Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Cu__MO_396616545191_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.592786550521851
cohesive_energy=3.511869165642938
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.592944892234892e-19, 2.26055907820962e-19, 2.7716854679883e-19, 3.19656668955876e-19, 3.54526441218252e-19, 3.8421958077617396e-19, 4.0982877209402994e-19, 4.3207659683375397e-19, 4.51483762401396e-19, 4.68442802072286e-19, 4.83274151173224e-19, 4.96261394968428e-19, 5.077938623799599e-19, 5.18457950055864e-19, 5.28330562474572e-19, 5.36692322327418e-19, 5.434583142528e-19, 5.4893775834108e-19, 5.533517549677499e-19, 5.56822069556994e-19, 5.59427208763878e-19, 5.61229657477128e-19, 5.62279083172398e-19, 5.626187446188059e-19, 5.62255050522888e-19, 5.61079052873532e-19, 5.58960975363384e-19, 5.55735793799142e-19, 5.5123207528096795e-19, 5.4527678473239e-19, 5.3773053278625e-19, 5.2834978859418e-19, 5.164888749726779e-19, 5.0143322114298e-19, 4.82654108815866e-19, 4.5952829128070995e-19, 4.31208217098126e-19, 3.9661081486352996e-19, 3.544014714408e-19, 3.0323596063401e-19, 2.41866186845274e-19, 1.65862131681582e-19, 7.06686467548086e-20, -4.8081801439330196e-20, -1.9677773201124597e-19, -3.8430770049104396e-19, -6.25066783282224e-19, -9.3399687967347e-19, -1.337125349084112e-18, -1.88132386894182e-18, -2.62160958268152e-18, -3.643285578650639e-18, -5.07420555224238e-18, -6.9910176336273e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -1.33896745442359e-24 eV

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

Energy: 0.016793406122438653
Energy: 0.017301337268197773
Energy: 0.3655246146905367
Energy: 0.896488999043011
Energy: 0.8996141687957548
Energy: 0.30338863133671606
Energy: 0.01732086493757288
Energy: 0.017494385190658233
Energy: 0.8579546531248241
Energy: 0.24597231573853717
Energy: 0.3663168333783692
Energy: 0.3666275303486717
Energy: 0.017941564494816896
Energy: 0.09577490008771325
Energy: 0.017147350066661876
Energy: 0.7025243957390519
Energy: 0.5306613877159538
Energy: 0.36496517485020735
Energy: 0.7204161779419979
Energy: 0.09435637338842684
Energy: 0.09606564727555497
Energy: 0.019559647582805664
Energy: 0.6049254995976548
Energy: 0.3658118039917252
Energy: 0.8966146250347252
Energy: 0.8986192222422397
Energy: 0.09475856906055499
Energy: 0.01769097577468931
Energy: 0.09449602000834074
Energy: 0.8639410908183252
Energy: 0.24568705463216797
Energy: 0.36562841099619936
Energy: 0.7086400853451702
Energy: 0.017530691801679328
Energy: 0.09598318760150552
Energy: 0.017204118587449215
Energy: 0.7026255082148811
Energy: 0.3651362754586491
Energy: 0.36495722686039106
Energy: 0.7270030653329845
Energy: 0.09417706210261498
Energy: 0.09580036649170912

minimum gb energy = 0.016793406122438653 eV
minimum distance =  2.51713152767431 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.1314931698584019
Energy: 1.0143297998730894
Energy: 1.1595256032748487
Energy: 1.0780379920393934
Energy: 1.0336705245899127
Energy: 1.0888444002490782
Energy: 1.0585469664518072
Energy: 1.01721835859274
Energy: 1.0783579300512187
Energy: 1.0096623012788497
Energy: 1.0939308729742931
Energy: 1.0681970753918235
Energy: 1.025935468084968
Energy: 1.0649700158551112
Energy: 1.0152146129438526
Energy: 1.1149329670621024
Energy: 1.1255533747359925
Energy: 1.087104220372262
Energy: 1.1036255116730236
Energy: 1.126213240818814
Energy: 1.0609668964350234
Energy: 1.0306441363069594
Energy: 1.0923731007860842
Energy: 1.0298079064220855
Energy: 1.0170946534519336
Energy: 1.0899636725211468
Energy: 1.018074190505809
Energy: 1.10415340938563
Energy: 1.1140328085847462
Energy: 1.0221446653852397
Energy: 1.0697439166873117
Energy: 1.0493702501280877
Energy: 1.0854818113317368
Energy: 1.0727314300167314
Energy: 1.0602599051745294
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Energy: 1.0875470507342357
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Energy: 1.0193350927587057
Energy: 1.07832737608089
Energy: 1.0523338671779214
Energy: 1.0660954223053964
Energy: 1.006164059007095
Energy: 1.058615303430592
Energy: 1.116420060328187
Energy: 1.0797158816011507
Energy: 1.1199243789685653
Energy: 1.1245883112469102
Energy: 1.0859162161409444
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Energy: 1.104080951536599
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Energy: 1.0803535940478903
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Energy: 1.0101744311896474
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Energy: 1.0826082851976768
Energy: 1.1149227311609504
Energy: 1.1028623732865046
Energy: 1.1241173482766658
Energy: 1.0895765647373863
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Energy: 1.1213991156639864
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Energy: 1.0401131088127336
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Energy: 1.0892964950431105
Energy: 1.0232974998685778
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Energy: 1.0855613253063645
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Energy: 1.130253866510781
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Energy: 1.0368624589325295
