Model name: model_name=EAM_Dynamo_MishinFarkasMehl_1999_Ni__MO_400591584784_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199994325637833
cohesive_energy=4.4503499761477565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: -3.09700299259974e-11 eV

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

Energy: 0.01815611614306409
Energy: 0.019237824819074212
Energy: 1.2221775905676187
Energy: 0.019237824819074212
Energy: 0.019237824819074212
Energy: 1.394016630892501
Energy: 0.019237824819735735
Energy: 1.394016630892501
Energy: 1.222177590566957
Energy: 0.019237824819074212
Energy: 0.01815611614306409
Energy: 0.019237824819074212
Energy: 0.019237824819074212
Energy: 1.394016630892501
Energy: 0.019237824819735735
Energy: 1.394016630892501

minimum gb energy = 0.01815611614306409 eV
minimum distance =  2.43122156136264 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.5765071445350267
Energy: 1.6652895055924346
Energy: 1.424863453372624
Energy: 1.6652895055924346
Energy: 1.4840154716177933
Energy: 1.584173173218176
Energy: 1.4940859567214722
Energy: 1.584173173220583
Energy: 1.4143145646054462
Energy: 1.6468067188154136
Energy: 1.4640156886174585
Energy: 1.6468067188146114
Energy: 1.471126176549426
Energy: 1.5480197573410033
Energy: 1.4360536344555488
Energy: 1.5480197573385965
Energy: 1.4502851080128492
Energy: 1.668223331765671
Energy: 1.46197464402594
Energy: 1.6682233317640665
Energy: 1.4070995656522844
Energy: 1.590659057384232
Energy: 1.3837406818134335
Energy: 1.5906590573786161
Energy: 1.4879155615260282
Energy: 1.6432431920565687
Energy: 1.4087273424057851
Energy: 1.6432431920581732
Energy: 1.3225291709494817
Energy: 1.6729618972899978
Energy: 1.3753751469260418
Energy: 1.6729618972916023
Energy: 1.4375119536043166
Energy: 1.4696879611772007
Energy: 1.4889920635461706
Energy: 1.4696879611763982
Energy: 1.3770776549293906
Energy: 1.6456606988787357
Energy: 1.3095066840415719
Energy: 1.6456606988787357
Energy: 1.4991087937510874
Energy: 1.5844654832140508
Energy: 1.441716008263392
Energy: 1.5844654832132483
Energy: 1.4408740513083285
Energy: 1.6725756219730226
Energy: 1.3995677849535055
Energy: 1.6725756219722203
Energy: 1.4920667759895083
Energy: 1.6429322304352796
Energy: 1.4890665891450228
Energy: 1.642932230436082
Energy: 1.4639207508059762
Energy: 1.5840307289145708
Energy: 1.4206476435214341
Energy: 1.5840307289185824
Energy: 1.4609476460175588
Energy: 1.6679202208508632
Energy: 1.4828696804949297
Energy: 1.6679202208516657
Energy: 1.4606342839266422
Energy: 1.6671228182032922
Energy: 1.4828600975235156
Energy: 1.6671228182024898
Energy: 1.4639751425527767
Energy: 1.6466788714727192
Energy: 1.3757219158072587
Energy: 1.6466788714727192
Energy: 1.4944223971378812
Energy: 1.5739164159321544
Energy: 1.514319199861375
Energy: 1.573916415931352
Energy: 1.340715326302017
Energy: 1.6702269553922255
Energy: 1.3981354849119607
Energy: 1.6702269553930278
Energy: 1.5133226250803056
Energy: 1.4683095527746495
Energy: 1.4362832387689133
Energy: 1.4683095527738472
Energy: 1.3788733772462218
Energy: 1.6464457609297212
Energy: 1.325534059841945
Energy: 1.6464457609273142
Energy: 1.4373506491624541
Energy: 1.4785274872799232
Energy: 1.4846051816434571
Energy: 1.4785274872791208
Energy: 1.4476650064201464
Energy: 1.6678652885393834
Energy: 1.3861324076142036
Energy: 1.6678652885393834
Energy: 1.4283772233393974
Energy: 1.6473903111099946
Energy: 1.40712943831384
Energy: 1.6473903111107968
Energy: 1.4085957381812624
Energy: 1.588277613419222
Energy: 1.4883246906570795
Energy: 1.5882776134184198
Energy: 1.446174513628743
Energy: 1.673429144032424
Energy: 1.4087245655525986
Energy: 1.6734291440340285
Energy: 1.4748551345289187
Energy: 1.5506082716951972
Energy: 1.4399701449044273
Energy: 1.5506082716992085
Energy: 1.3994429153450774
Energy: 1.642899142570521
Energy: 1.5434489469801387
Energy: 1.6428991425697188
Energy: 1.4823298430817726
Energy: 1.541997993436328
Energy: 1.485362612656342
Energy: 1.541997993433921
Energy: 1.5751094721915382
Energy: 1.6667283545215856
Energy: 1.4451784102792409
Energy: 1.6667283545207834
Energy: 1.4889871684857712
