Model name: model_name=MEAM_LAMMPS_KimJungLee_2015_NiAlCo__MO_876687166519_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.044650763273239
cohesive_energy=3.3602642529834164
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 0.012707190882280782
Energy: 0.28429902645875615
Energy: 0.3980214773989378
Energy: 0.2841955824851578
Energy: 0.012707190881667137
Energy: 0.28429902645916527
Energy: 0.2157614129678125
Energy: 0.3973260802227442
Energy: 0.013139957375809972
Energy: 0.11423602324535573
Energy: 0.013160573870635302
Energy: 0.3973260802227442
Energy: 0.01313995737640089
Energy: 0.11423602324576482
Energy: 0.012707190882280782
Energy: 0.2842990264577562
Energy: 0.49445027526381896
Energy: 0.2841955824851578
Energy: 0.012707190881667137
Energy: 0.28429902645875615
Energy: 0.21576141296760795
Energy: 0.3973260802227442
Energy: 0.013139957376196342
Energy: 0.11423602324515118
Energy: 0.013160573870430752
Energy: 0.39732608022253957
Energy: 0.01313995737640089
Energy: 0.11423602324576482
Energy: 0.012707190882280782
Energy: 0.2842990264583698
Energy: 0.21576141296760795
Energy: 0.2841955824851578
Energy: 0.012707190881667137
Energy: 0.2842990264589607
Energy: 0.21576141296801704
Energy: 0.3973260802227442
Energy: 0.013139957375809972
Energy: 0.11423602324496934
Energy: 0.013160573870248932
Energy: 0.3973260802227442
Energy: 0.013139957376196342
Energy: 0.11423602324576482

minimum gb energy = 0.012707190881667137 eV
minimum distance =  2.83315362330762 Angstroms
sigma value = 5


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

Energy: 0.6654770259294798
Energy: 0.6890923514930091
Energy: 0.7295424658675046
Energy: 0.6892539176620505
Energy: 0.6654770259294798
Energy: 0.6890923514954524
Energy: 0.7266702903484749
Energy: 0.641243642368326
Energy: 0.6332621148540187
Energy: 0.6782235446008914
Energy: 0.6336254024847904
Energy: 0.6412436423658826
Energy: 0.6332621148540187
Energy: 0.6782235446033348
Energy: 0.6239430359263385
Energy: 0.632950036040625
Energy: 0.6962058003508114
Energy: 0.6512958674485281
Energy: 0.6239430359263385
Energy: 0.6329500360381817
Energy: 0.7157932115333302
Energy: 0.6577861517770591
Energy: 0.6556812019490973
Energy: 0.6992521843639826
Energy: 0.628008839252421
Energy: 0.6577861508953824
Energy: 0.6556812019490973
Energy: 0.6992521843664262
Energy: 0.6252953295802832
Energy: 0.624389997309696
Energy: 0.6947185352555224
Energy: 0.6547127827013357
Energy: 0.6252953295802832
Energy: 0.6243899973072526
Energy: 0.7031460351317933
Energy: 0.6508729009559335
Energy: 0.6597819514061791
Energy: 0.6529098034334071
Energy: 0.6267855800115558
Energy: 0.6508729009510466
Energy: 0.6597819514037357
Energy: 0.6529098034480677
Energy: 0.6167706204473613
Energy: 0.650503641840689
Energy: 0.67818723301589
Energy: 0.6527303004186862
Energy: 0.6167706204473613
Energy: 0.6505036418382456
Energy: 0.6778000075014248
Energy: 0.6248485302397456
Energy: 0.6300362166211549
Energy: 0.679648047705381
Energy: 0.6408395727704878
Energy: 0.6248485302397456
Energy: 0.6300362166162682
Energy: 0.6796480476663306
Energy: 0.6191762082292547
Energy: 0.6302323598110893
Energy: 0.6702026204134676
Energy: 0.6345500378080785
Energy: 0.6191762082243678
Energy: 0.6302323598135326
Energy: 0.6702026205013865
Energy: 0.6215174493267586
Energy: 0.6559738947671372
Energy: 0.6830845537748327
Energy: 0.6427462525873757
Energy: 0.6215174493292019
Energy: 0.6559738947671372
Energy: 0.6830845537723894
Energy: 0.6443799152757826
Energy: 0.6266625240591508
Energy: 0.6604544049969765
Energy: 0.6586752395779812
Energy: 0.6443799152757826
Energy: 0.6266625240762104
Energy: 0.660454404994533
Energy: 0.6563535028292274
Energy: 0.6767211923964584
Energy: 0.6970867664912394
Energy: 0.6480693088889655
Energy: 0.6563535028292274
Energy: 0.6767211924037444
Energy: 0.6970867664912394
Energy: 0.6865388677277922
Energy: 0.6581188665978208
Energy: 0.6989651497065988
Energy: 0.6393791099098217
Energy: 0.6865388677302356
Energy: 0.6581188665978208
Energy: 0.6989651497114857
Energy: 0.6219574366936619
Energy: 0.6454813072090948
Energy: 0.72211361337493
Energy: 0.6247881113731651
Energy: 0.6219574366936619
Energy: 0.6454813072115382
Energy: 0.7221136133724866
Energy: 0.6209941741484456
Energy: 0.6349019166748916
Energy: 0.6692111609053017
Energy: 0.6313815183147068
Energy: 0.6209941741533325
Energy: 0.6349019166724482
Energy: 0.6692111609053017
Energy: 0.6498783588020118
Energy: 0.682804351773702
Energy: 0.7019671905551063
Energy: 0.708576498575658
Energy: 0.6498783587995683
Energy: 0.682804351773702
Energy: 0.7019671905551063
Energy: 0.6447048772046101
Energy: 0.6396286409237539
Energy: 0.6583015220790899
Energy: 0.6348224465755662
Energy: 0.644704877209497
Energy: 0.6396286409261973
Energy: 0.6583015220815333
Energy: 0.6271444960325359
Energy: 0.6300167359646575
Energy: 0.7003384844316458
Energy: 0.6469380297708579
Energy: 0.6271444960300924
Energy: 0.630016735962214
Energy: 0.7003384844340892
Energy: 0.629031868345957
Energy: 0.6346342107905041
Energy: 0.6841378525994005
Energy: 0.6301989563144655
Energy: 0.629031868345957
Energy: 0.6346342107929475
Energy: 0.6841378526091743
Energy: 0.6211962137494508
Energy: 0.6222555968701986