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Energy: 1.1280848090435505
Energy: 1.0775377695733237
Energy: 1.1291232877258903
Energy: 1.1090944108269518
Energy: 1.0692820502958051
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Energy: 1.0133100310064154
Energy: 1.0737093049009492
Energy: 1.0552018422756135
Energy: 1.0812553091046728
Energy: 1.0934771558792449
Energy: 1.131639185448953
Energy: 1.092667939849258
Energy: 1.081362822592333
Energy: 1.0694087609022385
Energy: 1.0684619279455905
Energy: 1.0910272271476418
Energy: 1.176370095927676
Energy: 1.0423177275491755
Energy: 1.047374785652601
Energy: 1.1497997051374287
Energy: 1.0186058077459546
Energy: 1.0758051365187375
Energy: 1.049303198290877
Energy: 1.025863698356392
Energy: 1.0690578186139146
Energy: 1.1370646700951896
Energy: 1.0702429265762465
Energy: 1.1101810235726806
Energy: 1.0798819393675594
Energy: 1.0611840252488025
Energy: 1.1268218403895807
Energy: 1.0675708884260484
Energy: 1.0413234592155705
Energy: 1.1032582827534678
Energy: 1.0089064018186529
Energy: 1.0282513907287212
Energy: 1.1117861927589965
Energy: 1.042136138099888
Energy: 1.10357228186686
Energy: 1.0925551525682007
Energy: 1.0457524728128496
Energy: 1.065995128037485
Energy: 1.0446571727749543
Energy: 1.0767868180955091
Energy: 1.0507811989359113
Energy: 1.0547534006348036
Energy: 1.0354323348199475
Energy: 1.0818951560646104
Energy: 1.0138474917520632
Energy: 1.0417663828338122
Energy: 1.0168521432947029
Energy: 1.0379133267797023
Energy: 1.007214205353027
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Energy: 1.1145480847381246
Energy: 1.120388523400088
Energy: 1.0727977740029853
Energy: 1.0393132333982105
Energy: 1.079696267047109
Energy: 1.0677427868140925

minimum gb energy = 1.0010534496030012 eV
minimum distance =  2.28951537924066 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.0722178952847023
Energy: 1.042607596616184
Energy: 1.115058659870975
Energy: 1.0627464730585736
Energy: 1.3202273703077676
Energy: 1.059657040897498
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Energy: 1.089013453626101
Energy: 1.0510232850265835
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Energy: 1.1657546763170432
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Energy: 1.058338752888214
Energy: 1.029626851895071
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Energy: 1.0718863704655541
Energy: 1.1054580685189097
Energy: 1.0738583361940213
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Energy: 1.0695538136537093
Energy: 1.0821587586856476
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Energy: 1.1624965149064868
Energy: 1.099712670791729
Energy: 1.1534938700550743
Energy: 1.0796762002821043
Energy: 1.0896060836021197
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Energy: 1.08488294647442
Energy: 1.0598020438633844
Energy: 1.0310761657677956
Energy: 1.0165051927669218
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Energy: 1.1319063185529585
Energy: 1.1683619819417148
Energy: 1.0939045834655072
Energy: 1.0459062037444953
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Energy: 1.0163920788325935
Energy: 1.1224372774139832
Energy: 1.094192892498915
Energy: 1.1057692253085907
Energy: 1.0310273596580988
Energy: 1.0305208633715321
Energy: 1.009250429156086
Energy: 1.0285941401739085
Energy: 1.1261560793781322
Energy: 1.099689088971141
Energy: 1.1118688531442353
Energy: 1.0487861953492594
Energy: 1.0317696099909848
Energy: 1.018550294419893
Energy: 1.1134008055141498
Energy: 1.128202686136485
Energy: 1.0561906795518177
Energy: 1.0747169700012458
Energy: 1.0600995489996847
Energy: 1.0668043304222372
Energy: 1.1376667504308784
Energy: 1.1364015422551077
Energy: 1.0268254702829231
Energy: 1.057151259897274
Energy: 1.0844815152283096
Energy: 1.073167862069656
Energy: 1.027271686096489
Energy: 1.1539705586902465
Energy: 1.0140859056890108
Energy: 1.025038594854803
Energy: 1.0297239552562425
Energy: 1.0325894846030348
Energy: 1.0795825286821499
Energy: 1.0252658693851668
Energy: 1.0659248066821296
Energy: 1.026517930799501
Energy: 1.0263600942484066
Energy: 1.0263423743272717
Energy: 1.0685282993550422
Energy: 1.080908562901051
Energy: 1.0713261373980993
Energy: 1.0512566368826723
Energy: 1.0436559826924128
Energy: 1.0263935406525915
Energy: 1.041660720725516
Energy: 1.0315317276413152
Energy: 1.0723143675932563
Energy: 1.0125604939192896
Energy: 1.0508148606609191
Energy: 1.0792747751100993
Energy: 1.0289742286762023
Energy: 1.0439123131014425
Energy: 1.0929517533209991
Energy: 1.1108650626772871
Energy: 1.0739945117175447
Energy: 1.0433911871626638
Energy: 1.137531299596657
Energy: 1.075649627701136
Energy: 1.0470388795338474
Energy: 1.0994746781472637
Energy: 1.067509044861809
Energy: 1.0346748437410325
Energy: 1.0328135733092012
Energy: 1.062313088234049
Energy: 1.176027736714865
Energy: 1.1759854630188904
Energy: 1.1123686684706484
Energy: 1.0860216804746081
Energy: 1.0629513373754742
Energy: 1.0102958800617234
Energy: 1.0244110109747515
Energy: 1.0744347927497384
Energy: 1.0292747285556139
Energy: 1.1178382857903577
Energy: 1.030949488019142
