Model name: model_name=MEAM_LAMMPS_MaiselKoZhang_2017_VNiTi__MO_744610363128_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5213917419314393
cohesive_energy=4.450350014970536
mass=58.6934
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=[2.46424379369004e-19, 3.2431099207764596e-19, 3.8238669070687797e-19, 4.2934809002605197e-19, 4.68817711404642e-19, 5.02724575509984e-19, 5.322430778147999e-19, 5.58159887046384e-19, 5.810293563201e-19, 6.01261642854252e-19, 6.1917237544573795e-19, 6.35011493649462e-19, 6.48982473897942e-19, 6.612487382078459e-19, 6.719496759463319e-19, 6.81202246007682e-19, 6.89110589873106e-19, 6.95759622904206e-19, 7.012278517560479e-19, 7.055809656706259e-19, 7.088798473600319e-19, 7.11180573006456e-19, 7.1252800355565e-19, 7.1296860213e-19, 7.12492755669702e-19, 7.109514617477939e-19, 7.081444482850259e-19, 7.038361953161999e-19, 6.977431175770979e-19, 6.895223492680439e-19, 6.787573244641979e-19, 6.64941755349216e-19, 6.474539973891059e-19, 6.2552981232945e-19, 5.982159050730179e-19, 5.6432346055738195e-19, 5.223480349232159e-19, 4.70376629269524e-19, 4.0594830028648193e-19, 3.2586510341262596e-19, 2.25913314100536e-19, 1.0047233650047659e-19, -5.806480382812079e-20, -2.60190281008332e-19, -5.206417168080059e-19, -8.605915550101259e-19, -1.3112662182113519e-18, -1.9200965434846197e-18, -2.76173595109116e-18, -3.95894641908132e-18, -5.724208612656179e-18, -8.450680656032999e-18, -1.2930478677061378e-17, -2.09550284137494e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.022155128573417466
Energy: 0.02489592189101237
Energy: 1.349705124007737
Energy: 1.3493714209264829
Energy: 1.2736694672805908
Energy: 0.49369210063252206
Energy: 0.02296646286207562
Energy: 0.02356141284134084
Energy: 1.26640989719433
Energy: 0.397165509909314
Energy: 0.8684574789496827
Energy: 0.8672885252227815
Energy: 0.02310911667796908
Energy: 0.14628432412296066
Energy: 0.022768645350768727
Energy: 1.266924885726434
Energy: 0.8939380708206464
Energy: 0.8686333674738858
Energy: 0.8682573150911559
Energy: 0.14508207008755508
Energy: 0.1481019165445849
Energy: 0.025756238417658676
Energy: 0.9838883640250741
Energy: 0.8904331736476825
Energy: 1.2019441215079225
Energy: 1.2664624227978836
Energy: 0.14536068897805435
Energy: 0.02399216073766179
Energy: 0.14542944973078994
Energy: 1.2705465739790787
Energy: 0.3971216889352792
Energy: 0.8677395834193035
Energy: 0.9806066909998541
Energy: 0.022943018993726853
Energy: 0.14503034578335972
Energy: 0.02292808413063818
Energy: 1.0104504398605838
Energy: 0.8943014435545775
Energy: 1.2031150374676405
Energy: 0.9911038784556773
Energy: 0.14500104356357865
Energy: 0.14782779024588139

minimum gb energy = 0.022155128573417466 eV
minimum distance =  2.46782232795125 Angstroms
sigma value = 5


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

Energy: 1.676894416441966
Energy: 1.7885643474462276
Energy: 1.8000057318768863
Energy: 1.7794638133133216
Energy: 1.8018835584689936
Energy: 1.8104961486108282
Energy: 1.768805483124425
Energy: 1.5229337636225788
Energy: 1.71116723768666
Energy: 1.577214713751587
Energy: 1.829111482881061
Energy: 1.6163208374603075
Energy: 1.5875768072651606
Energy: 1.6748209680349855
Energy: 1.8107671162106658
Energy: 1.8114460839445663
Energy: 1.8228675091584932
Energy: 1.785975697590662
Energy: 1.7965922326647883
Energy: 1.742948598759549
Energy: 1.7643372873474672
Energy: 1.5779708970902584
Energy: 1.8258025645143778
Energy: 1.6133511285829019
Energy: 1.7637631269859657
Energy: 1.7743536370059805
Energy: 1.6649384792664819
Energy: 1.8697631472355447
Energy: 1.7671582980229612
Energy: 1.6746457981741756
Energy: 1.6626655780731119
Energy: 1.7235114601821353
Energy: 1.753743172043335
Energy: 1.8072081968864089
Energy: 1.7724268543610067
Energy: 1.716685837201979
Energy: 1.660183337862223
Energy: 1.6717380911442232
Energy: 1.7737498461940713
Energy: 1.7485290040419235
Energy: 1.779625274238214
Energy: 1.7627634936448138
Energy: 1.8382434497214555
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Energy: 1.6376423756220657
Energy: 1.7632002629774899
Energy: 1.7835050525855463
Energy: 1.652090676375733
Energy: 1.8398037775052003
Energy: 1.564609200035826
Energy: 1.7979188033259454
Energy: 1.6244984476264264
Energy: 1.7479270914990586
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Energy: 1.6181712771584043
Energy: 1.8604940034048045
Energy: 1.688391637318061
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Energy: 1.6836220808169478
Energy: 1.8748949180166934
Energy: 1.7612266049883067
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Energy: 1.7129627416964808
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Energy: 1.6471420208296645
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Energy: 1.7593445567268442
Energy: 1.5453515824496322
Energy: 1.7231312975094746
Energy: 1.5852971153225204
Energy: 1.8003386372115142
Energy: 1.6190042118133887
Energy: 1.6369083165149043
Energy: 1.6271335939514706
Energy: 1.6734524482630884
Energy: 1.7983839245089632
Energy: 1.8302524372748863
Energy: 1.7769865515700716
Energy: 1.7473907556234787
Energy: 1.8041399505843847
Energy: 1.800694399093535
Energy: 1.5758119061006959
Energy: 1.8523678599488127
Energy: 1.6418215826334297
Energy: 1.8034836336292899
Energy: 1.7572710560868665
Energy: 1.6694744780508046
Energy: 1.7322638186962314
Energy: 1.7417029415396152
Energy: 1.6711284735633471
Energy: 1.6596656243603523
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Energy: 1.6985553118078827
Energy: 1.7803117980058887
Energy: 1.8293638370690286
Energy: 1.7749647866105007
Energy: 1.6595358310832429
Energy: 1.640737899979175
Energy: 1.7757173275902935
Energy: 1.687607245944447
Energy: 1.651996589703014
Energy: 1.7604423278409085
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Energy: 1.7310660134255234
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Energy: 1.7775593185956802
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Energy: 1.772776999905756
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Energy: 1.791825649012513
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Energy: 1.7354641562390047
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Energy: 1.733786688847928
Energy: 1.7853744793261954
Energy: 1.6398979308871229
Energy: 1.6172856730797656
Energy: 1.5980881059083327
Energy: 1.7245453056384707
Energy: 1.6898403943821814
Energy: 1.5827377978988082
Energy: 1.680907230012591
Energy: 1.7974509734234394
Energy: 1.864582987167119
Energy: 1.7523153278908263
Energy: 1.7671537071101548
Energy: 1.7677712855159413
Energy: 1.6703412914677216
Energy: 1.6952556903877047
Energy: 1.5863403366294226
Energy: 1.8189810361489793
Energy: 1.6311262221750504
Energy: 1.7411744573710959
Energy: 1.6253518823615698
Energy: 1.7239041565901208
Energy: 1.7862006717420167
Energy: 1.8645143364808026
Energy: 1.8865910961386605
Energy: 1.6689184069812584
Energy: 1.7175880512956405
Energy: 1.753912415396762
Energy: 1.823194259171099
Energy: 1.7749853729825953
Energy: 1.6365087567443461
Energy: 1.7868442984500525
Energy: 1.5663268404396702
Energy: 1.6880118767820422
Energy: 1.7084590089698066
Energy: 1.6031369473786146
Energy: 1.688727104862253
Energy: 1.7459243605995332
Energy: 1.6989377231634166
Energy: 1.7074836987646753
Energy: 1.698018608035645
Energy: 1.699365141275154
Energy: 1.7344177763070445
Energy: 1.817334623570967
Energy: 1.5668769479147058
Energy: 1.7344950942298223
Energy: 1.577727865432298
Energy: 1.6972101564317064
Energy: 1.6751312550147106
Energy: 1.5848570146955203
Energy: 1.7960032728493476
Energy: 1.753863927056803
Energy: 1.7251007225659765
Energy: 1.7101081359992807
Energy: 1.888033269855962
Energy: 1.894747835895307
Energy: 1.785839963173194
Energy: 1.7507425460230917
Energy: 1.5616555566731654
Energy: 1.7057033958246886
Energy: 1.6683154010592207
Energy: 1.9269535187092581
Energy: 1.65021012888861
Energy: 1.607843579441229
Energy: 1.6674772128121198
Energy: 1.6439789141013095
Energy: 1.7246497091606543
Energy: 1.7348155022574792
Energy: 1.7850132002960872
Energy: 1.7377162968057382
Energy: 1.7166736453957987
Energy: 1.7341112735432707