Energy: 0.682539617560819
Energy: 0.6486729171163539
Energy: 0.6211962137518943
Energy: 0.6222555968701986
Energy: 0.6825396175901403
Energy: 0.616859203964767
Energy: 0.6590173911769431
Energy: 0.6596273768628701
Energy: 0.6257677192452726
Energy: 0.6168592039598801
Energy: 0.659017391186717
Energy: 0.6596273768701558
Energy: 0.6192002169493168
Energy: 0.6457548309074657
Energy: 0.6877576744629148
Energy: 0.6348634637571139
Energy: 0.6192002169542037
Energy: 0.6457548309074657
Energy: 0.6877576744629148
Energy: 0.6270723196960029
Energy: 0.6290610795055341
Energy: 0.6921062518027554
Energy: 0.6443711012080579
Energy: 0.627072319691116
Energy: 0.6290610795055341
Energy: 0.6921062518027554
Energy: 0.6497748714271258
Energy: 0.6372262176044724
Energy: 0.6689178796004691
Energy: 0.6541636149360966
Energy: 0.6497748714271258
Energy: 0.6372262176166451
Energy: 0.6689178796029125
Energy: 0.6218995908678577
Energy: 0.669946801156545
Energy: 0.7039187432098906
Energy: 0.6441517373818788
Energy: 0.6218995908776314
Energy: 0.6699468011467713
Energy: 0.7039187432074472
Energy: 0.6492503885528397
Energy: 0.6265836818953662
Energy: 0.6756193092090468
Energy: 0.6713980992863086
Energy: 0.6492503885601699
Energy: 0.6265836818977651
Energy: 0.6756193092066034
Energy: 0.6531889233905614
Energy: 0.6333962400597979
Energy: 0.7183870777621825
Energy: 0.6556477462792103
Energy: 0.6531889233930048
Energy: 0.6333962400622413
Energy: 0.7183870777597391
Energy: 0.6391784176187412
Energy: 0.6514301881270071
Energy: 0.7173994155278693
Energy: 0.6509084720135506
Energy: 0.6391784201978432
Energy: 0.6514301881270071
Energy: 0.7173994155303127
Energy: 0.6388818559223558
Energy: 0.6579052102562161
Energy: 0.7290841683757985
Energy: 0.6310417525796502
Energy: 0.6388818559199124
Energy: 0.6579052102513292
Energy: 0.7290841683757985
Energy: 0.6296784445370944
Energy: 0.6514136677632041
Energy: 0.7105264583351171
Energy: 0.6408077573089495
Energy: 0.6296784445395378
Energy: 0.6514136677607607
Energy: 0.7105264583351171
Energy: 0.6217632690608854
Energy: 0.6586208432879878
Energy: 0.7152209136913673
Energy: 0.6735665479335521
Energy: 0.6217632690657722
Energy: 0.6586208433197522
Energy: 0.715220913901413
Energy: 0.6496031026570047
Energy: 0.6562166437935959
Energy: 0.6588475089774031
Energy: 0.6184325063278676
Energy: 0.6496031026594482
Energy: 0.6562166437935959
Energy: 0.6588475089774031
Energy: 0.6319390075674576
Energy: 0.6507549717996575
Energy: 0.703771482568086
Energy: 0.6368420447027773
Energy: 0.6319390075650141
Energy: 0.6507549717972141
Energy: 0.7037714825705295
Energy: 0.631448765750667
Energy: 0.6358190811608365
Energy: 0.6786758753153171
Energy: 0.641258537817713
Energy: 0.631448765750667
Energy: 0.6358190811632799
Energy: 0.6786758687820419
Energy: 0.6168639652589291
Energy: 0.6260658319452096
Energy: 0.6716683808931984
Energy: 0.6539297604760573
Energy: 0.6168639652564857
Energy: 0.6260658319549832
Energy: 0.6716683808931984
Energy: 0.6214012279804157
Energy: 0.6563679531669601
Energy: 0.6956812454507414
Energy: 0.6347806419866301
Energy: 0.6214012279779724
Energy: 0.6563679531694034
Energy: 0.6956812451405597
Energy: 0.6243992468198634
Energy: 0.6342680564893702
Energy: 0.6843935085280394
Energy: 0.6346744989521794
Energy: 0.6243992468174199
Energy: 0.6342680564942571
Energy: 0.6843935085353696
Energy: 0.6201027861658397
Energy: 0.637112709387504
Energy: 0.7189134081620442
Energy: 0.6468702156784669
Energy: 0.6201027861658397
Energy: 0.6371127093850606
Energy: 0.7189134081547139
Energy: 0.6435313045043461
Energy: 0.641639712498798
Energy: 0.7067154661484383
Energy: 0.6396682660737615
Energy: 0.6435313044994593
Energy: 0.641639712498798
Energy: 0.7067154661508817
Energy: 0.652446663320079
Energy: 0.6798285885325251
Energy: 0.717308082749047
Energy: 0.6627067271737107
Energy: 0.652446663320079
Energy: 0.6798285884983173
Energy: 0.717308082749047
Energy: 0.6449333029358197
Energy: 0.6360657365018499
Energy: 0.6629787344887581
Energy: 0.6556880132616741
Energy: 0.6449333029382631
Energy: 0.6360657365067367
Energy: 0.6629787344912015
Energy: 0.6508117804700532
Energy: 0.6326994739722954
Energy: 0.715032850871281
Energy: 0.6294542256992605
Energy: 0.65081178047494
Energy: 0.6326994739722954
Energy: 0.7150328508737245
Energy: 0.689399810795865
Energy: 0.6392274967109907
Energy: 0.7254632850148498
Energy: 0.6546119147277579
Energy: 0.6893998107983085
Energy: 0.639227511049944
Energy: 0.7254632850124064
Energy: 0.641593991447406
Energy: 0.6501098747698115
Energy: 0.6983049522173101
Energy: 0.6694562177906425
Energy: 0.6415939914449625
Energy: 0.6501098747698115
Energy: 0.6983049522197535
Energy: 0.6245312344394814
Energy: 0.6430370944531357
Energy: 0.6977744376402432
Energy: 0.6353478009810901
Energy: 0.624531234437038
Energy: 0.6430370944458054
Energy: 0.6977744376426867
Energy: 0.6211671941052018
Energy: 0.6574372622276802
Energy: 0.6921198729120966
Energy: 0.6720187628591852
Energy: 0.6211671941052018
Energy: 0.6574372622252368
Energy: 0.6921198837438459
Energy: 0.6191469458969746
Energy: 0.6558694516090396
Energy: 0.6626150879129293
Energy: 0.621329764350603
Energy: 0.6191469458969746
Energy: 0.6558694516041528
Energy: 0.6626150879153727