Energy: 1.0369283538040597
Energy: 1.038465675116106
Energy: 1.0274471919821244
Energy: 1.110924738660867
Energy: 1.038318377690062
Energy: 1.0821295142331637
Energy: 1.111747298461217
Energy: 1.0487328617412055
Energy: 1.0168389610945778
Energy: 1.1094624953893983
Energy: 1.0870362580940074
Energy: 1.053436418520657
Energy: 1.0863323303738037
Energy: 1.0490722712767229
Energy: 1.0239580574108502
Energy: 1.101787178016256
Energy: 1.1019176664169177
Energy: 1.0469071545488327
Energy: 1.0628991575721831
Energy: 1.0818364991327498
Energy: 1.0690006870942639
Energy: 1.0369585918027875
Energy: 1.1803667512845064
Energy: 1.0349573195561728
Energy: 1.0420059284722023
Energy: 1.0463111715730786
Energy: 1.0402703494495065
Energy: 1.051669608324117
Energy: 1.0947140383356773
Energy: 1.0397541923325129
Energy: 1.0531362065867451
Energy: 1.0745389533277248

minimum gb energy = 1.009250429156086 eV
minimum distance =  2.29749149521413 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.193690304715993
Energy: 1.034898851697162
Energy: 1.1176178420338523
Energy: 1.0289656858962761
Energy: 1.1961931225724063
Energy: 1.0853307336772775
Energy: 1.1477737121379141
Energy: 1.0533678910350193
Energy: 1.0582239614395772
Energy: 1.0480836466468484
Energy: 1.0553480986085106
Energy: 1.0919817948125612
Energy: 1.0593530022053297
Energy: 1.087647527046397
Energy: 1.0762013045109495
Energy: 1.0910324718053814
Energy: 1.0424824468674108
Energy: 1.0332615807746237
Energy: 1.0943748415062873
Energy: 1.0625464577665968
Energy: 1.0547016742637916
Energy: 1.0581064731235224
Energy: 1.0403918505970327
Energy: 1.059472996989981
Energy: 1.098072587283043
Energy: 1.092921157365001
Energy: 1.0578096922763731
Energy: 1.0604770525183527
Energy: 1.0899446658014569
Energy: 1.1026347152537341
Energy: 1.0840785194015772
Energy: 1.0907772030209884
Energy: 1.0651546163988896
Energy: 1.1655918987806095
Energy: 1.084767322153388
Energy: 1.0416535068898192
Energy: 1.0612504249069104
Energy: 1.0558552514222206
Energy: 1.0444949532592167
Energy: 1.0564746724859482
Energy: 1.0308755474827787
Energy: 1.0866190358761367
Energy: 1.0481488898653906
Energy: 1.022736258636072
Energy: 1.1343923573394792
Energy: 1.0228526587170432
Energy: 1.1309497343076753
Energy: 1.0958066467892351
Energy: 1.0047134243458091
Energy: 1.0823674161157095
Energy: 1.0460975434836857
Energy: 1.076069612030439
Energy: 1.1064191578094895
Energy: 1.1287057862822174
Energy: 1.0957897253451836
Energy: 1.1107448061383864
Energy: 1.0770369113364817
Energy: 1.0761725255467336
Energy: 1.0920716944408766
Energy: 1.0435244350507595
Energy: 1.0585433703437959
Energy: 1.0429686607618127
Energy: 1.092070987402493
Energy: 1.0403975512818364
Energy: 1.1183852306880497
Energy: 1.049554717593721
Energy: 1.1762605880254486
Energy: 1.0782473526923535
Energy: 1.0495145098626721
Energy: 1.0624639370787274
Energy: 1.0856828789762412
Energy: 1.091166131468754
Energy: 1.0585766419009597
Energy: 1.080317820363327
Energy: 1.0634834831264874
Energy: 1.1715333943369282
Energy: 1.107721640538099
Energy: 1.0482601648857313
Energy: 1.083941040587179
Energy: 1.052425846351034
Energy: 1.0485375230403615
Energy: 1.0539503579250487
Energy: 1.029974935156952
Energy: 1.0927335473497906
Energy: 1.0897713791358443
Energy: 1.0678633005227656
Energy: 1.1195168471105061
Energy: 1.023398749216562
Energy: 1.2018639914044877
Energy: 1.041539590643025
Energy: 1.0993954229351612
Energy: 1.1032672197381457
Energy: 1.0880168010824554
Energy: 1.0704550143892908
Energy: 1.1047620330683694
Energy: 1.132253655960764
Energy: 1.10086659148138
Energy: 1.1402765879962795
Energy: 1.0517933537684365
Energy: 1.0735851628732067
Energy: 1.0656580318062618
Energy: 1.0429686461603076
Energy: 1.0646916929202255
Energy: 1.0857399099803986
Energy: 1.0863996744061664
Energy: 1.0447183048661448
Energy: 1.1034182102473185
Energy: 1.0416074287636954
Energy: 1.0329307068614755
Energy: 1.079390178908031
Energy: 1.042017880415946
Energy: 1.0767836500704373
Energy: 1.0769118855297501
Energy: 1.0674842983411288
Energy: 1.0535156231447393
Energy: 1.1711006955534726
Energy: 1.1033678043415103
Energy: 1.11812868967752
Energy: 1.0742709782915771
Energy: 1.035719062036875
Energy: 1.1079543213288927
Energy: 1.0515241368625274
Energy: 1.0329196732829493
Energy: 1.0668237429329444
Energy: 1.0074226648481386
Energy: 1.0906424433100501
Energy: 1.1403647205662866
Energy: 1.0755379539272707
Energy: 1.063560976460226
Energy: 1.0254992949179438
Energy: 1.0370055491474963
Energy: 1.057536381881694
Energy: 1.09039859452437
Energy: 1.1117236808554731
Energy: 1.072853677634903
Energy: 1.103558089002928
Energy: 1.0854134430663889
Energy: 1.1673776860016856
Energy: 1.069870834748122
Energy: 1.1192994643618333
Energy: 1.0852404399150346
Energy: 1.094169816703715
Energy: 1.0559544573244226
Energy: 1.0852462187266116
Energy: 1.072695321950555
Energy: 1.0412543265116871
Energy: 1.099976717449219
Energy: 1.0528114696744495
Energy: 1.129010141556388
Energy: 1.101911839320028
Energy: 1.0558986540746105
Energy: 1.0815191510839466
Energy: 1.0349588863332715
Energy: 1.0792608941137258
Energy: 1.0608931782019468