Energy: 1.6102048512961487
Energy: 1.4919941338985894
Energy: 1.6102048512985556
Energy: 1.432987684006689
Energy: 1.6436262396104637
Energy: 1.4637403335295684
Energy: 1.6436262396120682
Energy: 1.4504201301137558
Energy: 1.6113959341543143
Energy: 1.4358316801249809
Energy: 1.6113959341567212

minimum gb energy = 1.3095066840415719 eV
minimum distance =  2.25979106805799 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.681444732573237
Energy: 1.7730356048051168
Energy: 1.5038419220198886
Energy: 1.7730356048060312
Energy: 1.5279457039098532
Energy: 1.6819943484268034
Energy: 1.5561593960099864
Energy: 1.681994348435036
Energy: 1.4690854561689657
Energy: 1.774853439705459
Energy: 1.5371684469301086
Energy: 1.7748534397118207
Energy: 1.4602805765425662
Energy: 1.506898232183425
Energy: 1.465942360508475
Energy: 1.506898232180681
Energy: 1.4609633070100607
Energy: 1.734302892914869
Energy: 1.5244513782719613
Energy: 1.7343028929102953
Energy: 1.53784051130277
Energy: 1.7327197839139257
Energy: 1.5277665982456137
Energy: 1.732719783909352
Energy: 1.523423853146978
Energy: 1.5073468886390182
Energy: 1.4881307021873003
Energy: 1.5073468886344445
Energy: 1.3677338361199918
Energy: 1.7754213699687316
Energy: 1.439064780407684
Energy: 1.7754213699742203
Energy: 1.4791626119086971
Energy: 1.5618078605175252
Energy: 1.5838814429936166
Energy: 1.5618078605211843
Energy: 1.4602792421680761
Energy: 1.7739971048934808
Energy: 1.429381630621093
Energy: 1.7739971048934808
Energy: 1.5236325006373141
Energy: 1.529773280395604
Energy: 1.56701046275803
Energy: 1.5297732803965185
Energy: 1.4209909733494195
Energy: 1.755711502374114
Energy: 1.5370076644685997
Energy: 1.755711502375029
Energy: 1.5890943239990847
Energy: 1.742917955578956
Energy: 1.5195971228937222
Energy: 1.7429179555734675
Energy: 1.5891043630243418
Energy: 1.7430169498039136
Energy: 1.498317774505808
Energy: 1.7430169498066577
Energy: 1.4209409454653152
Energy: 1.7556108277893592
Energy: 1.5377723555436624
Energy: 1.7556108277939328
Energy: 1.523412868854964
Energy: 1.5300955769892373
Energy: 1.5563072321824474
Energy: 1.530095576955433
Energy: 1.4603363464126116
Energy: 1.7737688913622918
Energy: 1.3936737116142321
Energy: 1.7737688913686946
Energy: 1.4791592693444184
Energy: 1.56138527737532
Energy: 1.5839060927224051
Energy: 1.561385277371661
Energy: 1.3676843849694584
Energy: 1.775199331288191
Energy: 1.41459643522643
Energy: 1.7751993312808731
Energy: 1.5233272416001216
Energy: 1.507482496860144
Energy: 1.4716706571411584
Energy: 1.5074824968638025
Energy: 1.537711289462838
Energy: 1.7325403514292508
Energy: 1.4145131384733256
Energy: 1.7325403514329094
Energy: 1.4610422406457304
Energy: 1.7341322313327994
Energy: 1.5273679530769244
Energy: 1.734132231337373
Energy: 1.4603690537169371
Energy: 1.5067728135888379
Energy: 1.4612709260952728
Energy: 1.5067728135860936
Energy: 1.4691056430012763
Energy: 1.7745460692230395
Energy: 1.528669883220033
Energy: 1.7745460692239543
Energy: 1.528015022465505
Energy: 1.681690113398996
Energy: 1.5559556586626708
Energy: 1.6816901133935076
Energy: 1.681444732573237
Energy: 1.7730356048051168
Energy: 1.5217870774191233
Energy: 1.7730356048051168
Energy: 1.5279457039098532
Energy: 1.6819943484268034
Energy: 1.5561593960099864
Energy: 1.681994348435036
Energy: 1.4690854561689657
Energy: 1.774853439705459
Energy: 1.5229367555931912
Energy: 1.7748534397118207
Energy: 1.4602805765425662
Energy: 1.506898232183425
Energy: 1.465942360508475
Energy: 1.506898232180681

minimum gb energy = 1.3676843849694584 eV
minimum distance =  2.26197630084674 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.6144315806937088
Energy: 1.8488289916132776
Energy: 1.6236365089481044
Energy: 1.8488289916111509
Energy: 1.6403803623463724
Energy: 1.6973608320758526
Energy: 1.5664150887142279
Energy: 1.697360832076916
Energy: 1.549980640166136
Energy: 1.911982615292879
Energy: 1.5692779673546469
Energy: 1.9119826152939423
Energy: 1.5510166417568287
Energy: 1.601778545980078
Energy: 1.5324056028017188
Energy: 1.6017785459779514
Energy: 1.5338137712716151
Energy: 1.8502871132698389
Energy: 1.5685092495709105