minimum gb energy = 0.6167706204473613 eV
minimum distance =  2.53528186877914 Angstroms
sigma value = 401


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

Energy: 0.6372516412419773
Energy: 0.6523002474839295
Energy: 0.71088166896232
Energy: 0.6531587311968783
Energy: 0.6372516412436414
Energy: 0.6523002474836772
Energy: 0.7108816689634293
Energy: 0.6297949309260358
Energy: 0.6799319825888205
Energy: 0.700466633603949
Energy: 0.6413644635714394
Energy: 0.6297949309249264
Energy: 0.6799319825910394
Energy: 0.7004666336042011
Energy: 0.6396046157973561
Energy: 0.6417643253272011
Energy: 0.661226943362642
Energy: 0.6331268957943132
Energy: 0.6396046157968013
Energy: 0.6417643253291174
Energy: 0.6612269433620873
Energy: 0.642256140184532
Energy: 0.6594600447025359
Energy: 0.647589829919655
Energy: 0.6337369832015857
Energy: 0.6422561401856416
Energy: 0.6594600447033427
Energy: 0.6381908863060541
Energy: 0.6405632817466822
Energy: 0.6509935132597597
Energy: 0.6452172595729354
Energy: 0.6374668439483756
Energy: 0.6405632817452702
Energy: 0.6509935132608692
Energy: 0.6452172595734901
Energy: 0.6398007672057427
Energy: 0.6485428904317458
Energy: 0.6435000404776623
Energy: 0.6405904650880683
Energy: 0.6398007672048854
Energy: 0.6485428904311912
Energy: 0.6570496344495111
Energy: 0.6319382478348549
Energy: 0.6426509724651011
Energy: 0.661222956332452
Energy: 0.6476336038857661
Energy: 0.6319382478345522
Energy: 0.6426509724642439
Energy: 0.6558882044943151
Energy: 0.6318211589397361
Energy: 0.6475802449764972
Energy: 0.6556580436089506
Energy: 0.6444127603365581
Energy: 0.6318211589410977
Energy: 0.6475802449729169
Energy: 0.6556580436089506
Energy: 0.6336064198536954
Energy: 0.637976731044246
Energy: 0.696245121758094
Energy: 0.6468579736400873
Energy: 0.6336064198536954
Energy: 0.6379767310436913
Energy: 0.6965300526078739
Energy: 0.6406215925948485
Energy: 0.6537893573838343
Energy: 0.7067717862618257
Energy: 0.6349438864291788
Energy: 0.6406215925948485
Energy: 0.6537893573824223
Energy: 0.6985119711581944
Energy: 0.6424606328425821
Energy: 0.6471469901068333
Energy: 0.6406672994727404
Energy: 0.6351437069082955
Energy: 0.6424606328428345
Energy: 0.6471469901096069
Energy: 0.6406672995944233
Energy: 0.6391873718694909
Energy: 0.631931164572313
Energy: 0.6596358881637462
Energy: 0.6528526071008588
Energy: 0.6391873718694909
Energy: 0.631931164572565
Energy: 0.6785866791681198
Energy: 0.6294131706167873
Energy: 0.6391055328626845
Energy: 0.6736346009848603
Energy: 0.6360784425399674
Energy: 0.6294131706140136
Energy: 0.639105532862987
Energy: 0.6571765835386272
Energy: 0.6210958261839447
Energy: 0.6523002474847867
Energy: 0.71088166896232
Energy: 0.6531587311974331
Energy: 0.6210958261822805
Energy: 0.6523002474844841
Energy: 0.7108816689642362
Energy: 0.6297949309262879
Energy: 0.6799319825896273
Energy: 0.7004666336028396
Energy: 0.6461215965015736
Energy: 0.6297949309249264
Energy: 0.6799319825912915
Energy: 0.7004666336045037
Energy: 0.6396046157965491
Energy: 0.6417643253280079
Energy: 0.6612269433634993
Energy: 0.6331268957946158
Energy: 0.6396046157959944
Energy: 0.6417643253288652
Energy: 0.6612269433623899
Energy: 0.6422561401842296
Energy: 0.6580315404342745
Energy: 0.6381908863032806
Energy: 0.633736983201283
Energy: 0.6422561401856416
Energy: 0.6580315404342745
Energy: 0.638190886305802
Energy: 0.6405632817458249
Energy: 0.6543632300247473
Energy: 0.6452172595726833
Energy: 0.6374668439475688
Energy: 0.6405632817455729
Energy: 0.6543632300249994
Energy: 0.6452172595723805
Energy: 0.6398662758611312
Energy: 0.6485428904320485
Energy: 0.657049634447595
Energy: 0.6405904650886229
Energy: 0.6398662758608287
Energy: 0.6485428904300817
Energy: 0.657049634459496
Energy: 0.6319382478356617
Energy: 0.6426509724645464
Energy: 0.6609816495829895
Energy: 0.6476336038865729
Energy: 0.6319382478348549
Energy: 0.6426509724642439
Energy: 0.6612229551883405
Energy: 0.6318211589391814
Energy: 0.6475802449756904
Energy: 0.6579207051456949
Energy: 0.6444127603374153
Energy: 0.6318211589416525
Energy: 0.6475802449742785
Energy: 0.6533537967511966
Energy: 0.6336064198531407
Energy: 0.6379767310433888
Energy: 0.6964540382173932
Energy: 0.6468579736392299
Energy: 0.6336064198550571
Energy: 0.6379767310439435
Energy: 0.6964540382165358
Energy: 0.640621592593739
Energy: 0.6537893573838343
Energy: 0.6944096031412889
Energy: 0.6349438864297333
Energy: 0.6406215925945964
Energy: 0.6537893573835318
Energy: 0.6944096031418436
Energy: 0.6424606328411704
Energy: 0.6464586606796209
Energy: 0.640667299350755
Energy: 0.6351437069077409
Energy: 0.6424606328439438
Energy: 0.6464586606793182
Energy: 0.6406672985554038
Energy: 0.63943020441898
Energy: 0.631931164572565
Energy: 0.6691035145784329
Energy: 0.6528526071019681
Energy: 0.6394302044217536
Energy: 0.631931164572565
Energy: 0.6691035145812064
Energy: 0.6261830092257868
Energy: 0.6391055328626845
Energy: 0.6571770136252976
Energy: 0.6360784414188512
Energy: 0.6261830092260895
Energy: 0.6391055328626845
Energy: 0.6571770946399679
Energy: 0.6372516412430868
Energy: 0.6523002474847867
Energy: 0.7108816689628746
Energy: 0.6531587311971304
Energy: 0.6372516412441962
Energy: 0.6523002474823157
Energy: 0.7108816689625721
Energy: 0.6297949309268428
Energy: 0.6799319825888205
Energy: 0.7004666336045037
Energy: 0.64136446357033
Energy: 0.6297949309243718
Energy: 0.6799319825904847
Energy: 0.700466633603949
Energy: 0.6396046157956918
Energy: 0.6417643253277557
Energy: 0.661226943364054
Energy: 0.6331268957940611
Energy: 0.6396046157971039
Energy: 0.6417643253283104
Energy: 0.661226943362642
Energy: 0.642256140184532
Energy: 0.6594600447033427
Energy: 0.6381908863052472
Energy: 0.6337369832021403
Energy: 0.642256140187003
Energy: 0.6594600447033427
Energy: 0.638190886305802
Energy: 0.6405632817469344
Energy: 0.6509935132583982
Energy: 0.6452172595734901
Energy: 0.6374668439470141
Energy: 0.6405632817452702
Energy: 0.6509935132595076
Energy: 0.645217259573238
Energy: 0.6398007672046333
Energy: 0.6485428904320485
Energy: 0.6435000404826546
Energy: 0.6405904650875137
Energy: 0.6398007672040786
Energy: 0.6485428904298296
Energy: 0.6570496345448706
Energy: 0.6319382478348549
Energy: 0.6426509724651011
Energy: 0.6452174142650461
Energy: 0.6476336038857661
Energy: 0.6319382478348549
Energy: 0.6426509724645464
Energy: 0.6612229551924756
Energy: 0.6318211589394336
Energy: 0.6475802449756904
Energy: 0.6579207051490232
Energy: 0.6444127603371127
Energy: 0.6318211589408457
Energy: 0.6475802449740263
Energy: 0.6556580436125814
Energy: 0.6336064198542503
Energy: 0.6379767310439435
Energy: 0.695084263107003
Energy: 0.6468579736392299
Energy: 0.6336064198533928
Energy: 0.6379767310433888
Energy: 0.6950842631067004
Energy: 0.6406215925948485
Energy: 0.6537893573849437
Energy: 0.6868774607913869
Energy: 0.6349438864297333
Energy: 0.6406215925954032
Energy: 0.6537893573832797
Energy: 0.6868774607939083
Energy: 0.6424606328400609
Energy: 0.6471469901051692
Energy: 0.6406672996479273
Energy: 0.6351437069085981
Energy: 0.6424606328428345
Energy: 0.6471469901084974
Energy: 0.6406672989836891
Energy: 0.6391873718709029
Energy: 0.631931164572313
Energy: 0.6691035145876109
Energy: 0.6528526071008588
Energy: 0.6391873718697934
Energy: 0.6319311645734225
Energy: 0.6691035145845348
Energy: 0.6294131706170897
Energy: 0.6391055328626845
Energy: 0.6411227747635305
Energy: 0.6360784417598455
Energy: 0.6294131706140136
Energy: 0.6391055328613229
Energy: 0.6411227767432347
Energy: 0.6210958261842472
Energy: 0.6523002474844841
Energy: 0.71088166896232
Energy: 0.6531587311968783
Energy: 0.6210958261825831
Energy: 0.6523002474836772
Energy: 0.7108816689634293
Energy: 0.6297949309268428
Energy: 0.6799319825866017
Energy: 0.7004666336028396
Energy: 0.6461215964280999
Energy: 0.6297949309246239
Energy: 0.6799319825901821
Energy: 0.7004666336042011

minimum gb energy = 0.6210958261822805 eV
minimum distance =  2.56113657259941 Angstroms
sigma value = 311