Energy: 1.0802342518885493
Energy: 1.0951698602910405
Energy: 1.1582451337413386
Energy: 1.0625721108873998
Energy: 1.0793924141156057
Energy: 1.1055624577672114
Energy: 1.0884061622237025
Energy: 1.1143389303057891
Energy: 1.0555300321741858
Energy: 1.0443127301261668
Energy: 1.0538709469946903
Energy: 1.0320848141815293
Energy: 1.075972139909995
Energy: 1.102261412224573
Energy: 1.0747563056517233
Energy: 1.1406137833980965
Energy: 1.07081656864546
Energy: 1.086567453794827
Energy: 1.040594562803894
Energy: 1.1149357097793064
Energy: 1.117761367590043
Energy: 1.0832030483522495
Energy: 1.0708526249801098
Energy: 1.145653830598577
Energy: 1.1296904135674768
Energy: 1.1181802368321712
Energy: 1.1589078225820768
Energy: 1.0967248760180293
Energy: 1.0713842334161172
Energy: 1.0709406761629399
Energy: 1.0452204616508873
Energy: 1.057357832631042
Energy: 1.1141337495031638
Energy: 1.1254468976831362
Energy: 1.0567841579689998
Energy: 1.0821873589374067
Energy: 1.0571870306642528
Energy: 1.0679401158629462
Energy: 1.082653608948403
Energy: 1.0583567453142142
Energy: 1.093586131692218
Energy: 1.0719413941275318
Energy: 1.0923920579293185
Energy: 1.0765313104745586
Energy: 1.160087439916042
Energy: 1.0550347688821564
Energy: 1.0578504300688212
Energy: 1.1031350740645067
Energy: 1.0581098369815902
Energy: 1.0989991418270688
Energy: 1.1056681337413548
Energy: 1.0654907960861228
Energy: 1.0698184628487701
Energy: 1.036379567948998
Energy: 1.0645382845753515
Energy: 1.1246055026165345
Energy: 1.101958869676978
Energy: 1.0954174838971666
Energy: 1.0727932997225618
Energy: 1.0745742842004247
Energy: 1.0364768871282144
Energy: 1.1148327914641922
Energy: 1.0614712957552395
Energy: 1.075980938974494
Energy: 1.0976140960360459
Energy: 1.139074632453419
Energy: 1.1321536952205333
Energy: 1.118860372851622
Energy: 1.1785749665254461
Energy: 1.0748241465575055
Energy: 1.0345777646091796
Energy: 1.090085145021941
Energy: 1.058223494127246
Energy: 1.0606676331745983
Energy: 1.0538716727182653
Energy: 1.0811559695972042
Energy: 1.069954824835157
Energy: 1.0726077000123613
Energy: 1.0684288313224066
Energy: 1.0479914601920424
Energy: 1.0858028686137862
Energy: 1.0575565321717613
Energy: 1.0635094910102625
Energy: 1.058634835115099
Energy: 1.0818582754485393
Energy: 1.062696732615938
Energy: 1.1397822848128316
Energy: 1.075171645324148
Energy: 1.090878188713643
Energy: 1.0715543208640923
Energy: 1.0498805090616945
Energy: 1.1063462991331945
Energy: 1.0902319625818686
Energy: 1.1440104669052573
Energy: 1.076940707887873
Energy: 1.065072221568217
Energy: 1.036486316129147

minimum gb energy = 1.0047134243458091 eV
minimum distance =  2.29780611977022 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.9898615408434925
Energy: 1.0223939952380887
Energy: 1.302725600001992
Energy: 1.192977382086015
Energy: 1.0733294067397579
Energy: 1.1048334284923909
Energy: 0.9733589249477205
Energy: 0.9735721444650344
Energy: 1.0726129037014132
Energy: 1.0970038738503693
Energy: 1.062179539687759
Energy: 1.0255077125100913
Energy: 1.0383268547475464
Energy: 1.0994143836111505
Energy: 1.0379041044862392
Energy: 1.0134548251110473
Energy: 1.0342723440336987
Energy: 1.0530613328130243
Energy: 1.025838106999161
Energy: 1.0426005975026376
Energy: 1.0425108198539987
Energy: 1.037757642529987
Energy: 1.0259778324374447
Energy: 1.1025359540541382
Energy: 1.0248450331155883
Energy: 1.0652233555668864
Energy: 1.1107540689898672
Energy: 1.0959352983672177
Energy: 1.040152908830206
Energy: 1.0228411730685296
Energy: 1.1114016427402664
Energy: 1.030605404402748
Energy: 1.0901569677274714
Energy: 1.1053129259256376
Energy: 1.0428114654662604
Energy: 0.972584355725964
Energy: 1.0253445088271687
Energy: 1.0329744880477962
Energy: 1.0133022121809199
Energy: 1.0730771108668957
Energy: 1.038416202414145
Energy: 1.0436548093919873
Energy: 1.0462867427104394
Energy: 1.0572782319110723
Energy: 1.026937183830184
Energy: 1.0509825026668027
Energy: 0.9747537029620598
Energy: 0.9768375884346185
Energy: 1.0329556069767005
Energy: 0.9750440382484653
Energy: 1.0773136350873092
Energy: 1.1216996436950946
Energy: 1.012914161405421
Energy: 1.1228106633589794
Energy: 1.0311643502405334
Energy: 1.0367313555883493
Energy: 0.9752761357342842
Energy: 1.0748671200119708
Energy: 1.1205971497041833
Energy: 1.0147115301508751
Energy: 1.0225257588111103
Energy: 1.0314092968491648
Energy: 1.0431408157879105
Energy: 1.0455235066422515
Energy: 1.0459662598005572
Energy: 1.1118397887599498
Energy: 1.0520530500633467
Energy: 1.024361357933599
Energy: 1.0393008672901187
Energy: 1.041264304787105
Energy: 1.0377874018974942
Energy: 1.0095310624353346
Energy: 1.0302673603245738
Energy: 1.0097904167759821
Energy: 1.023533851352281
Energy: 1.063956518165654
Energy: 1.1006430883635607
Energy: 1.0616794259375264
Energy: 1.0232446409003937
Energy: 1.086335110650619
Energy: 1.0101150984545442
Energy: 1.0642019531472267
Energy: 1.1088123903168197
Energy: 1.052273570401825
Energy: 0.9745814674601491
Energy: 1.0236690581248136
Energy: 1.1251816082647217
Energy: 1.0332642730237138
Energy: 1.1045815873708653
Energy: 1.1156216207121215
Energy: 1.0425046843350287