Energy: 1.8502871132709025
Energy: 1.6527805204226877
Energy: 1.9138057215121547
Energy: 1.6436175403125475
Energy: 1.913805721513218
Energy: 1.6409372067305126
Energy: 1.582100453796797
Energy: 1.5837362250384093
Energy: 1.5821004537978607
Energy: 1.6978055292199703
Energy: 1.8557014599183985
Energy: 1.4624052161200514
Energy: 1.8557014599183985
Energy: 1.58330961187659
Energy: 1.7258363242487693
Energy: 1.6409307585744342
Energy: 1.7258363242498327
Energy: 1.5666576832554944
Energy: 1.9116725900823202
Energy: 1.5053296725139458
Energy: 1.9116725900833835
Energy: 1.6119351179288643
Energy: 1.8462423602132774
Energy: 1.6412894470989967
Energy: 1.8462423602154039
Energy: 1.5802008369179292
Energy: 1.846296252762833
Energy: 1.5663250253634151
Energy: 1.8462962527617697
Energy: 1.569145890058502
Energy: 1.7525630179563865
Energy: 1.5098216821451043
Energy: 1.7525630179574498
Energy: 1.5843986360019173
Energy: 1.6577365342532846
Energy: 1.636607514240624
Energy: 1.6577365342543482
Energy: 1.4899382844940412
Energy: 1.8581180238930426
Energy: 1.4587460064453859
Energy: 1.8581180238941062
Energy: 1.6400193345835976
Energy: 1.5835108557903776
Energy: 1.5287728796371165
Energy: 1.5835108557893143
Energy: 1.4298948308347386
Energy: 1.911851215312958
Energy: 1.430148667234044
Energy: 1.9118512153140217
Energy: 1.532079902359682
Energy: 1.7584284262000964
Energy: 1.6130024950255255
Energy: 1.7584284261990333
Energy: 1.499914383001022
Energy: 1.7576772265061966
Energy: 1.5333531597129137
Energy: 1.7576772265061966
Energy: 1.6404606472005603
Energy: 1.912484967383295
Energy: 1.5659505574256107
Energy: 1.912484967383295
Energy: 1.6001725606424722
Energy: 1.7207584650824104
Energy: 1.565940410110881
Energy: 1.720758465081347
Energy: 1.617163180494789
Energy: 1.851577001931833
Energy: 1.6369823113257742
Energy: 1.8515770019307698
Energy: 1.6450143044749763
Energy: 1.7557194847539404
Energy: 1.5656615560134688
Energy: 1.7557194847539404
Energy: 1.5487303268188122
Energy: 1.9101056466469195
Energy: 1.5667442448688196
Energy: 1.9101056466469195
Energy: 1.640750559105197
Energy: 1.5996656548704193
Energy: 1.5302612815005643
Energy: 1.5996656548714825

minimum gb energy = 1.4298948308347386 eV
minimum distance =  2.26422921838701 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.8193490505683048
Energy: 1.817798430654186
Energy: 1.7284766128801268
Energy: 1.817798430654186
Energy: 1.7416207904804308
Energy: 1.7973783421009233
Energy: 1.6560393474607844
Energy: 1.7973783421021918
Energy: 1.642546242772268
Energy: 1.7106295304174877
Energy: 1.6566377353747397
Energy: 1.7106295304174877
Energy: 1.7395984992313314
Energy: 1.8631763366518623
Energy: 1.6247612062089385
Energy: 1.8631763366518623
Energy: 1.7400580761944546
Energy: 1.8209035365237427
Energy: 1.6598202864084637
Energy: 1.8209035365237427
Energy: 1.5514025698610445
Energy: 1.7105485821421644
Energy: 1.620953731853707
Energy: 1.7105485821421644
Energy: 1.6984375300340095
Energy: 1.552758165003179
Energy: 1.5538612211575211
Energy: 1.552758165004447
Energy: 1.579147070516406
Energy: 1.710442780356116
Energy: 1.6053932201909655
Energy: 1.710442780353579
Energy: 1.6995780234869968
Energy: 1.8209615795859344
Energy: 1.7457400559286285
Energy: 1.8209615795872025
Energy: 1.709862366121563
Energy: 1.8180606980640353
Energy: 1.5542331820213275
Energy: 1.8180606980665723
Energy: 1.6269042734812453
Energy: 1.73313559903219
Energy: 1.656421473263118
Energy: 1.7331355990157278
Energy: 1.6995699924809033
Energy: 1.757467699259744
Energy: 1.6246910667201226
Energy: 1.7574676992610123
Energy: 1.5516246959218607
Energy: 1.7118178387350589
Energy: 1.5483475005427578
Energy: 1.7118178387325218
Energy: 1.65743720948144
Energy: 1.6665223457897216
Energy: 1.680243964884527
Energy: 1.6665223457897216
Energy: 1.551498994556266
Energy: 1.7113544698337932
Energy: 1.5240499946945303
Energy: 1.7113544698350616
Energy: 1.7090060900196655
Energy: 1.75742433284071
Energy: 1.5530809172596887
Energy: 1.7574243328394414
Energy: 1.694502763860891
Energy: 1.8177321735825194
Energy: 1.6630622861640798
Energy: 1.8177321735837881
Energy: 1.6961828644959505