minimum gb energy = 1.5229337636225788 eV
minimum distance =  2.20538410598405 Angstroms
sigma value = 401


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

Energy: 1.7112833558124891
Energy: 1.5821360360973087
Energy: 1.7172534509230513
Energy: 1.892110200215055
Energy: 2.056534020251993
Energy: 1.7927018731918114
Energy: 1.717474906006942
Energy: 1.5541165200848652
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Energy: 1.6967562427221146
Energy: 1.7388394332981847
Energy: 1.6575288053091093
Energy: 1.6797683426636052
Energy: 1.6603811526369665
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Energy: 1.6671002096888465
Energy: 1.5079919781443096
Energy: 1.6115240012046808
Energy: 1.5701017216548883
Energy: 1.5742672650364342
Energy: 1.8352984212688854
Energy: 1.8151014247300625
Energy: 1.8378480753153794
Energy: 1.8262021386655738
Energy: 1.6229510695250915
Energy: 1.5901691186177402
Energy: 1.8037134022402266
Energy: 1.7685586415996466
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Energy: 1.6312639653621885
Energy: 1.6309596455408069
Energy: 1.6246710174374335
Energy: 1.6058721397867264
Energy: 1.5325479132173234
Energy: 1.7989522983975292
Energy: 1.7818597141057169
Energy: 1.8652689337744748
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Energy: 1.6098700962643724
Energy: 1.6389839251197587
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Energy: 1.67205673620678
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Energy: 1.5821083102937572
Energy: 1.6624077277787057
Energy: 1.8649360542865403
Energy: 1.7632268090496939
Energy: 1.7032726377271312
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Energy: 1.5720777332652431
Energy: 1.7626631733108709
Energy: 1.644456812120027
Energy: 1.643962991396683
Energy: 1.6562523057988368
Energy: 1.726235891053028
Energy: 1.7188798881939185
Energy: 1.8415957057837413
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Energy: 1.7001655469100467
Energy: 1.6558029776485332
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Energy: 1.716777191511463
Energy: 1.8188760138069067
Energy: 1.697033025408812
Energy: 1.60120863967774
Energy: 1.605954135870714
Energy: 1.5940116686119443
Energy: 1.560670662410561
Energy: 1.7543733248595756
Energy: 1.758686469156664
Energy: 1.7698979967678607
Energy: 1.5949033493593328
Energy: 1.5919619752871998
Energy: 1.5908150157359513
Energy: 1.818984347749283
Energy: 1.7162706697397176
Energy: 1.6681763516165335
Energy: 1.6092919245613586
Energy: 1.5391458778391458
Energy: 1.5536421084773002
Energy: 1.581255600619452
Energy: 1.5759865102039916
Energy: 1.8180908896348913
Energy: 1.828416995414192
Energy: 1.7284650360654708
Energy: 1.663021767148086
Energy: 1.7250754419474783
Energy: 1.6255901009169926
Energy: 1.757301204442016
Energy: 1.7537531475966741
Energy: 1.691118442050865
Energy: 1.6232337711169005
Energy: 1.5713897768480267
Energy: 1.7976312614711774
Energy: 1.5821340584099628
Energy: 1.6484478333959776
Energy: 1.7487631285094645
Energy: 1.564806141240322
Energy: 1.6312860386851442
Energy: 1.7587112585051794
Energy: 1.718770745877473
Energy: 1.7232934249398744
Energy: 1.7456893690478963
Energy: 1.6323871771343552
Energy: 1.5869012556080404
Energy: 1.5820453325912402
Energy: 1.6116046926945067
Energy: 1.5289197473960554
Energy: 1.650941149410133
Energy: 1.5943764098123243
Energy: 1.690539172798299
Energy: 1.5962571917266637
Energy: 1.5810018394005168
Energy: 1.6636997748309101
Energy: 1.672755783909716
Energy: 1.7489989407140232
Energy: 1.6934006087489943
Energy: 1.6895552790168105
Energy: 1.555609888253622
Energy: 1.741544251725434
Energy: 1.5623561018938001
Energy: 1.6474159252289668
Energy: 1.8747093152088976
Energy: 1.7181021312501388
Energy: 1.688166979353453
Energy: 1.835564436578434
Energy: 1.7422088137800384
Energy: 1.7111788103677017
Energy: 1.6981056194911495
Energy: 1.693719589289366
Energy: 1.7358554740333327
Energy: 1.911961060877801
Energy: 1.6396971235771407
Energy: 1.6259442717549148
Energy: 1.588216923941024
Energy: 1.5947025787712055
Energy: 1.5788388637594164
Energy: 1.564716354300472
Energy: 1.7586464964132125
Energy: 1.7545415936351167
Energy: 1.7357620978437358
Energy: 1.7848737596044122
Energy: 1.6447176143171693
Energy: 1.5850270298170865
Energy: 1.802165915011266
Energy: 1.6365038223264181
Energy: 1.6121633676824518
Energy: 1.5802484739678653
Energy: 1.5059944890090415
Energy: 1.5676604775705676
Energy: 1.5800440738450623
Energy: 1.5310571625844436
Energy: 1.7632918974949414
Energy: 1.8231782306921644
Energy: 1.7272631424379785
Energy: 1.6560370346472828
Energy: 1.7564507907867712
Energy: 1.624088581401964
Energy: 1.7590715938917278
Energy: 1.7794169073051662
Energy: 1.590759738465755
Energy: 1.6903806028911599
Energy: 1.558928800023482
Energy: 1.6313756569628748
Energy: 1.7829301923486018
Energy: 1.6621642902251732
Energy: 1.7377090700364906
Energy: 1.6772663746437948
Energy: 1.623928324089924
Energy: 1.7604866854239125
Energy: 1.7109636831807533
Energy: 1.8135416327185605
Energy: 1.8380243492444917
Energy: 1.6718982453256457
Energy: 1.599826572682587
Energy: 1.6711733183884863
Energy: 1.6368629041441725
Energy: 1.5394621294479607
Energy: 1.621692838979607
Energy: 1.6679614918484313
Energy: 1.6853746439155317