Energy: 1.0491264463450412
Energy: 1.0110289511665842
Energy: 1.0324320225215693
Energy: 1.0538600359177823
Energy: 0.9735777614387314
Energy: 0.9735211768100882
Energy: 1.0549078066710385
Energy: 0.9854295162609268
Energy: 1.0571578471481196
Energy: 1.0264004003201865
Energy: 1.051080294531469
Energy: 0.9729513116605611
Energy: 0.9733997091406179
Energy: 1.05233406402324
Energy: 0.9733071616525614
Energy: 1.0213743243807167
Energy: 1.0833041544989233
Energy: 1.034412423848894
Energy: 1.0739334961885325
Energy: 1.1044332480952275
Energy: 0.9739806733608469
Energy: 1.0366853785632806
Energy: 1.0717868731717997
Energy: 1.0971140607744756
Energy: 1.0623605514180345
Energy: 1.025298182296638
Energy: 1.0389378183798994
Energy: 1.0431502813145646
Energy: 1.0373782814126185
Energy: 1.0116719068807971
Energy: 1.0967514165421046
Energy: 1.0531513002703594
Energy: 1.0260742533804441
Energy: 1.040509663019826
Energy: 1.0431155939302368
Energy: 1.0379466557719805
Energy: 1.0283988743527466
Energy: 1.1018710616392393
Energy: 1.0249137179401004
Energy: 1.0649627862728375
Energy: 1.110441330478787
Energy: 1.1976006135114063
Energy: 1.0395238700963252
Energy: 1.0233022732596933
Energy: 1.108837861613325
Energy: 1.0314063628902024
Energy: 1.0846785701349226
Energy: 1.1051604101299084
Energy: 1.0425679922011968
Energy: 0.9724316318730999
Energy: 1.0238711976372086
Energy: 1.0328869092960722
Energy: 1.013338818700717
Energy: 1.0737106374297032
Energy: 0.9733360062374256
Energy: 1.0436356018763109
Energy: 1.0461533373941445
Energy: 1.058029992705078
Energy: 1.027088498432545
Energy: 1.0517147368364899
Energy: 0.9750401941451128
Energy: 0.9769343734135568
Energy: 1.0318615848418378
Energy: 0.9746577562905989
Energy: 1.0769483485644618
Energy: 1.1220696353210664
Energy: 1.012309668853565
Energy: 1.1223634340477233
Energy: 1.039306021234651
Energy: 1.0371332090213792
Energy: 0.9755319484338986
Energy: 1.0744184228840312
Energy: 1.120303097225569
Energy: 1.0141075273907842
Energy: 1.0231512154975968
Energy: 1.0349910135133398
Energy: 1.0542554625833729
Energy: 1.046546095520346
Energy: 1.058298114577029
Energy: 1.112289445168798
Energy: 1.0517831187385591
Energy: 1.024394661345356
Energy: 1.0394993435258213
Energy: 1.0413657359132367
Energy: 1.0373910082163358
Energy: 1.0093675401378606
Energy: 1.0307798779463173
Energy: 1.009387857389282
Energy: 1.0235061430019505
Energy: 1.0319632599894821
Energy: 1.099670610874175
Energy: 1.0623372154917594
Energy: 1.0242530405282444
Energy: 1.0885179663653723
Energy: 1.0107019643923685
Energy: 1.0641877811911196
Energy: 1.0327856655611367
Energy: 1.0521769973200907
Energy: 0.9751026820201762
Energy: 1.023385256274422
Energy: 1.1248858501599739
Energy: 1.0333828160628973
Energy: 1.1027549843125817
Energy: 1.114463319195142
Energy: 1.042531350581703
Energy: 1.0500684865236185
Energy: 1.0126763940675172
Energy: 1.0318761188768992
Energy: 1.053834579923069
Energy: 0.9735612839320724
Energy: 0.9736550406823844
Energy: 1.0549463948307536
Energy: 0.9725060409110097
Energy: 1.0569886096791183
Energy: 1.0263208328388007
Energy: 1.0139708110722316
Energy: 0.9727990964617036
Energy: 0.9735151803487699
Energy: 1.0523603074752712

minimum gb energy = 0.9724316318730999 eV
minimum distance =  2.30447799165259 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.2316526081881847
Energy: 1.140427717788679
Energy: 1.0223722364720091
Energy: 1.344577201864166
Energy: 1.1184245655104927
Energy: 1.0669201078055284
Energy: 1.2105236131302857
Energy: 1.030248814125533
Energy: 1.1118580723783413
Energy: 1.1524138616285784
Energy: 1.057169282449669
Energy: 0.9856898081086967
Energy: 1.2321799198114023
Energy: 1.0400959645051944
Energy: 1.1153046386384151
Energy: 1.0319316085891848
Energy: 1.050484237700854
Energy: 1.0255080761667001
Energy: 1.2466520478844518
Energy: 1.119742343754265
Energy: 1.1401489158540508
Energy: 1.2352507720459207
Energy: 1.0268267917254463
Energy: 1.0585288717956263
Energy: 1.0393384301775244
Energy: 0.9818693917615159
Energy: 1.0123864267207934
Energy: 1.160368847470423
Energy: 0.9990423643016049
Energy: 0.9678004681745024
Energy: 1.038833417571883
Energy: 0.998741475895558
Energy: 0.9868701583306353
Energy: 1.0353632481016637
Energy: 1.026217145001579
Energy: 0.9773626489821139
Energy: 0.9763484071706394
Energy: 1.0378962754024565
Energy: 1.0017114304447483
Energy: 1.0158045179061788
Energy: 1.022674324733123
Energy: 1.0214363976712282
Energy: 1.0099992391755335
Energy: 1.0041516904255867
Energy: 1.0137268566047821
Energy: 1.0122413473638647
Energy: 0.9778704371360865
Energy: 0.9775509686505637
Energy: 1.0388378073902387
Energy: 1.0758746720952261
Energy: 0.9874231930929396
Energy: 1.0502334156420285
Energy: 1.071747060114953
Energy: 1.0106477185334508
Energy: 0.9983934300140802
Energy: 1.026655263977907
Energy: 1.0134851938183522
Energy: 1.0200112245666775
Energy: 1.0331874003660093
Energy: 1.0313032215677551
Energy: 0.9866529828542351
Energy: 1.1363390431380378
Energy: 1.0381272709093552
Energy: 1.1202595443516905
Energy: 1.2423774115486825
Energy: 1.0298715230694202
Energy: 1.0196060324292295
Energy: 1.0040817158162414