Energy: 1.6967095301491688
Energy: 1.693060569158236
Energy: 1.6967095301517057
Energy: 1.7435912676709444
Energy: 1.7993121403046253
Energy: 1.6069559592326248
Energy: 1.7993121403046253
Energy: 1.6431091036555998
Energy: 1.7100237339052826
Energy: 1.6054980643479826
Energy: 1.7100237339052826
Energy: 1.7001285982747503
Energy: 1.6256405700256154
Energy: 1.6258562955482367
Energy: 1.6256405700256154

minimum gb energy = 1.5240499946945303 eV
minimum distance =  2.27156751041701 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.6126391545866783
Energy: 1.7401512631734903
Energy: 1.8439449185178198
Energy: 1.7401512631797653
Energy: 1.579726553141021
Energy: 1.8347932680767947
Energy: 1.557609822876936
Energy: 1.8347932680767947
Energy: 1.55759911326813
Energy: 1.7300617287641253
Energy: 1.5568999159673267
Energy: 1.7300617287641253
Energy: 1.6129562855685606
Energy: 1.6770181624559146
Energy: 1.7575519110282947
Energy: 1.6770181624543459
Energy: 1.754172790443082
Energy: 1.5795045695616756
Energy: 1.6498283739763284
Energy: 1.5795045695632441
Energy: 1.5628903228749982
Energy: 1.844142542055421
Energy: 1.557681917979804
Energy: 1.84414254205699
Energy: 1.5568998378653471
Energy: 1.676519989927557
Energy: 1.5574896074891167
Energy: 1.676519989927557
Energy: 1.735923137619458
Energy: 1.8586479327528038
Energy: 1.6112379193181312
Energy: 1.8586479327700605
Energy: 1.5569669207912051
Energy: 1.7228892435482102
Energy: 1.5829758500557827
Energy: 1.722889243543504
Energy: 1.8145606134193064
Energy: 1.7282197158369579
Energy: 1.5580933280424631
Energy: 1.7282197158400954
Energy: 1.6051707879437866
Energy: 1.676589586723577
Energy: 1.928028637971293
Energy: 1.6765895867173015
Energy: 1.5573362286991415
Energy: 1.6332012831245977
Energy: 1.8145991629900566
Energy: 1.633201283123029
Energy: 1.7362593286734171
Energy: 1.686147011411184
Energy: 1.5562418497392108
Energy: 1.6861470114080463
Energy: 1.557649948553075
Energy: 1.6757652473597227
Energy: 1.6129728323262553
Energy: 1.6757652473675668
Energy: 1.6178866379443955
Energy: 1.9679099132771931
Energy: 1.7366621269486837
Energy: 1.9679099132756244
Energy: 1.5790914049901643
Energy: 1.7524023683075074
Energy: 1.5620959886323789
Energy: 1.7524023683451229
Energy: 1.557387212479302
Energy: 1.7089755201771206
Energy: 1.8124725460790028
Energy: 1.7089755201771206

minimum gb energy = 1.5562418497392108 eV
minimum distance =  2.32462538548546 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.7801909035366648
Energy: 1.7790017170383672
Energy: 2.000115879370519
Energy: 1.7790017170374786
Energy: 1.8290299144713034
Energy: 1.709164768218872
Energy: 1.5970570378756201
Energy: 1.7091647682197604
Energy: 1.7905849975610282
Energy: 1.804878194179213
Energy: 1.5970662048344717
Energy: 1.804878194177436
Energy: 1.5993643460580294
Energy: 1.905758772930576
Energy: 1.718253811783241
Energy: 1.905758772930576
Energy: 1.8393878559614425
Energy: 1.7445941225093589
Energy: 1.6646601575794129
Energy: 1.744594122510247
Energy: 1.6222385044070993
Energy: 1.6668086436803407
Energy: 1.785629653825051
Energy: 1.6668086436812295
Energy: 1.601159954674969
Energy: 1.7930312995398328
Energy: 1.5976348399968059
Energy: 1.7930312995398328
Energy: 1.7851752632904136
Energy: 1.7111414449224216
Energy: 1.6192210130991618
Energy: 1.7111414449215328
Energy: 1.6233065733833585
Energy: 1.9090712188740473
Energy: 1.8240288655890025
Energy: 1.909071218873159
Energy: 1.9399659501447797
Energy: 1.7420102855404986
Energy: 1.597880878733791
Energy: 1.7420102855404986
Energy: 1.6036194111394169
Energy: 1.8235660742585584
Energy: 1.7930840224411857
Energy: 1.8235660742585584
Energy: 1.6200666424739945
Energy: 1.7904485926385183
Energy: 1.6211293175389012
Energy: 1.7904485926385183
Energy: 1.8305600563244488
Energy: 1.78058991889198
Energy: 1.7865339982034625
Energy: 1.7805899188910916
Energy: 1.5967737505154724
Energy: 1.8199160163482577
Energy: 1.8303290750704948
Energy: 1.8199160163482577
Energy: 1.7400791419609745
Energy: 1.795270374653117
Energy: 1.6226381315853435
Energy: 1.795270374654894
Energy: 1.7904661447476484
Energy: 1.7925425463259683