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

Energy: 0.684693801163053
Energy: 0.6600336273254507
Energy: 0.7541791711858608
Energy: 0.6615848510283848
Energy: 0.6846938010010736
Energy: 0.660033626233506
Energy: 0.7305952628596353
Energy: 0.6883814210346482
Energy: 0.6408341350098768
Energy: 0.6660734465046096
Energy: 0.6562022353020985
Energy: 0.6883814210359293
Energy: 0.6408341350101971
Energy: 0.6660734468778886
Energy: 0.6486232029292001
Energy: 0.6686588570017529
Energy: 0.707445278048749
Energy: 0.6566994519945598
Energy: 0.6486232029292001
Energy: 0.6686588570014326
Energy: 0.6917397877586813
Energy: 0.6491227289023667
Energy: 0.6488268415581291
Energy: 0.6867218393231956
Energy: 0.6318626345110319
Energy: 0.649122728902687
Energy: 0.6488268415578089
Energy: 0.6867218397066936
Energy: 0.6631481696913838
Energy: 0.6517812236900216
Energy: 0.6949925278012897
Energy: 0.6572104344931804
Energy: 0.663148169700031
Energy: 0.6517812236897013
Energy: 0.6949925282164937
Energy: 0.6618051165518032
Energy: 0.6423771771115707
Energy: 0.6709490335827877
Energy: 0.6330522055078047
Energy: 0.6618051165518032
Energy: 0.6423771771118911
Energy: 0.6709490335776781
Energy: 0.6705458778013801
Energy: 0.6945726776497574
Energy: 0.6642985521395216
Energy: 0.6510130876484379
Energy: 0.6705458778013801
Energy: 0.6945726776500776
Energy: 0.6568532909996468
Energy: 0.6605827923948756
Energy: 0.6374615758189595
Energy: 0.7012009507889263
Energy: 0.6403708925468286
Energy: 0.6605827923948756
Energy: 0.637461575818319
Energy: 0.701200950832773
Energy: 0.6483241061262507
Energy: 0.6362816839794161
Energy: 0.7081257907292169
Energy: 0.637464366613997
Energy: 0.6483241061272114
Energy: 0.6362816839742919
Energy: 0.7081257629784328
Energy: 0.6686122869562982
Energy: 0.684223207090431
Energy: 0.6967956913526483
Energy: 0.696324964546389
Energy: 0.6686122869562982
Energy: 0.6842232070917121
Energy: 0.6967956916557899
Energy: 0.679262772082522
Energy: 0.6525951360205346
Energy: 0.726097789249052
Energy: 0.6488581092484529
Energy: 0.6792627720822018
Energy: 0.6525951360128484
Energy: 0.7260977904658114
Energy: 0.6804049824983552
Energy: 0.6822495396684964
Energy: 0.6922989426244625
Energy: 0.6623655220278136
Energy: 0.6804049824980349
Energy: 0.6822495396688166
Energy: 0.6922989426225555
Energy: 0.667963344841264
Energy: 0.6458428798062456
Energy: 0.6975302159474015
Energy: 0.6509148923421835
Energy: 0.6679633448409437
Energy: 0.6458428798059253
Energy: 0.6975302159477219
Energy: 0.6401672610433013
Energy: 0.6642638720637104
Energy: 0.6726276013099516
Energy: 0.6576827984231033
Energy: 0.6401672610433013
Energy: 0.6642638720630699
Energy: 0.672627601309311
Energy: 0.6661492371065486
Energy: 0.6456462010767825
Energy: 0.6875263008721474
Energy: 0.6323467111280023
Energy: 0.6661492371071891
Energy: 0.6456462010767825
Energy: 0.6875263008727878
Energy: 0.6726851405789008
Energy: 0.663384501397885
Energy: 0.6986439267849904
Energy: 0.697678585373193
Energy: 0.6726851405795414
Energy: 0.6633845013982052
Energy: 0.6986439269143178
Energy: 0.6892657602307045
Energy: 0.6461880297403159
Energy: 0.7278506126648296
Energy: 0.6403975207881673
Energy: 0.6892657602303843
Energy: 0.6461880297412477
Energy: 0.7278506126664309
Energy: 0.6761958662223471
Energy: 0.6963138552685108
Energy: 0.7271348958640694
Energy: 0.6705673934744638
Energy: 0.6761958662220269
Energy: 0.6963138552681903
Energy: 0.727134895414947
Energy: 0.6468184945834423
Energy: 0.6373820388442518
Energy: 0.6876987011125173
Energy: 0.6291235049031133
Energy: 0.6468184945872856
Energy: 0.6373820388448923
Energy: 0.6876987011458244
Energy: 0.6588987843913747
Energy: 0.6469793862395682
Energy: 0.7011169633879754
Energy: 0.6376262234547551
Energy: 0.6588987843913747
Energy: 0.6469793862402088
Energy: 0.7011169626901119
Energy: 0.6612036954383546
Energy: 0.6658302286837128
Energy: 0.6798871860260426
Energy: 0.6945774076831956
Energy: 0.6612036954380343
Energy: 0.6658302286715719
Energy: 0.6798871860273237
Energy: 0.6603865015842256
Energy: 0.6334730390729691
Energy: 0.6681969894085207
Energy: 0.6409222800039809
Energy: 0.6603865015832648
Energy: 0.633473039072649
Energy: 0.6681969893784453
Energy: 0.687953371215598
Energy: 0.657301019938229
Energy: 0.6812961497455436
Energy: 0.6517037116703305
Energy: 0.6879533712149574
Energy: 0.6573010187803396
Energy: 0.6812961480716264
Energy: 0.6685737729680747
Energy: 0.6317991614983959
Energy: 0.6949039284926285
Energy: 0.6488438699385941
Energy: 0.6685737729680747
Energy: 0.6317991614980757
Energy: 0.6949039284926285
Energy: 0.6491112769332674
Energy: 0.6588772636051479
Energy: 0.6717658825179011
Energy: 0.6605463777483783
Energy: 0.6491112768939044
Energy: 0.6588772636048275
Energy: 0.6717660250409011
Energy: 0.6931507142357429
Energy: 0.6599149629374179
Energy: 0.6673894950254042
Energy: 0.6407785802827497
Energy: 0.6931507142354226
Energy: 0.6599149629367773
Energy: 0.6673894950430186
Energy: 0.6607647282432132
Energy: 0.6608929173048593
Energy: 0.7497563745080984
Energy: 0.6600289730922235
Energy: 0.6607647337944008
Energy: 0.6608929173051796
Energy: 0.749756374527285
Energy: 0.7038638862649947
Energy: 0.6421987772434165
Energy: 0.6792844031753169
Energy: 0.6526142092674491
Energy: 0.7038638862646744
Energy: 0.6421987772440277
Energy: 0.679284423594087
Energy: 0.6555741774673506
Energy: 0.6649258134631493
Energy: 0.6897626527205303
Energy: 0.6560210948777114
Energy: 0.655574177439488
Energy: 0.6649258134634695
Energy: 0.6890992393206564
Energy: 0.6451891976794564
Energy: 0.6425628507458656
Energy: 0.6865234534959748
Energy: 0.6318085350499406
Energy: 0.6451892028227914
Energy: 0.6425628507452251
Energy: 0.6865234533339808
Energy: 0.6676681852525733
Energy: 0.6517650409151597
Energy: 0.6960729114893214
Energy: 0.6644954884720443
Energy: 0.6676681852602595
Energy: 0.6517650409158003
Energy: 0.6959842878420982
Energy: 0.6604733647487289
Energy: 0.6467390365262801
Energy: 0.6686282957224183
Energy: 0.6350549272238264
Energy: 0.6604733647496894
Energy: 0.6467390365262801
Energy: 0.6686282960447756
Energy: 0.6650244368845649
Energy: 0.6952294913697126
Energy: 0.6754883134676569
Energy: 0.6646061185867145
Energy: 0.6650244368845649
Energy: 0.6952294913748367
Energy: 0.6754883118942724
Energy: 0.6586798933302838
Energy: 0.6379337523456282
Energy: 0.6872929960715308
Energy: 0.6379286902486876
Energy: 0.6586798932883587
Energy: 0.6379337523459484
Energy: 0.6872930283920186
Energy: 0.6596208557053725
Energy: 0.6289007873198679
Energy: 0.7257837151411636
Energy: 0.6376037860341969
Energy: 0.6596208557056927
Energy: 0.6289007873211488
Energy: 0.7259178981294517
Energy: 0.6663852207161998
Energy: 0.6740446695139902
Energy: 0.6963976193290985
Energy: 0.696225297515852
Energy: 0.6663852207161998
Energy: 0.6740446695130294
Energy: 0.6963968653258256