minimum gb energy = 1.5059944890090415 eV
minimum distance =  2.21803416567347 Angstroms
sigma value = 311


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

Energy: 1.6820296585304695
Energy: 1.7573622322440678
Energy: 1.708294725997485
Energy: 1.6159050050483936
Energy: 1.7443521079675806
Energy: 1.6715519496035185
Energy: 1.8004325419249263
Energy: 1.6037752435104455
Energy: 1.5835735203310106
Energy: 1.5893855159949002
Energy: 1.7024465674696907
Energy: 1.69939411225573
Energy: 1.6000365008001953
Energy: 1.6932567213998473
Energy: 1.6395933600834613
Energy: 1.6591638937746638
Energy: 1.6457352305659663
Energy: 1.7360341489179332
Energy: 1.742345127222271
Energy: 1.6583535003981698
Energy: 1.658187227040137
Energy: 1.586536178426087
Energy: 1.7615540711964783
Energy: 1.5870906580257231
Energy: 1.684223301250399
Energy: 1.7427799131893382
Energy: 1.6288362950421398
Energy: 1.806679851457541
Energy: 1.794635364217719
Energy: 1.7055660621708708
Energy: 1.6146408704899313
Energy: 1.7535940502756844
Energy: 1.6463455845488555
Energy: 1.7576070204857255
Energy: 1.704391176082946
Energy: 1.7242375386874067
Energy: 1.6149600746081425
Energy: 1.5851412617106266
Energy: 1.5967816750570434
Energy: 1.576679943260673
Energy: 1.6752598082035677
Energy: 1.6462223088650458
Energy: 1.6866503028189903
Energy: 1.680254815447239
Energy: 1.7122254784177438
Energy: 1.6045526018537706
Energy: 1.8167066550804674
Energy: 1.6781875349324604
Energy: 1.8338132621237653
Energy: 1.642907385475826
Energy: 1.6026458402153012
Energy: 1.575381440503067
Energy: 1.726491712288117
Energy: 1.6788681533069094
Energy: 1.657382227695509
Energy: 1.7268394990252818
Energy: 1.6812645370783852
Energy: 1.7062564317135058
Energy: 1.6933288671377789
Energy: 1.6628221128656433
Energy: 1.6911525315054412
Energy: 1.6816292423949737
Energy: 1.6930847495754253
Energy: 1.5560636578601128
Energy: 1.7582552230119908
Energy: 1.6267212476529576
Energy: 1.7049304467488493
Energy: 1.666877393412549
Energy: 1.5831727629853285
Energy: 1.660951238463326
Energy: 1.7347218888157458
Energy: 1.6916128807242157
Energy: 1.6289506306793438
Energy: 1.794218739176332
Energy: 1.689464906014822
Energy: 1.774493415090589
Energy: 1.6375473173554238
Energy: 1.559000623278897
Energy: 1.618971016253541
Energy: 1.5520196905291685
Energy: 1.5862823446634808
Energy: 1.576866712113562
Energy: 1.6466895649701367
Energy: 1.6328432670076432
Energy: 1.7116407237086209
Energy: 1.614153719111391
Energy: 1.7024236675710025
Energy: 1.6488194123188569
Energy: 1.8431423927691197
Energy: 1.6729144492043007
Energy: 1.6823582325057813
Energy: 1.6418273881999361
Energy: 1.7099141448523265
Energy: 1.6605416613012929
Energy: 1.6853513803608369
Energy: 1.7238247222453429
Energy: 1.6593258371985284
Energy: 1.789018793474765
Energy: 1.7176502151093354
Energy: 1.6636344831667722
Energy: 1.6926875243853299
Energy: 1.7387316942972046
Energy: 1.7084236412041591
Energy: 1.6781529038808616
Energy: 1.725570615186206
Energy: 1.5683079138349718
Energy: 1.7218554181392687
Energy: 1.5895118632383385
Energy: 1.638224018239556
Energy: 1.645105805194214
Energy: 1.5942584549091943
Energy: 1.5629628153267274
Energy: 1.7396977641426536
Energy: 1.7004638969122372
Energy: 1.675882508458919
Energy: 1.7954805393015132
Energy: 1.625665373817988
Energy: 1.740473537140818
Energy: 1.632799892571967
Energy: 1.5731846204710767
Energy: 1.6602179522274134
Energy: 1.7249559516549746
Energy: 1.5917989867370335
Energy: 1.5767073312310087
Energy: 1.596158065371048
Energy: 1.6062286327435082
Energy: 1.7048177657412766
Energy: 1.6323527957849524
Energy: 1.7533035135253598
Energy: 1.6099138745757182
Energy: 1.8011804164107492
Energy: 1.6791992360459673
Energy: 1.774138456921423
Energy: 1.6576742015006227
Energy: 1.739076439900571
Energy: 1.6763025539974932
Energy: 1.7106977310799354
Energy: 1.7125041155090002
Energy: 1.6724040245395577
Energy: 1.728182934398102
Energy: 1.6860952420962696
Energy: 1.6292574958993613
Energy: 1.6874752633172942
Energy: 1.70898674852415
Energy: 1.7028679544150005
Energy: 1.6752079811553442
Energy: 1.7637026032002068
Energy: 1.5481881599639076
Energy: 1.6798654742267227
Energy: 1.704937829619457
Energy: 1.5862458660827536
Energy: 1.6289751317834704
Energy: 1.6123835561477153
Energy: 1.6099276877772315
Energy: 1.7693086187632099
Energy: 1.7563534127420068
Energy: 1.72093814858359
Energy: 1.770680792159319
Energy: 1.6482955374641015
Energy: 1.7613824521695949
Energy: 1.7116874224499288
Energy: 1.6446673336614366
Energy: 1.6496787484014819
Energy: 1.790921515968648
Energy: 1.5778218931440648
Energy: 1.5917472536214323
Energy: 1.5680577746844875
Energy: 1.6581367897854025
Energy: 1.7324860895856324
Energy: 1.635332712533008
Energy: 1.7356373648581969
Energy: 1.6893584221792797
Energy: 1.6704699328434673
Energy: 1.7098151748478398
Energy: 1.7542262996300562
Energy: 1.6866925855068031
Energy: 1.724958454643731
Energy: 1.6609912836438134
Energy: 1.7614744709242347
Energy: 1.6911773672349653
Energy: 1.693845461199131
Energy: 1.7299198117026484
Energy: 1.6468895235196126
Energy: 1.6062118266675436
Energy: 1.7304321411971686
Energy: 1.6315301970800995
Energy: 1.7548432305199047
Energy: 1.6184752758375998
Energy: 1.6887034723122898
Energy: 1.606202553482201
Energy: 1.6191716845704236
Energy: 1.627840966208791
Energy: 1.5801779546650412
Energy: 1.6807013249886837
Energy: 1.588905993157225
Energy: 1.5817814155050578
Energy: 1.7210432109924705
Energy: 1.6680542248746326
Energy: 1.6236665021511925
Energy: 1.7842817712715486
Energy: 1.6477260021647842
Energy: 1.7686574956583498
Energy: 1.6825612078289798
Energy: 1.644202604083972
Energy: 1.6864288216194778
Energy: 1.6716352225038922
Energy: 1.6009287989938565
Energy: 1.579878669583579
Energy: 1.671244231705934
Energy: 1.7288342037719662
Energy: 1.7297026763721743
Energy: 1.6480036254149355
Energy: 1.7181379802280448
Energy: 1.71557500721513
Energy: 1.7018387494639522
Energy: 1.6724469563085496
Energy: 1.7867157486646985
Energy: 1.664257364737495
Energy: 1.6893305342372302
Energy: 1.665157618606883
Energy: 1.7633765477970311
Energy: 1.752968722659719
Energy: 1.7177354285766202
Energy: 1.7286339016948717
Energy: 1.6375736290613323
Energy: 1.6215796360674612
Energy: 1.6710934012851846
Energy: 1.6077764885007375
Energy: 1.762680596366158
Energy: 1.6137026817148203
Energy: 1.6973517238474027
Energy: 1.7186127982746222
Energy: 1.6581468543346185
Energy: 1.624325476726927
Energy: 1.731833262262038
Energy: 1.607956666667638
Energy: 1.716727061245964
Energy: 1.6224666330824788
Energy: 1.7154836033652905
Energy: 1.646025712995876
Energy: 1.6213637332612179
Energy: 1.738904986608444
Energy: 1.6204459499113162
Energy: 1.7341255222724963
Energy: 1.6319577795151181
Energy: 1.624567689311624
Energy: 1.6857757062723238
Energy: 1.6806173303137297
Energy: 1.6117333502949758
Energy: 1.7009805453754716
Energy: 1.6738129790659813
Energy: 1.677837629776948