Energy: 1.7855490475469749
Energy: 1.792542546326857
Energy: 1.5980054705090891
Energy: 1.862398852373716
Energy: 1.967463665798114
Energy: 1.8623988523728277
Energy: 1.8726744242077322
Energy: 1.7636875688118034
Energy: 1.62193049096906
Energy: 1.7636875688135805
Energy: 1.5973644267981302
Energy: 1.8640709004820657
Energy: 1.7065364630506392
Energy: 1.8640709004811769
Energy: 1.597622783169895
Energy: 1.9061816820257873
Energy: 1.5998406959161364
Energy: 1.9061816820222333
Energy: 1.6904786989832106
Energy: 1.8040218609792713
Energy: 1.7898832559383049
Energy: 1.8040218609783827
Energy: 1.597955257189695
Energy: 1.875296091405485
Energy: 1.939505963929505
Energy: 1.875296091405485
Energy: 1.8034395704343842
Energy: 1.822688450387073
Energy: 1.5962135805102926
Energy: 1.822688450387962
Energy: 1.6200412596499414
Energy: 1.795154095693347
Energy: 1.8169471040179177
Energy: 1.7951540956942356
Energy: 1.6198055115397032
Energy: 1.8054096562888429
Energy: 1.8166806824663115
Energy: 1.8054096562888429
Energy: 1.8109951623417093
Energy: 1.8256151665387854
Energy: 1.5981379218139917
Energy: 1.8256151665387854
Energy: 1.6387505051957203
Energy: 1.9982908866845366
Energy: 1.984521601531163
Energy: 1.998290886683648
Energy: 1.7836960145368876
Energy: 1.6683653179501106
Energy: 1.7923076846253452
Energy: 1.6683653179492222
Energy: 1.9435871859787817
Energy: 1.9085916898282238
Energy: 1.6030377424252542
Energy: 1.9085916898282238
Energy: 1.6193156605135188
Energy: 1.8639928031558088
Energy: 1.8707318886645945
Energy: 1.8639928031575859

minimum gb energy = 1.5962135805102926 eV
minimum distance =  2.23567639217386 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.530610440964881
Energy: 1.5301630614978758
Energy: 1.927105819440009
Energy: 1.5301630615019668
Energy: 1.823050073145853
Energy: 1.667875760830134
Energy: 1.667986405832194
Energy: 1.6678757608280885
Energy: 1.5319137786984394
Energy: 1.5301009221211406
Energy: 1.773855441722971
Energy: 1.5301009221190949
Energy: 1.532156656354116
Energy: 1.5302490605904508
Energy: 1.668120718660057
Energy: 1.5302490605904508
Energy: 1.8228986200459807
Energy: 1.667760644415413
Energy: 1.6065388655609634
Energy: 1.6677606444174582
Energy: 1.530610440964881
Energy: 1.5301630614978758
Energy: 2.0342614641153767
Energy: 1.5301630615019668
Energy: 1.823050073143808
Energy: 1.667875760830134
Energy: 1.6679864058301488
Energy: 1.6678757608280885
Energy: 1.5319137786984394
Energy: 1.5301009221190949
Energy: 1.773855441894696
Energy: 1.5301009221190949
Energy: 1.5321566563500253
Energy: 1.530249060592496
Energy: 1.7693895602578498
Energy: 1.5302490605904508
Energy: 1.8228986200459807
Energy: 1.6677606444133672
Energy: 1.7061095595659541
Energy: 1.6677606444174582
Energy: 1.530610440964881
Energy: 1.5301630614978758
Energy: 2.034261464117422
Energy: 1.5301630615019668
Energy: 1.823050073145853
Energy: 1.667875760830134
Energy: 1.768838922554437
Energy: 1.6678757608280885
Energy: 1.5319137786984394
Energy: 1.5301009221211406
Energy: 1.7738554415961996
Energy: 1.5301009221190949

minimum gb energy = 1.5301009221190949 eV
minimum distance =  2.30074700814439 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.7518496703925905
Energy: 1.9469864399388783
Energy: 2.0541764131547557
Energy: 1.9469864399464487
Energy: 2.003954514653686
Energy: 1.7740794439146612
Energy: 1.6911855265455547
Energy: 1.774079443911633
Energy: 1.6638248829804427
Energy: 1.663558264459966
Energy: 1.6973731442381839
Energy: 1.6635582644645084
Energy: 1.846057901581731
Energy: 1.9765420878720084
Energy: 1.6772546562097435
Energy: 1.9765420878818503
Energy: 1.9345093186061078
Energy: 1.7716079577999584
Energy: 1.6906940423077133
Energy: 1.7716079577969301
Energy: 1.7300577731389135
Energy: 1.731060413806043
Energy: 1.8448033635478074
Energy: 1.7310604138083143
Energy: 2.1225393474046546
Energy: 1.7520343654904273
Energy: 1.692780151045573
Energy: 1.752034365500269
Energy: 1.6800369536603046
Energy: 1.967615967255252
Energy: 1.8313576758437495
Energy: 1.967615967249953
Energy: 1.667285592368743
Energy: 1.990932950012418
Energy: 1.7434617565240147
Energy: 1.9909329500078758