minimum gb energy = 0.6289007873198679 eV
minimum distance =  2.54538337130457 Angstroms
sigma value = 39


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

Energy: 0.6592132839800693
Energy: 0.6825067349974222
Energy: 0.6952979369958705
Energy: 0.6829636505733853
Energy: 0.6592132839830932
Energy: 0.6825067349951544
Energy: 0.6909035988945246
Energy: 0.655546510471626
Energy: 0.6615218289371211
Energy: 0.6213829082474336
Energy: 0.6758691714930081
Energy: 0.655546510473138
Energy: 0.6615218289374991
Energy: 0.6213829082447876
Energy: 0.6593544921042231
Energy: 0.624676797659447
Energy: 0.6604489975762269
Energy: 0.6403632871022457
Energy: 0.6593544921011993
Energy: 0.6246767976605807
Energy: 0.6587117652214327
Energy: 0.6513104025443937
Energy: 0.6614780765035161
Energy: 0.6488414343393136
Energy: 0.6827605274826043
Energy: 0.6513104025481391
Energy: 0.6614780765016262
Energy: 0.6488414343370458
Energy: 0.6683236593218601
Energy: 0.6389738907476635
Energy: 0.6622080379076717
Energy: 0.6407686486830824
Energy: 0.6683236593214822
Energy: 0.6389738907484195
Energy: 0.6580901250105802
Energy: 0.651436831937033
Energy: 0.6417942840239207
Energy: 0.6611788203460272
Energy: 0.7120690472693877
Energy: 0.651436831935521
Energy: 0.6417942840239207
Energy: 0.6611788203460272
Energy: 0.7172820157036599
Energy: 0.6397301243370256
Energy: 0.6552143001804395
Energy: 0.6401861385873602
Energy: 0.7172820157025261
Energy: 0.6397301243370256
Energy: 0.6552143001804395
Energy: 0.6475330581915875
Energy: 0.6633956635577808
Energy: 0.68231869223646
Energy: 0.6633774329942599
Energy: 0.6475330581919654
Energy: 0.6633956635581588
Energy: 0.6823186922345701
Energy: 0.7160426177365593
Energy: 0.6393937284713255
Energy: 0.6525774938670424
Energy: 0.6397838631541887
Energy: 0.7160426177365593
Energy: 0.6393937284713255
Energy: 0.6448461669183051
Energy: 0.6513245372940554
Energy: 0.708666271348487
Energy: 0.6608585665991074
Energy: 0.6382401322082366
Energy: 0.6513245372948112
Energy: 0.7086662713458413
Energy: 0.660858566600619
Energy: 0.6683002456347694
Energy: 0.6411047461151876
Energy: 0.6676737601466739
Energy: 0.6390416422961115
Energy: 0.6683002456332576
Energy: 0.6411047461159435
Energy: 0.7075052355763377
Energy: 0.6513700796519075
Energy: 0.6826829180868635
Energy: 0.6219772624672537
Energy: 0.661448139665037
Energy: 0.6513700796526635
Energy: 0.6826829180883753
Energy: 0.6219772624661197
Energy: 0.6593053683489551
Energy: 0.6404888503698545
Energy: 0.6689604990259626
Energy: 0.6247227356038877
Energy: 0.6593053683485772
Energy: 0.6404888503713664
Energy: 0.6624419121366234
Energy: 0.6557011667331974
Energy: 0.6622853552676146
Energy: 0.6216075985138453
Energy: 0.6614835645778132
Energy: 0.6557011667343314
Energy: 0.6622853552679927
Energy: 0.6216075985134675
Energy: 0.6592132839804473
Energy: 0.6825067349974222
Energy: 0.6851031624392019
Energy: 0.6829636505737632
Energy: 0.6592132839834711
Energy: 0.6825067349951544
Energy: 0.7006938208466137
Energy: 0.6555465104720041
Energy: 0.6615218289371211
Energy: 0.6213829082459216
Energy: 0.6758691714945199
Energy: 0.6555465104720041
Energy: 0.6615218289374991
Energy: 0.6213829082462996
Energy: 0.6593544921049791
Energy: 0.6246767976598249
Energy: 0.6587117652221888
Energy: 0.6403632871011118
Energy: 0.6593544921008214
Energy: 0.6246767976598249
Energy: 0.6587117652214327
Energy: 0.6513104025447373
Energy: 0.66147807650276
Energy: 0.6488414343389357
Energy: 0.6827605274841161
Energy: 0.6513104025481391
Energy: 0.6614780765020042
Energy: 0.6488414343374238
Energy: 0.6683236593226162
Energy: 0.6389738907484195
Energy: 0.658090125000753
Energy: 0.6407686486834604
Energy: 0.6683236593211043
Energy: 0.6389738907480413
Energy: 0.6580901249984852
Energy: 0.6514368319374109
Energy: 0.6417942840231646
Energy: 0.661178820346783
Energy: 0.7120690472640963
Energy: 0.651436831935521
Energy: 0.6417942840227867
Energy: 0.6611788203456491
Energy: 0.717282015703282
Energy: 0.6397301243381595
Energy: 0.6405867457208164
Energy: 0.6401861385866042
Energy: 0.717282015703282
Energy: 0.6397301243358917
Energy: 0.6405867457200605
Energy: 0.6475330581915875
Energy: 0.6633956635577808
Energy: 0.68231869223646
Energy: 0.6633774329938817
Energy: 0.6475330581919654
Energy: 0.6633956635581588
Energy: 0.6823186922341922
Energy: 0.7160426177365593
Energy: 0.6393937284698136
Energy: 0.644700456240286
Energy: 0.6397838631549445
Energy: 0.7160426177358034
Energy: 0.6393937284713255
Energy: 0.6447004562380182
Energy: 0.6513245372936775
Energy: 0.7086662713469751
Energy: 0.6608585665957055
Energy: 0.6382401322086145
Energy: 0.6513245372951891
Energy: 0.7086662713481091
Energy: 0.6608585665964614
Energy: 0.6683002456340136
Energy: 0.6411047461151876
Energy: 0.6617678021570049
Energy: 0.6390416422949776
Energy: 0.6683002456336357
Energy: 0.6411047461151876
Energy: 0.6617678021721236
Energy: 0.6513700796515296
Energy: 0.6826829180861076
Energy: 0.6219772624664976
Energy: 0.661448139665037
Energy: 0.6513700796530413
Energy: 0.6826829180864855
Energy: 0.6219772624664976
Energy: 0.6593053683493333
Energy: 0.6404888503706104
Energy: 0.6624884466237494
Energy: 0.6247227356038877
Energy: 0.6593053683481993
Energy: 0.6404888503717444
Energy: 0.6624884466211036
Energy: 0.6557011667331974
Energy: 0.6622853552653469
Energy: 0.6216075985134675
Energy: 0.6614835645781912
Energy: 0.6557011667339535
Energy: 0.6622853552664808
Energy: 0.6216075985142233
Energy: 0.6592132839808253
Energy: 0.6825067349978002
Energy: 0.6722476894500414
Energy: 0.6829636505737632
Energy: 0.6592132839827152
Energy: 0.6825067349966663
Energy: 0.6722476894489076
Energy: 0.6555465104712481
Energy: 0.6615218289371211
Energy: 0.6213829082462996
Energy: 0.6758691714956538
Energy: 0.65554651047276
Energy: 0.6615218289374991
Energy: 0.6213829082462996