minimum gb energy = 1.5481881599639076 eV
minimum distance =  2.18757460957386 Angstroms
sigma value = 39


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

Energy: 1.5008431264138882
Energy: 1.499617577737852
Energy: 1.8904807378005524
Energy: 1.808210716866299
Energy: 1.6465185524342847
Energy: 1.68412632123276
Energy: 1.5488186637369188
Energy: 1.4573100199957671
Energy: 1.5847939461925862
Energy: 1.644841724512184
Energy: 1.5150842063150016
Energy: 1.5533099341558048
Energy: 1.562917119650987
Energy: 1.56018142012715
Energy: 1.5579265957883457
Energy: 1.5602706911956876
Energy: 1.5710214387933514
Energy: 1.573776364039008
Energy: 1.566844472039943
Energy: 1.5602796701122355
Energy: 1.5565646681537604
Energy: 1.5281691419133414
Energy: 1.5838431862372924
Energy: 1.6215937125439772
Energy: 1.586941421051268
Energy: 1.5635489197643941
Energy: 1.6427012066847038
Energy: 1.663023100628266
Energy: 1.5610071071296363
Energy: 1.49926400095398
Energy: 1.5700509405561063
Energy: 1.6034366081626898
Energy: 1.70915062703787
Energy: 1.6086279274474236
Energy: 1.56454125703905
Energy: 1.4581050032973448
Energy: 1.4996902696614118
Energy: 1.580823112237132
Energy: 1.8796927450174437
Energy: 1.6166834285816154
Energy: 1.5555392271205255
Energy: 1.5598750495282265
Energy: 1.649197413572549
Energy: 1.8788914535181591
Energy: 1.5680304399362366
Energy: 1.8488198386904429
Energy: 1.546584729438706
Energy: 1.4864316289251485
Energy: 1.577304836978531
Energy: 1.4578890291769182
Energy: 1.5875400093614849
Energy: 1.8462664298290876
Energy: 1.5007107824165737
Energy: 1.6303440571796053
Energy: 1.642402242361937
Energy: 1.5607049713619041
Energy: 1.4578224334938348
Energy: 1.5921312612241882
Energy: 1.8456885428506153
Energy: 1.5280753969293175
Energy: 1.6579168346817033
Energy: 1.6492928069779758
Energy: 1.5599586658892552
Energy: 1.8564560561859025
Energy: 1.5481416320195662
Energy: 1.6503122496107263
Energy: 1.5647029470083524
Energy: 1.5544441734439558
Energy: 1.5653756597972488
Energy: 1.5796933218160685
Energy: 1.5260356430096982
Energy: 1.4990715280160554
Energy: 1.6028397931535345
Energy: 1.5890883042779806
Energy: 1.5013507529349404
Energy: 1.595900518970493
Energy: 1.672667185955659
Energy: 1.5612005678759495
Energy: 1.4995419699293724
Energy: 1.5895873620669105
Energy: 1.5662702128449688
Energy: 1.5140812188206965
Energy: 1.6444598903332888
Energy: 1.5780738937254435
Energy: 1.4568345561378107
Energy: 1.556117103597277
Energy: 1.6316448784962398
Energy: 1.647581628792434
Energy: 1.5832738424763573
Energy: 1.6453892421199512
Energy: 1.560687655876754
Energy: 1.7376074080446375
Energy: 1.493388734960122
Energy: 1.6064017979513994
Energy: 1.860620604486277
Energy: 1.461828526855994
Energy: 1.483085715032559
Energy: 1.580070142511049
Energy: 1.4575513278765502
Energy: 1.596071283792874
Energy: 1.5663631104643108
Energy: 1.8502142057089106
Energy: 1.461790831479031
Energy: 1.4612660559760937
Energy: 1.5768330372126749
Energy: 1.5008781575474952
Energy: 1.569843324610493
Energy: 1.8440943876309839
Energy: 1.5918750379996525
Energy: 1.804822618098853
Energy: 1.7025011348625478
Energy: 1.4784954788625237
Energy: 1.564156013668485
Energy: 1.5849092633255926
Energy: 1.6450299640240065
Energy: 1.5147597341472259
Energy: 1.5534338622132664
Energy: 1.5623469197591577
Energy: 1.559941593106155
Energy: 1.561579588710774
Energy: 1.5590622120006836
Energy: 1.570997124411007
Energy: 1.5736086368190743
Energy: 1.5674558499679792
Energy: 1.589651712395217
Energy: 1.5571172411841923
Energy: 1.5501647629509094
Energy: 1.5838538441293095
Energy: 1.6215912113850905
Energy: 1.5876081943890898
Energy: 1.56344579947634
Energy: 1.6427304837437344
Energy: 1.6631749217669305
Energy: 1.5609276516124104
Energy: 1.4991734518987638
Energy: 1.5700488436201714
Energy: 1.5845754993237575
Energy: 1.7094813227686396
Energy: 1.6082488187675692
Energy: 1.564854853904269
Energy: 1.477962926415748
Energy: 1.4999383530258068
Energy: 1.584412870905323
Energy: 1.878921374119434
Energy: 1.6078152633497682
Energy: 1.4618428503837324
Energy: 1.561185749853418
Energy: 1.6490233302883663
Energy: 1.9076930951425657
Energy: 1.5677971598061708
Energy: 1.8477619624272132
Energy: 1.4624943110556337
Energy: 1.4866895359840788
Energy: 1.576785505953267
Energy: 1.4576838439459885
Energy: 1.5896773605846568
Energy: 1.8465908242847835
Energy: 1.5832329293899852
Energy: 1.630661139550511
Energy: 1.6431251293658833
Energy: 1.5601089755241286
Energy: 1.457798971187364
Energy: 1.5935880348961133
Energy: 1.8436783022685865
Energy: 1.528356863899895
Energy: 1.6564139169435468
Energy: 1.6488235533771436
Energy: 1.559955967560752
Energy: 1.8574979959545963
Energy: 1.547641456123504
Energy: 1.6507856430902703
Energy: 1.5649203346800205
Energy: 1.5535654080442283
Energy: 1.5657600963452691
Energy: 1.5799629339555077
Energy: 1.5261114776814266
Energy: 1.498610958495645
Energy: 1.602822690831926
Energy: 1.699347643972058
Energy: 1.5008294274575174
Energy: 1.6651073540808694
Energy: 1.6733767029876088
Energy: 1.5596943318599468
Energy: 1.4991682033824918
Energy: 1.5800019153073852
Energy: 1.5662764205746011
Energy: 1.515682626829649
Energy: 1.6283403520352804
Energy: 1.5575469431402063
Energy: 1.4573518934081562
Energy: 1.5561082428986361
Energy: 1.6307975089737576
Energy: 1.6470494965002496
Energy: 1.584441663834743
Energy: 1.6459678957227135
Energy: 1.5614820151428708
Energy: 1.737766285928492
Energy: 1.4934495584519758
Energy: 1.6041368523038047
Energy: 1.8604310728275475
Energy: 1.460288672808528
Energy: 1.4829721840887102
Energy: 1.579165862903476
Energy: 1.4787581009512165
Energy: 1.5949378817046775
Energy: 1.5664853064987565
Energy: 1.7903583758732156
Energy: 1.461828039423817
Energy: 1.4626986454472823
Energy: 1.579182557923367

minimum gb energy = 1.4568345561378107 eV
minimum distance =  2.28004930474995 Angstroms
sigma value = 21