Energy: 1.7144595526778346
Energy: 1.765433877075873
Energy: 1.740193055258516
Energy: 1.7654338770751161
Energy: 1.6834855096004515
Energy: 1.8566011437868881
Energy: 2.040931160615046
Energy: 1.8566011437808319
Energy: 1.8920954839560975
Energy: 1.8562502364093545
Energy: 1.6781639897656389
Energy: 1.8562502363949704
Energy: 1.668187738553151
Energy: 1.7970554653488102
Energy: 1.9494837924485189
Energy: 1.7970554653488102
Energy: 1.8497861354111265
Energy: 2.0354676912894303
Energy: 1.6961060806931343
Energy: 2.035467691284131
Energy: 1.6870197267739184
Energy: 1.832544369708762
Energy: 1.8609553814943007
Energy: 1.8325443697080048
Energy: 1.675991078880945
Energy: 2.0052722424730436
Energy: 1.8092060612783447
Energy: 2.005272242476072
Energy: 1.7843946195995262
Energy: 1.9266715995742882
Energy: 1.686264064039157
Energy: 1.9266715995750452
Energy: 1.6906686831149893
Energy: 1.7520665518470135
Energy: 1.9951226845910983
Energy: 1.7520665518523129
Energy: 1.941516303091559
Energy: 1.983582529501139
Energy: 1.7337649880609862
Energy: 1.9835825294996248
Energy: 1.6784447158614857
Energy: 1.7772217489697013
Energy: 1.8359966667955183
Energy: 1.7772217489712154
Energy: 1.814428988935778
Energy: 1.9871125055943386
Energy: 1.8092285801239434
Energy: 1.987112505586011
Energy: 1.8049258959205232
Energy: 1.6725709597209648
Energy: 1.6653086233473418
Energy: 1.6725709597164224
Energy: 1.7459937011092181
Energy: 1.8284883330983213
Energy: 1.7165712034969212
Energy: 1.8284883331005926
Energy: 2.0547545041801647
Energy: 1.8564406492119438
Energy: 1.6791410058334184
Energy: 1.8564406492021017
Energy: 1.6912113465200005
Energy: 1.8449980803629427
Energy: 2.0594080221811337
Energy: 1.8449980803614288
Energy: 1.7300104034502937
Energy: 1.6636349205243262
Energy: 1.6650434884278207
Energy: 1.6636349205250833
Energy: 1.934700166562999
Energy: 1.9505757103476067
Energy: 1.8453556938887192
Energy: 1.9505757103505659
Energy: 1.7754704933704581
Energy: 1.9182524382414952
Energy: 1.845475685344249
Energy: 1.91825243823771
Energy: 1.7764292704625568
Energy: 1.6632528904469253
Energy: 1.6637231198718831
Energy: 1.6632528904424517
Energy: 1.6886301736867884
Energy: 1.8523468666150813
Energy: 2.0337319860879406
Energy: 1.8523468666173526
Energy: 1.936420575623314
Energy: 1.7931595009986685
Energy: 1.677781057449867
Energy: 1.7931595009933692
Energy: 1.7430940565034418
Energy: 1.8152634191460484
Energy: 1.7132037007569767
Energy: 1.8152634191445343
Energy: 1.7461785198254989
Energy: 1.8567379544013847
Energy: 1.6645837788422553
Energy: 1.8567379544006277
Energy: 1.8188301483357185
Energy: 1.9703824012365498
Energy: 1.8047228977033003
Energy: 1.9703824012297362
Energy: 1.686554993420088
Energy: 2.0092325588430104
Energy: 2.0987167457674194
Energy: 2.0092325588475526

minimum gb energy = 1.6632528904424517 eV
minimum distance =  2.23112316397737 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.7924214136578254
Energy: 1.791262525969368
Energy: 2.0020912198073524
Energy: 1.791262525969368
Energy: 1.8074528500311886
Energy: 1.8322901507338796
Energy: 1.6946846204821695
Energy: 1.8322901507350806
Energy: 1.7032156737353397
Energy: 1.777717281806507
Energy: 1.6943941323831215
Energy: 1.7777172818041047
Energy: 1.6753848045786088
Energy: 1.9279494558901464
Energy: 1.7134614978887117
Energy: 1.9279494558925487
Energy: 1.7660122108563336
Energy: 1.8311064100247365
Energy: 1.6949419159457968
Energy: 1.8311064100259375
Energy: 1.7142355076172642
Energy: 1.7025752087029344
Energy: 1.9695316813755521
Energy: 1.7025752087029344
Energy: 2.109105449333474
Energy: 1.9099821428573236
Energy: 1.7065049218938735
Energy: 1.9099821428549215
Energy: 1.6784821259283902
Energy: 1.6731425405581484
Energy: 1.9946615591278956
Energy: 1.673142540555746
Energy: 2.043323351515776
Energy: 1.6751803854989609
Energy: 1.68297786925337
Energy: 1.675180385500162
Energy: 1.7024619330988198
Energy: 1.820734986055995
Energy: 1.7005814118196123
Energy: 1.820734986055995
Energy: 1.6820547220333553
Energy: 1.7767630773480594
Energy: 1.9639500647640606
Energy: 1.7767630773492604
Energy: 1.8757415024356694
Energy: 1.9258702045490117