Energy: 1.0665381715671725
Energy: 1.2385625777757958
Energy: 1.003109435057486
Energy: 1.031008537056792
Energy: 1.0493860006437015
Energy: 1.0396669403221468
Energy: 1.1001001641551273
Energy: 0.9851043403042914
Energy: 1.0610620242669166
Energy: 1.0760515346524544
Energy: 1.1285231315671576
Energy: 1.1563256622859968
Energy: 1.025465439233063
Energy: 1.2096921146905242
Energy: 1.2109015948108206
Energy: 1.1578984480028103
Energy: 1.209974719285774
Energy: 1.094605753152849
Energy: 1.0220760690823532
Energy: 1.1797448128938282
Energy: 0.9969777201245844
Energy: 1.0123352258707086
Energy: 1.0782718422493027
Energy: 0.9843015052925085
Energy: 1.0681244665847047
Energy: 1.0259900659727754
Energy: 1.103545694924191
Energy: 0.9970438672881439
Energy: 1.0571204721141585
Energy: 1.0512275742904775
Energy: 1.0750042999552272
Energy: 1.0201929417607232
Energy: 1.13895390415978
Energy: 1.0247953108790577
Energy: 1.246462932027457
Energy: 1.2375226506915187
Energy: 1.025096583005569
Energy: 1.2349289126465097
Energy: 1.0006369009992624
Energy: 1.058309121450607
Energy: 1.0317929887598858
Energy: 1.0448952297193197
Energy: 1.0674429919439616
Energy: 1.201246172389209
Energy: 0.9999543445989804
Energy: 1.0244577994594617
Energy: 1.0364213821084145
Energy: 1.0637047819902015
Energy: 1.0015834034275977
Energy: 1.0231311975757038
Energy: 1.027575633226122
Energy: 0.9784621893836734
Energy: 1.0099912041927683
Energy: 1.0574389152096195
Energy: 1.0747916696362745
Energy: 0.9660461308144612
Energy: 1.0376659899841745
Energy: 1.0081938602610032
Energy: 0.9785939652710541
Energy: 0.9956378630988635
Energy: 1.0902537913980412
Energy: 1.056430460846362
Energy: 0.9773362369943585
Energy: 0.9777593511504921
Energy: 1.0247531392309952
Energy: 1.0082184812244999
Energy: 0.9867465906060147
Energy: 1.0698203608997838
Energy: 1.057706695591957
Energy: 1.0113360681477235
Energy: 0.9990877536019817
Energy: 1.0274790321399512
Energy: 1.0682363477805297
Energy: 1.040858652015167
Energy: 1.0563476862097139
Energy: 1.0566720344654918
Energy: 1.1490503027273564
Energy: 1.1381221648559559
Energy: 1.0377752984702442
Energy: 1.1214517172663603
Energy: 1.0314618254104602
Energy: 1.0310918984519668
Energy: 1.050960625227932
Energy: 1.0565953238993988
Energy: 1.0432621660636008
Energy: 1.1292710760665963
Energy: 1.2345333454140104
Energy: 1.0000876766158864
Energy: 1.1800266667441597
Energy: 1.2128549863394447
Energy: 1.1049042761321821
Energy: 1.0376438013008136
Energy: 1.0039408051709355
Energy: 1.0738644987846253
Energy: 1.0419017228095084
Energy: 1.09897221960998
Energy: 1.1772421949375476
Energy: 1.2087439492449394
Energy: 1.208703888078543
Energy: 1.1574263901424284
Energy: 0.9836972006167042
Energy: 1.0682067753438518
Energy: 1.1738925312315724
Energy: 1.101936828899203
Energy: 1.025307667180144
Energy: 1.0569634452929713
Energy: 1.0612573755107413

minimum gb energy = 0.9660461308144612 eV
minimum distance =  2.30668226082656 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.2136503163144934
Energy: 1.217317068659357
Energy: 1.2821914022378191
Energy: 1.3296719098852845
Energy: 1.2846644902371624
Energy: 1.1946976581476356
Energy: 1.1876107542219012
Energy: 1.323870773470643
Energy: 1.2204256379879639
Energy: 1.171291170508474
Energy: 1.1575601203602426
Energy: 1.1395618280690094
Energy: 1.2900599130134027
Energy: 1.110680446036997
Energy: 1.2874599601025956
Energy: 1.1484371806213844
Energy: 1.2060231159619712
Energy: 1.1309634250374467
Energy: 1.2596157863792952
Energy: 1.213527338472224
Energy: 1.0827678739635915
Energy: 1.1939543197654434
Energy: 1.2391985018277336
Energy: 1.21854196886551
Energy: 1.2197818817461192
Energy: 1.2703294573868413
Energy: 1.2109300214832937
Energy: 1.2137546674203672
Energy: 1.0833095021788097
Energy: 1.2603325854532905
Energy: 1.10715912914916
Energy: 1.157299368720719
Energy: 1.1258911923208672
Energy: 1.1886947587475907
Energy: 1.2427796516047622
Energy: 1.1053676835597412
Energy: 1.1367680469635062
Energy: 1.10227454740859
Energy: 1.0736872327158664
Energy: 1.124575521257429
Energy: 1.1350296707711307
Energy: 1.119035184882958
Energy: 1.1213296846347522
Energy: 1.1539940861575202
Energy: 1.183106829930969
Energy: 1.1637124332216184
Energy: 1.1543232009940074
Energy: 1.174962018439414
Energy: 1.1622351700400515
Energy: 1.0831585792512606
Energy: 1.0610840216799884
Energy: 1.0518547040699973
Energy: 1.0611107950616807
Energy: 1.1583053789221696
Energy: 1.0798580112093799
Energy: 1.0580470522244496
Energy: 1.0085253083288872
Energy: 1.0686535368714865
Energy: 1.095916474105113
Energy: 1.024502583271045
Energy: 1.1021895499502168
Energy: 1.2255893566643872
Energy: 1.0873286252016887
Energy: 1.155124595721181
Energy: 1.0178699518648904
Energy: 1.1574591591814662
Energy: 1.016510428477156
Energy: 1.040006895529522
Energy: 1.1065433898022734
Energy: 1.0346813196467737
Energy: 1.0791220430411221
Energy: 1.0807890513766834
Energy: 1.0561046278850332
Energy: 1.048626025676989
Energy: 1.073826044245097
Energy: 1.1575570712235752
Energy: 1.0516013940160729
Energy: 1.0334914670930095
Energy: 1.131161949530197
Energy: 1.2134474373959063