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

Energy: 1.8613494083887627
Energy: 1.8030011343424974
Energy: 1.8330661732721218
Energy: 1.9510319281104416
Energy: 1.6290625107774044
Energy: 1.7318237350444694
Energy: 1.8536107970176012
Energy: 1.723488681715069
Energy: 1.612982503664168
Energy: 1.715029496307459
Energy: 1.7520470222255315
Energy: 1.855335718368956
Energy: 1.7866274627668957
Energy: 1.9039538148534
Energy: 1.6070302315083385
Energy: 1.6104672501726198
Energy: 1.596194497333461
Energy: 1.814768266529252
Energy: 1.8424757289410985
Energy: 1.5348124650277495
Energy: 1.7609430600475928
Energy: 1.798262564328407
Energy: 1.8148784831030833
Energy: 1.6387626653662581
Energy: 1.7284371438437576
Energy: 1.625324503671499
Energy: 1.6102600289834483
Energy: 1.7091059923210563
Energy: 1.537735441948735
Energy: 1.5373349408411878
Energy: 1.5029451405699061
Energy: 1.5592616955210854
Energy: 1.6583258674565058
Energy: 1.5280032921300566
Energy: 1.5651435133797182
Energy: 1.4915400437102044
Energy: 1.5377909545946375
Energy: 1.7414225126195788
Energy: 1.7813326693168674
Energy: 1.73579935677554
Energy: 1.7306901177691336
Energy: 1.5677148781840873
Energy: 1.862711149688067
Energy: 1.7256924858250882
Energy: 1.6099197057057577
Energy: 1.5375454202062127
Energy: 1.549569439379331
Energy: 1.4881011127649506
Energy: 1.6048857824155605
Energy: 1.7162945611499978
Energy: 1.6095705074647721
Energy: 1.6082512809638634
Energy: 1.649925280917959
Energy: 1.7013071376147275
Energy: 1.5677185014239072
Energy: 1.5590583222514982
Energy: 1.6070864012151493
Energy: 1.596224703755516
Energy: 1.7379095849975057
Energy: 1.7074376885244185
Energy: 1.821515667679276
Energy: 1.693087639604084
Energy: 1.9282671333123722
Energy: 1.7236038352011063
Energy: 1.8628879527909759
Energy: 1.6444344640938946
Energy: 1.7371865428851432
Energy: 1.52282639421323
Energy: 1.731184249305984
Energy: 1.8026114993028326
Energy: 1.507061998864668
Energy: 1.7407180166637704
Energy: 1.6158880491848329
Energy: 1.8696099622277402
Energy: 1.6075203077292841
Energy: 1.780066217986295
Energy: 1.9069469749259893
Energy: 1.6176355624933623
Energy: 1.6562339946728588
Energy: 1.724598661077594
Energy: 2.012652261939524
Energy: 1.7794409609944104
Energy: 1.779366482486308
Energy: 1.8865849197184668
Energy: 1.7734908356553751
Energy: 1.809806744398282
Energy: 1.875008855474205
Energy: 1.8177999391142072
Energy: 1.709559459926221
Energy: 1.722848906414917
Energy: 1.7882164345233058
Energy: 1.7163486753931876
Energy: 1.7844371733446658
Energy: 1.79031874928472
Energy: 1.7685160912532167
Energy: 1.691943643958578
Energy: 1.7406758888662692
Energy: 1.9058748046599796
Energy: 1.6197476884083681
Energy: 1.559186391211049
Energy: 1.630946911709759
Energy: 1.8086829439022107
Energy: 1.857574720943143
Energy: 1.8588527784896065
Energy: 1.6729221521893294
Energy: 1.7730628245873432
Energy: 1.7182219146145337
Energy: 1.6387184112033248
Energy: 1.826296374275104
Energy: 1.6161743255852394
Energy: 1.606389669213789
Energy: 1.9295861930198537
Energy: 1.5445687262074832
Energy: 1.6485577306597978
Energy: 1.690627326352961
Energy: 1.5888372213168283
Energy: 1.6146489891288593
Energy: 1.7928805995176849
Energy: 1.5585733745708334
Energy: 1.4864155768544705
Energy: 1.5370684741551481
Energy: 1.6714286710548023
Energy: 1.7825200611370597
Energy: 1.605943357037812
Energy: 1.8218420254717942
Energy: 1.7961891929453258
Energy: 1.714815859681208
Energy: 1.524772409535427
Energy: 1.6231646028930482
Energy: 1.607801671708828
Energy: 1.5478254754178966
Energy: 1.4877924650710637
Energy: 1.5160700523248423
Energy: 1.6327862238130522
Energy: 1.6031377730144476
Energy: 1.6047763517748714
Energy: 1.5337326672398377
Energy: 1.5971353426422406
Energy: 1.4975689412064217
Energy: 1.5304923597488889
Energy: 1.6066770115998288
Energy: 1.5892515578368047
Energy: 1.8229628033311431
Energy: 1.7664444779226505
Energy: 1.804014280690842
Energy: 1.8383985082364924
Energy: 1.738184998841226
Energy: 1.50766411617507
Energy: 1.807942923510722
Energy: 1.6807903748603892
Energy: 1.6363355650507514
Energy: 1.7397627605505452
Energy: 1.8502083053635916
Energy: 1.735441609352946
Energy: 1.8176198589211565
Energy: 1.7875695139820202
Energy: 1.803399226695158
Energy: 1.9578485703703112
Energy: 1.6539656832662084
Energy: 1.6758959419692478
Energy: 1.9302134866041587
Energy: 1.60487111425494
Energy: 1.560092615620817
Energy: 1.5998670273806044
Energy: 2.0270407956240626
Energy: 1.858812071042917
Energy: 1.8549198634840132
Energy: 1.7218822192146113
Energy: 1.7165792702578377
Energy: 1.8567012435551127
Energy: 2.0298616739301756
Energy: 1.9612014756989162
Energy: 1.6527303501274968
Energy: 1.6741869060285728
Energy: 1.9081665735790214

minimum gb energy = 1.4864155768544705 eV
minimum distance =  2.19561511786436 Angstroms
sigma value = 113