Energy: 1.6786649784764651
Energy: 1.9258702045430063
Energy: 1.7154205361449246
Energy: 1.7985873137962933
Energy: 1.9989617494750056
Energy: 1.7985873137950918
Energy: 2.0233018521528434
Energy: 1.909833968347229
Energy: 1.717872964122557
Energy: 1.9098339683460552
Energy: 1.6829937265370822
Energy: 1.964051290127775
Energy: 1.9587926379240337
Energy: 1.964051290128976
Energy: 1.96444947475605
Energy: 1.6736374960616587
Energy: 1.6787862380628862
Energy: 1.6736374960616587
Energy: 1.7975737332962147
Energy: 1.7941268253858398
Energy: 1.703314525116854
Energy: 1.7941268253858398
Energy: 1.793874884407645
Energy: 1.79191951077819
Energy: 1.7012265270377813
Energy: 1.79191951077819
Energy: 1.8682179273941348
Energy: 1.6728429630699455
Energy: 1.6759867827894757
Energy: 1.6728429630687445
Energy: 1.7094541883571732
Energy: 1.8436339902956889
Energy: 2.059493985839904
Energy: 1.84363399029689
Energy: 2.031989835874902
Energy: 1.775920142542837
Energy: 1.7143792140937382
Energy: 1.775920142542837
Energy: 1.7263516062645707
Energy: 1.830078538285347
Energy: 1.886207529132623
Energy: 1.830078538286521

minimum gb energy = 1.6728429630687445 eV
minimum distance =  2.26807503426664 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.712562568450745
Energy: 1.7124841367185073
Energy: 2.122097967324803
Energy: 1.7124841367074664
Energy: 2.0715994160561726
Energy: 1.7468304400950867
Energy: 1.7040571751414515
Energy: 1.7468304400976349
Energy: 1.682479595768199
Energy: 1.7128513923170263
Energy: 1.738853352065278
Energy: 1.7128513923170263
Energy: 1.7401778911000036
Energy: 1.8226952173702926
Energy: 1.7042171334074352
Energy: 1.8226952173728406
Energy: 1.682127298308332
Energy: 1.7917921731007598
Energy: 1.7046984371382128
Energy: 1.7917921730965132
Energy: 1.6832155265947655
Energy: 1.7134656508675763
Energy: 2.0048678692761994
Energy: 1.7134656508675763
Energy: 1.8808823560559997
Energy: 1.934963020343789
Energy: 1.7184220459028026
Energy: 1.9349630203361452
Energy: 1.6828927966067226
Energy: 1.714179116538304
Energy: 2.0617225261351186
Energy: 1.714179116535756
Energy: 1.8965715420897464
Energy: 1.8016031226678642
Energy: 1.698475020988879
Energy: 1.8016031226661655
Energy: 1.6837208834148438
Energy: 1.836032815943221
Energy: 1.8590338194608562
Energy: 1.8360328159466186
Energy: 1.7303512676355641
Energy: 1.9562009701427372
Energy: 1.7351780633835565
Energy: 1.9562009701384906
Energy: 1.739665908756218
Energy: 1.7927812045232192
Energy: 1.7330923584123064
Energy: 1.7927812045240687
Energy: 1.7275216305285144
Energy: 1.7175786124098025
Energy: 1.7426239904216196
Energy: 1.7175786124013093
Energy: 1.7198851054863964
Energy: 1.7008708337312362
Energy: 1.7350955071634202
Energy: 1.700870833730387
Energy: 1.6780346597391922
Energy: 1.9670272283122248
Energy: 1.882021820533638
Energy: 1.9670272283079782
Energy: 2.1526913415298603
Energy: 1.7007984597217845
Energy: 1.6992907823915517
Energy: 1.7007984597132915
Energy: 1.6872165208140273
Energy: 1.794328678900502
Energy: 1.7755195591629223
Energy: 1.7943286788979538
Energy: 1.7053576747132488
Energy: 1.9507495791079401
Energy: 1.7337813295418396
Energy: 1.9507495791036935
Energy: 1.687702829390826
Energy: 1.8531121924874117
Energy: 1.7326738469566838
Energy: 1.8531121924899594
Energy: 1.6793690249416602
Energy: 1.7959296500275943
Energy: 1.7326705473120312
Energy: 1.795929650029293
Energy: 1.7349422833931316
Energy: 1.959712086095449
Energy: 1.6986219398952036
Energy: 1.9597120860945998
Energy: 1.6834635649457605
Energy: 1.958160795767565
Energy: 1.8574240669564197
Energy: 1.958160795769264
Energy: 2.0392536709122657
Energy: 1.80283976777016
Energy: 1.7246427907130786
Energy: 1.8028397677693107
Energy: 1.7171919086964247
Energy: 1.7139440137051087
Energy: 2.0032725014094273
Energy: 1.713944013707657
Energy: 1.7440133551889168
Energy: 1.797249908445669
Energy: 1.7284210702035805
Energy: 1.797249908438874
Energy: 1.7307142654755265
Energy: 1.9547591210488673
Energy: 1.7306417781065406
Energy: 1.9547591210463195
Energy: 1.6822662001126492
Energy: 1.8291611916235195
Energy: 1.8656137205101588
Energy: 1.829161191619273