minimum gb energy = 0.6213829082447876 eV
minimum distance =  2.62042411935985 Angstroms
sigma value = 21


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

Energy: 0.6702653879741717
Energy: 0.7292570992216434
Energy: 0.677912621885908
Energy: 0.7289337077418904
Energy: 0.6702653879737128
Energy: 0.7292570992207257
Energy: 0.6655994307934693
Energy: 0.6754190386748887
Energy: 0.6676761646649403
Energy: 0.6442676621010265
Energy: 0.6675605141068516
Energy: 0.6754190386735122
Energy: 0.667676164665399
Energy: 0.6442676623675071
Energy: 0.6743794411006726
Energy: 0.6638898464370162
Energy: 0.6796527142010143
Energy: 0.6678215857545352
Energy: 0.6743794410993169
Energy: 0.6638898464360984
Energy: 0.6796527170936145
Energy: 0.6862543199582127
Energy: 0.6560506698978532
Energy: 0.6662011461865371
Energy: 0.6553123632026671
Energy: 0.6853525877334229
Energy: 0.6560506698973944
Energy: 0.6662011461874547
Energy: 0.654772254990269
Energy: 0.7368052857562961
Energy: 0.6505163292255635
Energy: 0.6760840090607962
Energy: 0.654772254990269
Energy: 0.736805285756755
Energy: 0.6505163292273989
Energy: 0.7090632602346411
Energy: 0.6915197729479431
Energy: 0.7169049806295256
Energy: 0.6614926712948463
Energy: 0.7090632602158287
Energy: 0.6915197729479431
Energy: 0.7169049806350317
Energy: 0.6537326134786751
Energy: 0.7441207296732069
Energy: 0.6593740570116255
Energy: 0.6655228255572337
Energy: 0.6537326134777575
Energy: 0.7441207296732069
Energy: 0.6495016126659375
Energy: 0.6673903409497094
Energy: 0.674890917739006
Energy: 0.7214066278887505
Energy: 0.6590816858187222
Energy: 0.6673903409483329
Energy: 0.6748909177367118
Energy: 0.7214066278887505
Energy: 0.6535363481481409
Energy: 0.6622502259583017
Energy: 0.6626789283518082
Energy: 0.7109789354507585
Energy: 0.6535363481481409
Energy: 0.6622502259583017
Energy: 0.6626789283518082
Energy: 0.6498083293751657
Energy: 0.6704257322272192
Energy: 0.6537564803624353
Energy: 0.6585931166857041
Energy: 0.6498083293760833
Energy: 0.6704257322272192
Energy: 0.653756480362894
Energy: 0.7320331830974313
Energy: 0.7049733333708493
Energy: 0.6685907720794738
Energy: 0.6603224608746332
Energy: 0.7320331830602654
Energy: 0.7049733333703906
Energy: 0.6631706712812921
Energy: 0.6822429335368377
Energy: 0.6500391196783137
Energy: 0.6493062785451378
Energy: 0.6503354288804343
Energy: 0.6822429335372966
Energy: 0.6500391196783137
Energy: 0.6493062785451378
Energy: 0.7068027390814988
Energy: 0.6500834143755566
Energy: 0.6552838254870897
Energy: 0.6584977516301387
Energy: 0.7068027398652991
Energy: 0.6500834143760155
Energy: 0.6552838254861721
Energy: 0.6334155489637932
Energy: 0.6507418680388488
Energy: 0.6522722594555763
Energy: 0.6336211274492518
Energy: 0.6334155489637932
Energy: 0.6507418680402254
Energy: 0.6522722594551176
Energy: 0.6966811306586481
Energy: 0.6420985855949368
Energy: 0.6420100834691441
Energy: 0.6554354830019743
Energy: 0.6966811306591069
Energy: 0.6420985855958544
Energy: 0.6420100834691441
Energy: 0.6295013499263286
Energy: 0.6916673285510334
Energy: 0.6521355265297133
Energy: 0.642859908969365
Energy: 0.6295013499254108
Energy: 0.691667328551951
Energy: 0.652135526530172
Energy: 0.6970926917424529
Energy: 0.6423613918485856
Energy: 0.6507527218503213
Energy: 0.6553813565046998
Energy: 0.6970926917424529
Energy: 0.6423613918472091
Energy: 0.6507527218494037
Energy: 0.6295017912763865
Energy: 0.6716983221858182
Energy: 0.6584834223894974
Energy: 0.7106067084194558
Energy: 0.6295017912759275
Energy: 0.6716983221858182
Energy: 0.6584834223890386
Energy: 0.6778502428450282
Energy: 0.6423965205604607
Energy: 0.7051402254169582
Energy: 0.6496525602411779
Energy: 0.6778502428468635
Energy: 0.642396520562755
Energy: 0.7051402254169582
Energy: 0.6297297014568877
Energy: 0.6912759577446562
Energy: 0.642458476073022
Energy: 0.6911711550436118
Energy: 0.6297297014568877
Energy: 0.6912759577446562
Energy: 0.6424584760743984
Energy: 0.6778519158514474
Energy: 0.6491954746554319
Energy: 0.7049367535570934
Energy: 0.6422467965230004
Energy: 0.6778519158509886
Energy: 0.6491954746563495
Energy: 0.7049367535575523
Energy: 0.6294989092728986
Energy: 0.7037319560491114
Energy: 0.6582983152332269
Energy: 0.6717197818117574
Energy: 0.6294989092728986
Energy: 0.7037319560513847
Energy: 0.6582983152341446
Energy: 0.69683465616065
Energy: 0.6553928901470539
Energy: 0.6506649963137141
Energy: 0.6423676297476013
Energy: 0.6968346561615676
Energy: 0.6553928901470539
Energy: 0.6506649963123375
Energy: 0.629550596843936
Energy: 0.6428833674056752
Energy: 0.6523755364342801
Energy: 0.6917540245547343
Energy: 0.6295505968448538
Energy: 0.6428833674065928
Energy: 0.6523755364351977
Energy: 0.6972729562285744
Energy: 0.6595086140808456
Energy: 0.6453428865779424
Energy: 0.6421950437308898
Energy: 0.6972729562281156
Energy: 0.6595086140803866
Energy: 0.6453428947260351

minimum gb energy = 0.6294989092728986 eV
minimum distance =  2.58239591933777 Angstroms
sigma value = 113