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

Energy: 1.7949181927623314
Energy: 2.0906615469635677
Energy: 1.9165909524632085
Energy: 1.8991141622323455
Energy: 1.8636320793941443
Energy: 1.8829112215120576
Energy: 2.0253482557523936
Energy: 1.9244563197085809
Energy: 1.9008923750097653
Energy: 1.9404644811819227
Energy: 1.9350008131515828
Energy: 1.9629605306762359
Energy: 1.9036399625542286
Energy: 2.0523395230846995
Energy: 1.962637184810197
Energy: 1.8998126368695865
Energy: 1.8226757143495653
Energy: 1.8865630942734228
Energy: 1.908834823290733
Energy: 1.8172451395677431
Energy: 1.9811423652262876
Energy: 1.8287926360731674
Energy: 1.9724570080302768
Energy: 1.7943329126817604
Energy: 1.8277334747205516
Energy: 1.8219304432850887
Energy: 1.796007068726039
Energy: 1.9043340778558855
Energy: 1.7926952771555453
Energy: 1.8685879777943826
Energy: 1.8178096027098365
Energy: 1.824884027167303
Energy: 1.8097335164102675
Energy: 1.7954576768405153
Energy: 1.8846869149191423
Energy: 1.6328399756323073
Energy: 1.760646043344136
Energy: 1.79286007663687
Energy: 1.7480638603595398
Energy: 1.6997027476484583
Energy: 1.6916832040349543
Energy: 1.8077297204163705
Energy: 1.8755125719697108
Energy: 1.774902187764988
Energy: 1.7828521745212396
Energy: 1.7875119585980044
Energy: 1.847028691111325
Energy: 1.861279054948389
Energy: 1.887398440838138
Energy: 1.773557689714047
Energy: 1.6562777800792734
Energy: 1.803595506774661
Energy: 1.877481666051376
Energy: 1.8097917368429297
Energy: 1.8717966004644537
Energy: 1.7134407498277104
Energy: 1.7803700224381702
Energy: 1.7807869440024857
Energy: 1.7776368004022736
Energy: 1.7350492577518186
Energy: 1.740338261998196
Energy: 1.8455594692244663
Energy: 1.7677521571595216
Energy: 1.8177426973449355
Energy: 1.8135535831819072
Energy: 1.8662012667086734
Energy: 1.6526333840792327
Energy: 1.7181668495797542
Energy: 1.698507135978511
Energy: 1.7064939232534326
Energy: 1.8508988721839665
Energy: 1.717074381985605
Energy: 1.8120937469167298
Energy: 1.6157224983120457
Energy: 1.7705941882783152
Energy: 1.7485597057841367
Energy: 1.7398229260593638
Energy: 1.752041115797544
Energy: 1.7203449937218387
Energy: 1.8389126531765116
Energy: 1.7888082941105508
Energy: 1.7587060209040066
Energy: 1.7718654141413481
Energy: 1.8566992903206407
Energy: 1.8789363882565007
Energy: 1.6119609608943373
Energy: 1.7609308779280244
Energy: 1.7770353258186875
Energy: 1.817504437585137
Energy: 1.8031233550724621
Energy: 1.6704625738298482
Energy: 1.864051510845207
Energy: 1.7963746966745542
Energy: 1.7737017265755792
Energy: 1.7203472843016756
Energy: 1.6315706487450023
Energy: 1.9416867156757218
Energy: 1.7835415200289262
Energy: 1.6673854272896886
Energy: 1.820717911883806
Energy: 1.7752759263473903
Energy: 1.653416764517469
Energy: 1.6893100085931663
Energy: 1.8556491504616144
Energy: 1.7543194625312675
Energy: 1.7831701075169353
Energy: 1.7570499553255345
Energy: 1.8514227566849575
Energy: 1.8017883645658506
Energy: 1.8008577799925682
Energy: 1.8255341426393465
Energy: 1.8099570411994805
Energy: 1.8243754365668055
Energy: 1.8940138927548449
Energy: 1.7286333656690651
Energy: 1.8358185220114125
Energy: 1.8130592202616767
Energy: 1.7936214310411518
Energy: 1.9479690909519616
Energy: 1.707610255024502
Energy: 1.8195834371265116
Energy: 1.807044517030216
Energy: 1.7978759432110367
Energy: 1.7901172770085345
Energy: 1.8152295748041216
Energy: 1.7880511305841822
Energy: 1.9711626677601006
Energy: 1.9607447777720142
Energy: 1.8211140017174976
Energy: 1.9237080433697116
Energy: 1.9426633329120369
Energy: 1.968429177369023
Energy: 1.949690204504913
Energy: 1.820757724096844
Energy: 2.0189600271023065
Energy: 1.803264372580042
Energy: 1.917058526910863
Energy: 1.8012536577207685
Energy: 1.883559446525506
Energy: 2.0040675310492704
Energy: 1.954682724455851
Energy: 1.9866836828421426
Energy: 1.798732803795223
Energy: 2.0033199403700452
Energy: 1.8822011498491011
Energy: 1.799969449238455
Energy: 2.0744108395243175
Energy: 1.8733582121644365
Energy: 1.9957026994808267
Energy: 1.8228668403892105
Energy: 2.083804013996474
Energy: 1.886616875160185
Energy: 1.7866204357964897
Energy: 2.094146454707587
Energy: 1.7893233271342097
Energy: 2.000699754770293