Energy: 1.1215049345710584
Energy: 1.0564628274938557
Energy: 1.1307776127830396
Energy: 1.0745995663620391
Energy: 1.0913084587285156
Energy: 1.0498992687737696
Energy: 1.0982146397271835
Energy: 1.028738886553816
Energy: 1.120428089408493
Energy: 1.0192856872814324
Energy: 1.0094392242801085
Energy: 1.116869330561119
Energy: 1.0273016305145597
Energy: 1.1083437510998917
Energy: 1.0634060768546323
Energy: 1.0167538901226396
Energy: 1.1483535278833745
Energy: 1.067779537838331
Energy: 1.0543800555788305
Energy: 1.1539707658044354
Energy: 1.144519667592331
Energy: 1.0829176490274586
Energy: 1.0627639557581576
Energy: 1.1281334560763598
Energy: 1.1808371818428627
Energy: 1.0170626518043735
Energy: 1.1608750433274817
Energy: 1.1318996370658734
Energy: 1.0749745018580867
Energy: 1.047563035659573
Energy: 1.134414585447365
Energy: 1.1112057795195938
Energy: 1.1117944788209704
Energy: 1.2579742962774512
Energy: 1.166247130143358
Energy: 1.1940020417975934
Energy: 1.155630218890968
Energy: 1.2359436943729407
Energy: 1.1950022326991654
Energy: 1.1546581126996294
Energy: 1.2078432238019574
Energy: 1.1806945962211959
Energy: 1.1177137067021188
Energy: 1.175172528961357
Energy: 1.2093646003863898
Energy: 1.1699138016274822
Energy: 1.2281382145013313
Energy: 1.2207571255772367
Energy: 1.2019348930897509
Energy: 1.0654189443024888
Energy: 1.1001472523378268
Energy: 1.1559185769926321
Energy: 1.1562121211288134
Energy: 1.1866792633224075
Energy: 1.204993271513076
Energy: 1.2185420513376881
Energy: 1.3081841289873688
Energy: 1.2700899350338895
Energy: 1.2132073102802217
Energy: 1.0840495700308095
Energy: 1.3051904332805622
Energy: 1.1958754687519235
Energy: 1.1198602524755692
Energy: 1.2323028481409548
Energy: 1.1544934341359665
Energy: 1.1921282014412415
Energy: 1.2073596455099802
Energy: 1.3037994837333853
Energy: 1.2032948245171893
Energy: 1.1530264634815153
Energy: 1.328103038246177
Energy: 1.219874242556903
Energy: 1.1650293684263242
Energy: 1.1028803845998854
Energy: 1.2001295451047718
Energy: 1.1373799831138638
Energy: 1.2206497992682943
Energy: 1.3031605989310584
Energy: 1.303042937893163
Energy: 1.2205279876153499
Energy: 1.1109853633000089
Energy: 1.3266627828301405
Energy: 1.1370886316975677
Energy: 1.147977875646068
Energy: 1.0716634271406391
Energy: 1.071265322884445
Energy: 1.0374785624018983
Energy: 1.1330530272186472
Energy: 1.1215842516092998
Energy: 1.1977029783085378
Energy: 1.2053226442031892
Energy: 1.2260287222187127
Energy: 1.2558384325773015
Energy: 1.2072125773039424
Energy: 1.204164082278217
Energy: 1.1227111134658199
Energy: 1.256723419966295
Energy: 1.192815719786736
Energy: 1.2153739391356195
Energy: 1.2726141859559463
Energy: 1.2128564072409904
Energy: 1.2224725348812637
Energy: 0.9876182095700706
Energy: 1.101207362689112
Energy: 1.111596224957586
Energy: 1.1038571236945587
Energy: 1.1492624162308196
Energy: 1.1745198049826415
Energy: 1.2465065092361698
Energy: 1.104569516219751
Energy: 1.135258154565859
Energy: 1.123662452833551
Energy: 1.10002335458988
Energy: 1.1110399465537324
Energy: 1.149906048266225
Energy: 1.1423862017274542
Energy: 1.0971410122360787
Energy: 1.0892323003380067
Energy: 1.1363989745499294
Energy: 1.105657448667912
Energy: 1.0810193507814996
Energy: 1.1434746127411097
Energy: 1.12379362635704
Energy: 1.1164686513828257
Energy: 1.0759725168223078
Energy: 1.1199940643432564
Energy: 1.0669251143439884
Energy: 1.0679060497497435
Energy: 1.0729320659395047
Energy: 1.085895137883346
Energy: 1.0127725097241913
Energy: 1.0476249554964274
Energy: 1.1141432950738048
Energy: 1.086187638673624
Energy: 1.1304104841709512
Energy: 1.2124183417688843
Energy: 1.078206423680621
Energy: 1.0566515250606563
Energy: 1.110974554734255
Energy: 1.0356428527429777
Energy: 1.0166648333528894
Energy: 1.007699166995666
Energy: 1.1650777174072466
Energy: 1.029402718752438
Energy: 1.0896082192752437
Energy: 1.0969741716304158
Energy: 1.0710208047600276
Energy: 1.0543758298388193
Energy: 1.0587363466712434
Energy: 1.086746011098738
Energy: 1.0499421617410731
Energy: 1.0363980219236049
Energy: 1.0168616194388804
Energy: 1.131486759689051
Energy: 1.0798036538477453
Energy: 1.1344331438609612
Energy: 1.1911760993970608
Energy: 1.0213714686030577
Energy: 1.0930437841516012
Energy: 1.0487482324821964
Energy: 1.0898373561100259
Energy: 1.0522496596898117
Energy: 1.107877435115933
Energy: 1.0099526631551992
Energy: 1.047123159402078
Energy: 1.1138091218032986
Energy: 1.0478444253145556
Energy: 1.086753965676884
Energy: 1.0466183715682464
Energy: 1.062708905765896
Energy: 1.144693593361277
Energy: 1.0567865858182657
Energy: 1.0552370639450195
Energy: 1.0949369494643548
Energy: 1.0934275438329633
Energy: 1.052663588412967
Energy: 1.0609633537393042
Energy: 1.129713034528303
Energy: 1.087905615764903
Energy: 1.0572478396645337
Energy: 1.2005069963550925
Energy: 1.1271175778580593
Energy: 1.0680430658217595
Energy: 1.0651560554123678
Energy: 1.1117144162756682
Energy: 1.167138558524485
Energy: 1.1065199516626607
Energy: 1.1813720481967849
Energy: 1.166722888997681
Energy: 1.1909274735764335
Energy: 1.1550332036262345
Energy: 1.1770737250170515