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

Energy: 0.7224679855971974
Energy: 0.7120549544740136
Energy: 0.6832588709771494
Energy: 0.7095974983229891
Energy: 0.7224679855342488
Energy: 0.7120549544750377
Energy: 0.683258870976125
Energy: 0.7092801177079451
Energy: 0.6872913460403578
Energy: 0.6668005481685205
Energy: 0.6994905827513681
Energy: 0.7092801177041274
Energy: 0.687291346038542
Energy: 0.6668005481871909
Energy: 0.7149023989397845
Energy: 0.694175157889445
Energy: 0.6972123501195909
Energy: 0.6911047524510343
Energy: 0.7149023989482582
Energy: 0.6941751578838111
Energy: 0.7147570431267526
Energy: 0.6649628336346218
Energy: 0.6920430960951234
Energy: 0.72121816504603
Energy: 0.6758714471770696
Energy: 0.6649628336919367
Energy: 0.6920430960915382
Energy: 0.7212181650501271
Energy: 0.7049484600197522
Energy: 0.6473860859281233
Energy: 0.6744883127592756
Energy: 0.6696123672222235
Energy: 0.7049484600228252
Energy: 0.6473860889221358
Energy: 0.6744883127592756
Energy: 0.6547655568502271
Energy: 0.6966586189932603
Energy: 0.7476274078451883
Energy: 0.6494054255478426
Energy: 0.6547655568494356
Energy: 0.6966586190014549
Energy: 0.7476274078457005
Energy: 0.6843083266519508
Energy: 0.6515193942003261
Energy: 0.6735310590460355
Energy: 0.6601677649274839
Energy: 0.6843083266537201
Energy: 0.6515194050204421
Energy: 0.685897619566787
Energy: 0.6533261065918068
Energy: 0.6935910173958005
Energy: 0.7282027232348183
Energy: 0.6588711938568531
Energy: 0.6533261066995922
Energy: 0.6935910173950556
Energy: 0.7282027232332818
Energy: 0.647716413911014
Energy: 0.6572052515490768
Energy: 0.7083186069576297
Energy: 0.6604257073976479
Energy: 0.6477149095528222
Energy: 0.6572052520256605
Energy: 0.7083186069703871
Energy: 0.644129172724247
Energy: 0.6704887063314513
Energy: 0.7051533761575887
Energy: 0.6600176021534111
Energy: 0.644129172724247
Energy: 0.6704887063309392
Energy: 0.7051533761550277
Energy: 0.6919985746667613
Energy: 0.6889024686895612
Energy: 0.7242146852942482
Energy: 0.6647289264452215
Energy: 0.6919985746639211
Energy: 0.688902468685464
Energy: 0.7242146852952723
Energy: 0.6542974639853273
Energy: 0.6723337241623907
Energy: 0.7272740528379334
Energy: 0.6626912688882817
Energy: 0.6542974681677727
Energy: 0.6723337243638075
Energy: 0.7272740461460208
Energy: 0.6903348511909663
Energy: 0.6678317389095993
Energy: 0.719527081971708
Energy: 0.6728921444078383
Energy: 0.6903348511925028
Energy: 0.6678317389871676
Energy: 0.7089585842600817
Energy: 0.6921596833124487
Energy: 0.7101611004313026
Energy: 0.7471641729324298
Energy: 0.7039102978156309
Energy: 0.6921596826210857
Energy: 0.7101611004318149
Energy: 0.7471641729339662
Energy: 0.6952734769218252
Energy: 0.6684808469292276
Energy: 0.7405731460708339
Energy: 0.6961653569359456
Energy: 0.695273476919497
Energy: 0.6684808469277378
Energy: 0.7280327708466069
Energy: 0.6945726161991279
Energy: 0.6765641566728913
Energy: 0.7173886444181378
Energy: 0.6783544888277986
Energy: 0.6945726161556414
Energy: 0.6765641523919258
Energy: 0.7173886444166013
Energy: 0.7048658564028867
Energy: 0.6654200434058398
Energy: 0.7444139901126515
Energy: 0.6680149553803694
Energy: 0.704865856401583
Energy: 0.6654200433951311
Energy: 0.7444139901141881
Energy: 0.6570887173186275
Energy: 0.667068182211127
Energy: 0.7131918100126681
Energy: 0.6618903043270182
Energy: 0.6570887172364499
Energy: 0.6670681826370538
Energy: 0.7131918100162532
Energy: 0.7049943474549418
Energy: 0.6817107250347363
Energy: 0.7428817856055271
Energy: 0.6881831453723456
Energy: 0.7049943474446986
Energy: 0.6817107250309185
Energy: 0.7428817856050149
Energy: 0.6602526660603133
Energy: 0.6814584773223982
Energy: 0.7107026535381163
Energy: 0.6410365613347554
Energy: 0.6602526630760316
Energy: 0.6814584773290562
Energy: 0.7107026535355556
Energy: 0.6745352574278263
Energy: 0.6450005414289581
Energy: 0.7399392148299714
Energy: 0.6907002630844448
Energy: 0.674535257417071
Energy: 0.6450005414294703
Energy: 0.7399392148284349
Energy: 0.6623143685167567
Energy: 0.6794652904946018
Energy: 0.6875225683119839
Energy: 0.6520541884356131
Energy: 0.6623143684939891
Energy: 0.6794653216924877
Energy: 0.6875225712005392
Energy: 0.6538541130722038
Energy: 0.6507558896562448
Energy: 0.7473907439945254
Energy: 0.6958252277481172
Energy: 0.6538463165071532
Energy: 0.6507558896559653
Energy: 0.7473907439656118
Energy: 0.6797055327446069
Energy: 0.6745307312027357
Energy: 0.6999523726518226
Energy: 0.6674395174713211
Energy: 0.6797055327448397
Energy: 0.6745307312045048
Energy: 0.6999523726546162
Energy: 0.6700886396200703
Energy: 0.6733423703238139
Energy: 0.6716557848254603
Energy: 0.7226052004142586
Energy: 0.6700885563465722
Energy: 0.6733423703268868
Energy: 0.6716557850888476
Energy: 0.6732236330254263
Energy: 0.7056260228307203
Energy: 0.7159882003556808
Energy: 0.6717800594647747
Energy: 0.6732236330213291
Energy: 0.705626022827135
Energy: 0.7159882003556808
Energy: 0.7042818227646462
Energy: 0.6697356452218141
Energy: 0.656809899924896
Energy: 0.7390492169727105
Energy: 0.7042818238885477
Energy: 0.6697356452192533
Energy: 0.6568098993379661
Energy: 0.6826230870521417
Energy: 0.7275035487057
Energy: 0.7204567469542019
Energy: 0.7092977161716708
Energy: 0.6826230870529333
Energy: 0.7275035487062121
Energy: 0.7204567469528982
Energy: 0.724662009861865
Energy: 0.670121735279643
Energy: 0.7020298770281551
Energy: 0.7368779253557348
Energy: 0.7246620098713631
Energy: 0.6701217352824368
Energy: 0.7020298770225213
Energy: 0.6705571665263312
Energy: 0.6985294724603988
Energy: 0.7058632420340074
Energy: 0.7059435098395767
Energy: 0.6705571665273555
Energy: 0.6985294724276209
Energy: 0.7058632420593357
Energy: 0.6949129179729142
Energy: 0.6737179642377248
Energy: 0.7167074871738319
Energy: 0.7167194665162043
Energy: 0.6949129179751956
Energy: 0.6737179642392611
Energy: 0.7167074871960873
Energy: 0.6677998653862266
Energy: 0.6456180169166187
Energy: 0.6766948836723155
Energy: 0.6735853538423511
Energy: 0.6677998655978863
Energy: 0.645618016918155
Energy: 0.6766948836728276
Energy: 0.6551951916384339
Energy: 0.6664577844807305
Energy: 0.7432391179471758
Energy: 0.6829667244351295
Energy: 0.6556153601316583
Energy: 0.6664577844827791
Energy: 0.7432391179438235
Energy: 0.6537333376674749
Energy: 0.6542217699801999
Energy: 0.6696325948980015
Energy: 0.6512775844771983
Energy: 0.6537333376690114
Energy: 0.6542217699801999
Energy: 0.6696325950830757
Energy: 0.6499130803001438
Energy: 0.6439176516671933
Energy: 0.7296224172775305
Energy: 0.6848984676061914
Energy: 0.6499130802993989
Energy: 0.6439176516661689
Energy: 0.7296224172803242
Energy: 0.6462392315549301
Energy: 0.654364041323371
Energy: 0.665196612177859
Energy: 0.6486939773979479
Energy: 0.6462392315559544
Energy: 0.6543640413202981
Energy: 0.6651966262482049
Energy: 0.6473206217344434
Energy: 0.6550324148585971
Energy: 0.7065998905405869
Energy: 0.6847704205440651
Energy: 0.647320621733652
Energy: 0.6550324148650223
Energy: 0.7065998905385382
Energy: 0.6600614812775849
Energy: 0.6473855649119652
Energy: 0.6928974354514135
Energy: 0.6633310426935106
Energy: 0.6600614812794008
Energy: 0.6473855649019548
Energy: 0.6928974354519255
Energy: 0.6640543136876382
Energy: 0.6665062320426162
Energy: 0.7444044999989152
Energy: 0.6849191071058528
Energy: 0.6640543136883832
Energy: 0.6665062320556994
Energy: 0.7444045000019881
Energy: 0.6673675176221502
Energy: 0.6771056407098526
Energy: 0.7057122778706182
Energy: 0.6763009166689163
Energy: 0.667367515551693
Energy: 0.6771056367396258
Energy: 0.7057122778698268
Energy: 0.6867831262822851
Energy: 0.6662169507281404
Energy: 0.7349162808796228
Energy: 0.6962268234347078
Energy: 0.6867831401478155
Energy: 0.6662169507286526
Energy: 0.7349162808854893
Energy: 0.6683796728766341
Energy: 0.6686918107510215
Energy: 0.748278576893268
Energy: 0.7020926757177215
Energy: 0.6683796728891586
Energy: 0.6686918107527907
Energy: 0.7482785769135214
Energy: 0.6768562337205754
Energy: 0.666877292062285
Energy: 0.7241658627886338
Energy: 0.6975803540223561
Energy: 0.676856234313884
Energy: 0.6668772920597241
Energy: 0.7241658627894252
Energy: 0.6821138530832324
Energy: 0.6721568580530476
Energy: 0.7496902304701109
Energy: 0.665329411102255
Energy: 0.6821138530822081
Energy: 0.6721568578823137
Energy: 0.7496902304693194
Energy: 0.6757308629617881
Energy: 0.6732856783059565
Energy: 0.7094001175587461
Energy: 0.6754311585507832
Energy: 0.6757308629653731
Energy: 0.6732856783013471
Energy: 0.7094001175615396