Energy: 1.9206138732404168
Energy: 1.8978154746489744
Energy: 1.8634919231230511
Energy: 1.882130036435104
Energy: 2.018730006339668
Energy: 2.0158281438728576
Energy: 1.987243758313551
Energy: 1.930406900444674
Energy: 1.8874758888579453
Energy: 1.892898606674615
Energy: 1.93203194708322
Energy: 2.056483574108861
Energy: 1.8152758033879428
Energy: 1.9008821935193374
Energy: 1.8189013583425166
Energy: 1.88592016695387
Energy: 1.8210295080875287
Energy: 1.8286421289861077
Energy: 1.9321165598600596
Energy: 1.813751818361077
Energy: 1.9792139172653647
Energy: 1.7959965153645197
Energy: 1.8242923984831796
Energy: 1.8211265411559168
Energy: 1.797476012489242
Energy: 2.0934801894846404
Energy: 1.8146836597076637
Energy: 1.8866680453375126
Energy: 1.804069473389845
Energy: 1.8096909530876473
Energy: 1.815415770007733
Energy: 1.8109693173958763
Energy: 1.8824198614532164
Energy: 1.6315683350533041
Energy: 1.827262332262974
Energy: 1.7968572981418958
Energy: 1.8039611115420782
Energy: 1.699144568367603
Energy: 1.6914005247682469
Energy: 1.8126524825408423
Energy: 1.8774459088835753
Energy: 1.778301230563926
Energy: 1.7166654909019976
Energy: 1.7331380316337248
Energy: 1.8296666491112825
Energy: 1.8347453986605122
Energy: 1.8925609675708286
Energy: 1.7921454064222362
Energy: 1.6747539278584416
Energy: 1.7549608056247556
Energy: 1.8793479106105642
Energy: 1.84603846325983
Energy: 1.7993367294982572
Energy: 1.683759843072802
Energy: 1.6722657105924867
Energy: 1.7805180224008081
Energy: 1.8063649526154888
Energy: 1.772763234068987
Energy: 1.741791016424928
Energy: 1.83478805868466
Energy: 1.8057150722736979
Energy: 1.8705646432979455
Energy: 1.8237670142322546
Energy: 1.8740459546802946
Energy: 1.6132624816467935
Energy: 1.663992295960754
Energy: 1.7887108752069896
Energy: 1.7077682549981306
Energy: 1.8220743216831
Energy: 1.6980878104641017
Energy: 1.7701255262039033
Energy: 1.6241895128413324
Energy: 1.792409129331957
Energy: 1.739870313928235
Energy: 1.7364406458951829
Energy: 1.7620974887819338
Energy: 1.7242126081009839
Energy: 1.8394339994764155
Energy: 1.777624027253247
Energy: 1.7676946336956918
Energy: 1.7711059707465469
Energy: 1.8678347797565096
Energy: 1.8801088110348048
Energy: 1.6366099360587805
Energy: 1.8023752158654602
Energy: 1.7791546399063316
Energy: 1.8559994462137894
Energy: 1.8149159681068567
Energy: 1.6700032956245519
Energy: 1.8116722493877866
Energy: 1.7672395915944346
Energy: 1.8666751480293053
Energy: 1.750870073526603
Energy: 1.8485926343280528
Energy: 1.9155264703811856
Energy: 1.807220473633397
Energy: 1.637909936539471
Energy: 1.8257112845400307
Energy: 1.7784596652247466
Energy: 1.668294881828134
Energy: 1.683858533740768
Energy: 1.7362339860984763
Energy: 1.754540210030204
Energy: 1.7896519339411114
Energy: 1.7667243078927926
Energy: 1.8506415949048762
Energy: 1.7164142528243593
Energy: 1.8124753515791403
Energy: 1.818181410978054
Energy: 1.7662115452107354
Energy: 1.819078709763393
Energy: 1.9963621212083942
Energy: 1.7260175982862611
Energy: 1.833682262999752
Energy: 1.8102492986569023
Energy: 1.7137225311764577
Energy: 1.9604815109832265
Energy: 1.7145563152896335
Energy: 1.8368258853643873
Energy: 1.8099803688008047
Energy: 1.798975975528732
Energy: 1.864587166042136
Energy: 1.7868102061697353
Energy: 1.823540033664748
Energy: 1.8592781248594428
Energy: 1.9010789018067682
Energy: 1.874047558967445
Energy: 1.9271454965922405
Energy: 1.9397187010515888
Energy: 1.9534346351717187
Energy: 1.9478582797582586
Energy: 1.8058288695173716
Energy: 2.012180173583274
Energy: 1.8017868944773592
Energy: 1.9201673253987885
Energy: 1.7992333484287688
Energy: 1.8820373058380575
Energy: 2.015562342476752
Energy: 1.9544324255943195
Energy: 1.9327106271840586
Energy: 1.8011513421866838
Energy: 2.0526211383342345
Energy: 1.8810364190578586
Energy: 1.7827233883054356
Energy: 2.0706647030154306
Energy: 1.870918547045976
Energy: 1.9696980511119069
Energy: 1.7962616974587007
Energy: 2.0118876530007292
Energy: 1.8841447441414456
Energy: 1.7775777347893285
Energy: 2.079423412436755
Energy: 1.7856106123369742
Energy: 1.9224110153776102
Energy: 1.8996081708504529
Energy: 1.8978945068887036
Energy: 1.8601295104136293
Energy: 1.882332221659768
Energy: 2.0036766926931238

