 1.2984777864155437
Energy: 1.1494607341047067
Energy: 1.0647718105986341
Energy: 1.1494607341041438
Energy: 1.0647718105991972
Energy: 1.1494607341041438
Energy: 1.0647718105986341
Energy: 1.1636285814173228
Energy: 1.0522739605094715
Energy: 1.1636285814173228
Energy: 1.0522739605094715
Energy: 1.1636285814167597
Energy: 1.0522739605094715
Energy: 1.0971200212597596
Energy: 1.1911501957545918
Energy: 1.0971200212597596
Energy: 1.1911501957545918
Energy: 1.0971200212597596
Energy: 1.191150195754029
Energy: 1.1343170579419906
Energy: 1.1027104774461987
Energy: 1.1343170579431163
Energy: 1.1027104774461987
Energy: 1.1343170579419906
Energy: 1.1027104774467615
Energy: 1.1193823878819942
Energy: 1.0530060120927354
Energy: 1.119382387882557
Energy: 1.0530060120932982
Energy: 1.1193823878831202
Energy: 1.0530060120932982
Energy: 1.0444420012919389
Energy: 1.145721637012151
Energy: 1.0444420012925018
Energy: 1.145721637009899
Energy: 1.0444420012919389
Energy: 1.145721637012151
Energy: 1.0456605029632997
Energy: 1.0802932246320545
Energy: 1.0456605029632997
Energy: 1.0802932246320545
Energy: 1.0456605029627366
Energy: 1.0802932246320545
Energy: 1.1359653565449725
Energy: 1.0500966796479747
Energy: 1.1359653565444094
Energy: 1.0500966796479747
Energy: 1.1359653565455357
Energy: 1.0500966796479747
Energy: 1.0655322253017347
Energy: 1.1333024623716939
Energy: 1.0655322253022976
Energy: 1.1333024623722567
Energy: 1.0655322253022976
Energy: 1.1333024623716939
Energy: 1.0459166191794136
Energy: 1.2996895240272128
Energy: 1.0459166191794136
Energy: 1.2996895240249609
Energy: 1.0459166191799767
Energy: 1.2996895240238349
Energy: 1.2050923694234936
Energy: 1.0502889306190324
Energy: 1.2050923694234936
Energy: 1.0502889306190324
Energy: 1.2050923694223674
Energy: 1.0502889306190324
Energy: 1.183875458011642
Energy: 1.0511127936736715
Energy: 1.183875458011642
Energy: 1.0511127936725453
Energy: 1.183875458011642
Energy: 1.0511127936725453
Energy: 1.043610896293028
Energy: 1.2143505894299271
Energy: 1.0436108962935908
Energy: 1.2143505894299271
Energy: 1.0436108962935908
Energy: 1.214350589429364
Energy: 1.1499653260270755
Energy: 1.0793770929106274
Energy: 1.1499653260253868
Energy: 1.0793770929106274
Energy: 1.1499653260287648
Energy: 1.0793770929106274
Energy: 1.1660015154149328
Energy: 1.0527465006000734
Energy: 1.1660015154154957
Energy: 1.0527465006000734
Energy: 1.1660015154154957
Energy: 1.0527465006000734
Energy: 1.0911068305336213
Energy: 1.1774675887050399
Energy: 1.0911068305336213
Energy: 1.1774675887050399
Energy: 1.0911068305330585
Energy: 1.1774675887050399
Energy: 1.091768422817432
Energy: 1.104830076640495
Energy: 1.091768422816869
Energy: 1.104830076640495
Energy: 1.091768422816869
Energy: 1.104830076640495
Energy: 1.2135606053396537
Energy: 1.053165979060706
Energy: 1.2135606053396537
Energy: 1.053165979060706
Energy: 1.2135606053396537
Energy: 1.053165979060706
Energy: 1.0456852432137191
Energy: 1.1777928726664157
Energy: 1.0456852432137191
Energy: 1.1777928726669786
Energy: 1.0456852432137191
Energy: 1.1777928726652898
Energy: 1.0445679897589657
Energy: 1.1695326850342698
Energy: 1.0445679897589657
Energy: 1.1695326850337069
Energy: 1.0445679897595288
Energy: 1.1695326850337069
Energy: 1.1833415007707817
Energy: 1.0506910655245594
Energy: 1.1833415007713448
Energy: 1.0506910655245594
Energy: 1.1833415007707817
Energy: 1.0506910655245594
Energy: 1.181409036458817
Energy: 1.0510166153846898
Energy: 1.181409036458817
Energy: 1.0510166153841267
Energy: 1.181409036458254
Energy: 1.0510166153841267

minimum gb energy = 1.043610896293028 eV
minimum distance =  2.25887796030628 Angstroms
sigma value = 33


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

Energy: 0.020537719765941546
Energy: 0.9703327731872794
Energy: 0.020537719765941546
Energy: 0.9703327731881631
Energy: 0.020537719765941546
Energy: 0.9703327731868117
Energy: 0.021200777561845727
Energy: 0.4148784766213526
Energy: 0.021200777561845727
Energy: 0.41487847662182037
Energy: 0.021200777561845727
Energy: 0.41487847662182037
Energy: 0.9711747986758268
Energy: 0.41520928577758404
Energy: 0.9711746490352099
Energy: 0.4152092857785196
Energy: 0.9711745926232361
Energy: 0.41520928577940325
Energy: 0.021200777560910183
Energy: 0.41487847662270394
Energy: 0.021200777560442412
Energy: 0.41487847662270394
Energy: 0.021200777560442412
Energy: 0.41487847662228816

minimum gb energy = 0.020537719765941546 eV
minimum distance =  2.48225159623838 Angstroms
sigma value = 1