Energy: 1.1144894283777558
Energy: 1.0974624206963464
Energy: 1.158296923139252
Energy: 1.1746264264432518
Energy: 1.1172498114525795
Energy: 1.2024497702826802
Energy: 1.2172980875771826
Energy: 1.1737413756196498
Energy: 1.2868845800818771
Energy: 1.254267413069116
Energy: 1.1882614588116642
Energy: 1.161127040139307
Energy: 1.2802682436239579
Energy: 1.2036110739082424
Energy: 1.1564678636000758
Energy: 1.2098632914615537
Energy: 1.1531402490785534
Energy: 1.2447375177983508
Energy: 1.3055862936445182
Energy: 1.2686640430138145
Energy: 1.2125785681555112
Energy: 1.2200357082358624
Energy: 1.2786488213472795
Energy: 1.2178754819466586
Energy: 1.1222321888863327
Energy: 1.346102058283118
Energy: 1.2263253683154784
Energy: 1.2010227135229206
Energy: 1.1152726227143488
Energy: 1.2992835935614713
Energy: 1.1550570648052298
Energy: 1.1565488214727295
Energy: 1.2248219192061285
Energy: 1.239521041624003
Energy: 1.21002106878733
Energy: 1.0815984864350638
Energy: 1.0188264941125755
Energy: 1.1833807592876786
Energy: 1.2789623550128382
Energy: 1.272401131145651
Energy: 1.0963707909254312
Energy: 1.1979519403930616
Energy: 1.1409170739943104

minimum gb energy = 0.9876182095700706 eV
minimum distance =  2.27131280890123 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.093344046246777
Energy: 1.0437907641974826
Energy: 0.9929540014493896
Energy: 1.0511748005270312
Energy: 1.0444526014203668
Energy: 0.9949123210347566
Energy: 1.0450717721215863
Energy: 1.0927522750597327
Energy: 1.2044146762042491
Energy: 0.9965853167676356
Energy: 0.9965506884826751
Energy: 0.9971832464472338
Energy: 0.9953912065837253
Energy: 1.205185315116906
Energy: 1.0503230850326797
Energy: 1.2697375172390601
Energy: 0.994117259512112
Energy: 0.9941001920382402
Energy: 0.9944375870111852
Energy: 0.9939347692419436
Energy: 1.0447667606765139
Energy: 1.051627771374092
Energy: 1.2704916680658984
Energy: 0.9946785711001961
Energy: 0.9959191693124199
Energy: 0.9941439253783299
Energy: 0.9942556884552637
Energy: 1.0489218128999787
Energy: 1.0924234617780264
Energy: 1.205000815178402
Energy: 1.0084328600918266
Energy: 1.2044927002142631
Energy: 0.9958278999984872
Energy: 1.0077730423562656
Energy: 1.2051855839040047
Energy: 1.0517818845987625
Energy: 1.3327456205247505
Energy: 0.9943652129129126
Energy: 1.0519682839821534
Energy: 1.0447728663522013
Energy: 0.9941138534110119
Energy: 1.0454964249665226
Energy: 1.051250913974999
Energy: 1.204820045082917
Energy: 0.9947260083136873
Energy: 0.995326424497049
Energy: 0.9953835322052713
Energy: 0.996228959016371
Energy: 1.2046927054048522
Energy: 1.0506278676307397
Energy: 1.270193191175061
Energy: 0.9956555009597128
Energy: 0.9948763076097368
Energy: 0.9948235682278792
Energy: 0.9947539793323285
Energy: 1.2040280578222038
Energy: 1.0525776645850051
Energy: 1.2699602312784812
Energy: 0.9945568610281693
Energy: 1.0451104750666915
Energy: 0.9951395577000931
Energy: 0.9944063856143006
Energy: 1.0462561433155946
Energy: 1.0923330971183056
Energy: 1.2056088573379191
Energy: 1.0428558269722656
Energy: 1.2049612028162509
Energy: 1.2046007868056197
Energy: 1.0430024516098095
Energy: 1.20483899875245
Energy: 1.051882576634802
Energy: 1.2705272052230057
Energy: 0.9945509317321237
Energy: 1.0447367268317225
Energy: 0.9954348569674899
Energy: 0.9942475233617125
Energy: 1.0473925298057074
Energy: 1.0503307985970824
Energy: 1.2700966203583282
Energy: 0.9945313595061499
Energy: 0.9948695932390028
Energy: 0.9945157398441125
Energy: 0.99458949083007
Energy: 1.2720071188997488
Energy: 1.0518558598313075
Energy: 1.2042569281067335
Energy: 0.9942887174000639
Energy: 0.9956131937170264
Energy: 0.9960507268483205
Energy: 0.9950583651132623
Energy: 1.2052615442862689
Energy: 1.052719470470703
Energy: 1.3202751870390657
Energy: 0.9948138694310725
Energy: 1.0514113268144232
Energy: 1.0447941547119337
Energy: 0.995009360907068
Energy: 1.045221800868621
Energy: 1.0925572349505437
Energy: 1.2052661986365343
Energy: 1.008934049828992
Energy: 0.9944802443479644
Energy: 0.9965674732912756
Energy: 0.9956367750942579
Energy: 1.204567371064536
Energy: 1.0508544360632457
Energy: 1.2710795830553359
Energy: 0.9941211305247263
Energy: 0.9949330430172204
Energy: 0.9940816403918904
Energy: 0.9940179031840374
Energy: 1.049221732340983
Energy: 1.0507758918789432
Energy: 1.2695026756859127
Energy: 0.9939697639918409
Energy: 0.9953203868996512
Energy: 0.9939831763786295
Energy: 0.9942728262806141
Energy: 1.0443947256394417
Energy: 1.0926043593857135
Energy: 1.2047495116224032
Energy: 0.9957124322107307
Energy: 0.9972953702147341
Energy: 0.9956960619036719
Energy: 0.9951024356208076
Energy: 1.2038632060862853
Energy: 1.052637625207814
Energy: 1.3215840008883217
Energy: 0.9952504880884685
Energy: 1.051441040035222
Energy: 1.0446774080003336
Energy: 0.9948545766014789
Energy: 1.0450670464683396
Energy: 1.0521542990362223
Energy: 1.2041518259575141
Energy: 0.9945123403752915
Energy: 0.9961336062823711
Energy: 0.9962012523642403
Energy: 0.9949363553637004
Energy: 1.2047336958381123

minimum gb energy = 0.9929540014493896 eV
minimum distance =  2.37911344135083 Angstroms
sigma value = 23