minimum gb energy = 0.6410365613347554 eV
minimum distance =  2.51856232080201 Angstroms
sigma value = 365


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

Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.5867625644652744
Energy: 0.5225463187010493
Energy: 0.6800288437999815
Energy: 0.522546318700472
Energy: 0.5922905623158788
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.6605305184100412
Energy: 0.5225463187010493
Energy: 0.6800288437999815
Energy: 0.5225463187010493
Energy: 0.5922905623158788
Energy: 0.6800288437988269
Energy: 0.5225463186998945
Energy: 0.6258640411742092
Energy: 0.5225463187010493
Energy: 0.6800288437994042
Energy: 0.5225463187016268
Energy: 0.6160095309616623
Energy: 0.6800288437982495
Energy: 0.5225463187010493
Energy: 0.606664475893372
Energy: 0.5225463187016268
Energy: 0.6800288438005588
Energy: 0.5225463186998945
Energy: 0.5922905623164562
Energy: 0.6800288437994042
Energy: 0.522546318700472
Energy: 0.6605305184187015
Energy: 0.5225463187016268
Energy: 0.6800288437999815
Energy: 0.5225463187016268
Energy: 0.5922905623158788
Energy: 0.6800288437988269
Energy: 0.5225463187010493
Energy: 0.6168505487784021
Energy: 0.5225463187016268
Energy: 0.6800288437988269
Energy: 0.5225463187010493
Energy: 0.5922905623158788
Energy: 0.6800288437982495
Energy: 0.5225463187010493
Energy: 0.5922905623147241
Energy: 0.522546318700472
Energy: 0.6800288437994042
Energy: 0.5225463187010493
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.6264578940318866
Energy: 0.5225463187010493
Energy: 0.6800288437994042
Energy: 0.522546318700472
Energy: 0.6264578940307319
Energy: 0.6800288437988269
Energy: 0.522546318700472
Energy: 0.5922767776024265
Energy: 0.5225463187016268
Energy: 0.6800288437994042
Energy: 0.5225463187010493
Energy: 0.5922905623158788
Energy: 0.6800288437982495
Energy: 0.522546318700472
Energy: 0.5922905623135695
Energy: 0.5225463187016268
Energy: 0.6800288437999815
Energy: 0.5225463187010493
Energy: 0.5922905623158788
Energy: 0.6800288437988269
Energy: 0.522546318700472
Energy: 0.5922905623153014
Energy: 0.5225463187010493
Energy: 0.6800288437988269
Energy: 0.5225463186998945
Energy: 0.5922905623158788
Energy: 0.6800288437994042
Energy: 0.5225463186998945
Energy: 0.5922905623153014
Energy: 0.5225463187016268
Energy: 0.6800288437988269
Energy: 0.522546318700472
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.5922905623153014
Energy: 0.5225463187022041
Energy: 0.6800288437988269
Energy: 0.5225463187010493
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.5922905623153014
Energy: 0.5225463187016268
Energy: 0.6800288437994042
Energy: 0.5225463187010493
Energy: 0.5922905623158788
Energy: 0.6800288437994042
Energy: 0.5225463186998945
Energy: 0.5922905623147241
Energy: 0.5225463187010493
Energy: 0.6800288437994042
Energy: 0.5225463187016268
Energy: 0.5922905623141468
Energy: 0.6800288437982495
Energy: 0.5225463186998945
Energy: 0.5922905623147241
Energy: 0.5225463187027815
Energy: 0.6800288437999815
Energy: 0.5225463187010493
Energy: 0.5922905623147241
Energy: 0.6800288437994042
Energy: 0.5225463187016268
Energy: 0.5922905623147241
Energy: 0.5225463187027815
Energy: 0.6800288437999815
Energy: 0.5225463187010493
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463186998945
Energy: 0.5922905623153014
Energy: 0.5225463187016268
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463187016268
Energy: 0.5922905623147241
Energy: 0.5225463187016268
Energy: 0.6800288437994042
Energy: 0.5225463187010493
Energy: 0.5922905623153014
Energy: 0.6800288437988269
Energy: 0.5225463187022041
Energy: 0.5922905623153014
Energy: 0.5225463187016268
Energy: 0.6800288437994042
Energy: 0.5225463187010493
Energy: 0.5922905623164562

minimum gb energy = 0.5225463186998945 eV
minimum distance =  2.66207211018458 Angstroms
sigma value = 23