minimum gb energy = 1.6119609608943373 eV
minimum distance =  2.15916638303606 Angstroms
sigma value = 365


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

Energy: 1.673735760042759
Energy: 1.5681860415607671
Energy: 1.6542106237336023
Energy: 1.604914167243134
Energy: 1.6067354386876582
Energy: 1.6137117174130768
Energy: 1.5682318417834848
Energy: 1.5450499074983153
Energy: 1.9139878132578785
Energy: 1.573745111726032
Energy: 1.5893185113244406
Energy: 1.588722760240987
Energy: 1.574275846230129
Energy: 1.9143228541960458
Energy: 1.592586934287838
Energy: 1.8761800185506634
Energy: 1.5767477726405286
Energy: 1.597568764342104
Energy: 1.5994651046623238
Energy: 1.5755777321654882
Energy: 1.568408738650121
Energy: 1.5935015909983794
Energy: 1.8702114188759678
Energy: 1.5772592131703187
Energy: 1.5778213641674996
Energy: 1.5758263392461234
Energy: 1.5752619268849857
Energy: 1.568890694262122
Energy: 1.5449578007215938
Energy: 1.9153817765680008
Energy: 1.5463543203760275
Energy: 1.8946506477210645
Energy: 1.561642028429755
Energy: 1.5485681004048497
Energy: 1.8966368987127145
Energy: 1.6653517913805191
Energy: 1.8713062271840135
Energy: 1.6555217429582803
Energy: 1.6028292256188716
Energy: 1.603862604638473
Energy: 1.6080769708728666
Energy: 1.5689379782989603
Energy: 1.583200358355183
Energy: 1.912882410177616
Energy: 1.5739672958229678
Energy: 1.5876114599947484
Energy: 1.5857303879706477
Energy: 1.5773469640469602
Energy: 1.9134339836898315
Energy: 1.5926997628935387
Energy: 1.8842643077105967
Energy: 1.5776365066741245
Energy: 1.600572527168946
Energy: 1.5859612668187972
Energy: 1.576723353740398
Energy: 1.9118529511481863
Energy: 1.6664712023033388
Energy: 1.901201943598523
Energy: 1.5771791333555858
Energy: 1.601815910049273
Energy: 1.601943842443129
Energy: 1.5772051400669667
Energy: 1.5694776712612597
Energy: 1.5455932223877615
Energy: 1.8977387382449307
Energy: 1.5469077399049218
Energy: 1.894645041194943
Energy: 1.8948008847712627
Energy: 1.548188908162176
Energy: 1.8982551654905078
Energy: 1.6675988502340902
Energy: 1.8896270226479952
Energy: 1.5775303538242575
Energy: 1.5995974321233484
Energy: 1.576594632968739
Energy: 1.5764229876516973
Energy: 1.5705475585420472
Energy: 1.5926012207598945
Energy: 1.877611961676006
Energy: 1.5781659144442886
Energy: 1.5999820948626224
Energy: 1.60045876853107
Energy: 1.5759877206805322
Energy: 1.9130153519413209
Energy: 1.5830037792200706
Energy: 1.8832155472684213
Energy: 1.5736436146155695
Energy: 1.5877358374332027
Energy: 1.585519324325534
Energy: 1.575872178511774
Energy: 1.9127638387223982
Energy: 1.6742721049063989
Energy: 1.8722700397351102
Energy: 1.6553254324721165
Energy: 1.6034404730504357
Energy: 1.6055031020735995
Energy: 1.6077409913913456
Energy: 1.5701064898276023
Energy: 1.5449889788531195
Energy: 1.9129718770636608
Energy: 1.5454687123489566
Energy: 1.5617435975695957
Energy: 1.5890068379957094
Energy: 1.5807999017796408
Energy: 1.9148479434363879
Energy: 1.5932569095305513
Energy: 1.8715850864159214
Energy: 1.5766985106962463
Energy: 1.5963654814464012
Energy: 1.5770220400790949
Energy: 1.5752793087274952
Energy: 1.568740286032234
Energy: 1.5928149649603283
Energy: 1.8745113125757558
Energy: 1.5772538814418329
Energy: 1.5972845722062123
Energy: 1.5761969482065623
Energy: 1.5750926914407373
Energy: 1.5679616768460183
Energy: 1.5450060875440432
Energy: 1.914812296385622
Energy: 1.5738932848769407
Energy: 1.5901760417477842
Energy: 1.5899960477809276
Energy: 1.580988696204077
Energy: 1.9142738955963587
Energy: 1.6735537388563628
Energy: 1.8746142724359969
Energy: 1.655089447598
Energy: 1.6046304665236346
Energy: 1.6063697888066146
Energy: 1.6080645211990106
Energy: 1.5680865299187507
Energy: 1.5851220610646548
Energy: 1.8828244105998095
Energy: 1.5739649345663609
Energy: 1.58903155983615
Energy: 1.5835340758240974
Energy: 1.5736249058274805
Energy: 1.9137823518707473

minimum gb energy = 1.5449578007215938 eV
minimum distance =  2.19162684254814 Angstroms
sigma value = 23