Energy: 1.7402633074956144
Energy: 1.7936523139530332
Energy: 1.7040713367782077
Energy: 1.7936523139555811
Energy: 1.6814033836808395
Energy: 1.7129865782535185
Energy: 1.9098304925199217
Energy: 1.712986578255217
Energy: 1.7156894261348032
Energy: 1.7396271140082722
Energy: 1.7149161779812787
Energy: 1.739627114002327
Energy: 1.6814026716418613
Energy: 1.71302848200407
Energy: 1.968009310086983
Energy: 1.7130284819930286

minimum gb energy = 1.6780346597391922 eV
minimum distance =  2.25174745517072 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.646747347085717
Energy: 1.6312954540947386
Energy: 2.1521469156260937
Energy: 1.6312954540947386
Energy: 1.5914986492872707
Energy: 1.6509569415283998
Energy: 1.651588025556666
Energy: 1.650956941543159
Energy: 1.5934716812309653
Energy: 1.7339847868080747
Energy: 1.7708539755577744
Energy: 1.733984786808666
Energy: 1.6502701092713397
Energy: 1.5904952582511218
Energy: 1.6527181722409423
Energy: 1.590495258026181
Energy: 1.6469977368730246
Energy: 1.7013347882501024
Energy: 1.659126862640193
Energy: 1.7013347882503984
Energy: 1.6454168159917808
Energy: 1.7320544498311239
Energy: 1.645728213887566
Energy: 1.7320544498316828
Energy: 1.6283288369819628
Energy: 1.70117604617949
Energy: 1.6469225899782485
Energy: 1.7011760461797858
Energy: 1.6523654112015391
Energy: 1.5902512197994982
Energy: 1.6503389006089577
Energy: 1.590251219799794
Energy: 1.7707027298651663
Energy: 1.733650613097974
Energy: 1.6538751588340386
Energy: 1.7336506130991571

minimum gb energy = 1.5902512197994982 eV
minimum distance =  2.30822166796978 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.5828022487153581
Energy: 1.6098434792903782
Energy: 1.8368503619221084
Energy: 1.6098434792903782
Energy: 1.5880862233212132
Energy: 1.640034674954618
Energy: 1.562517025132649
Energy: 1.640034674959432
Energy: 1.5372189018503477
Energy: 1.59747472982867
Energy: 1.8430102592619058
Energy: 1.5974747298294725
Energy: 1.5674970516503137
Energy: 1.6716380339001162
Energy: 1.560061742040351
Energy: 1.6716380339001162
Energy: 1.554864002101348
Energy: 1.683554409154747
Energy: 1.825825106572804
Energy: 1.683554409153945
Energy: 1.6480840799996141
Energy: 1.6120701692168797
Energy: 1.5429496637522415
Energy: 1.6120701692144728
Energy: 1.5384918497868603
Energy: 1.680202504020019
Energy: 1.5272838067980268
Energy: 1.680202504020019
Energy: 1.5340105514480578
Energy: 1.6144162672631797
Energy: 1.5397678430735446
Energy: 1.6144162672607727
Energy: 1.5529011794540264
Energy: 1.6800216469316724
Energy: 1.5780392944746882
Energy: 1.6800216469316724
Energy: 1.5471481240424667
Energy: 1.680363313050982
Energy: 1.5285426438060297
Energy: 1.6803633130533888
Energy: 1.5755758291058857
Energy: 1.7662569351091908
Energy: 1.5392660281198558
Energy: 1.7662569351099933
Energy: 1.5533431503961599
Energy: 1.7006209640280276
Energy: 1.6091834868764294
Energy: 1.7006209640280276
Energy: 1.653240270658917
Energy: 1.6116523936356517
Energy: 1.5974265148918174
Energy: 1.611652393636454
Energy: 1.5678986464695595
Energy: 1.6107726785821457
Energy: 1.6004323797953375
Energy: 1.6107726785805412
Energy: 1.6160553756862224
Energy: 1.674161929070191
Energy: 1.5396384780502128
Energy: 1.6741619290709933
Energy: 1.5504459671213775
Energy: 1.5963460101020979
Energy: 1.6329593948267704
Energy: 1.5963460101020979
Energy: 1.8317415129664723
Energy: 1.7044073542275795
Energy: 1.5629229658935813
Energy: 1.7044073542291842
Energy: 1.5523354626814112
Energy: 1.6102340399375055
Energy: 1.764776699911939
Energy: 1.6102340399383077
Energy: 1.5358037619676588
Energy: 1.6825425796445008
Energy: 1.541289773026916
Energy: 1.6825425796445008
Energy: 1.5401358055507945
Energy: 1.829050229674025
Energy: 1.5683593096971777
Energy: 1.829050229676432
Energy: 1.5428825221106235
Energy: 1.6116374782830882
Energy: 1.554855170205163
Energy: 1.6116374782830882
Energy: 1.5748246171462323
Energy: 1.6806695212868865
Energy: 1.54261464957396
Energy: 1.6806695212892935
Energy: 1.5428160318714512
Energy: 1.6124005182955612
Energy: 1.5603427071709541
Energy: 1.6124005182931542
Energy: 1.609034402730428
Energy: 1.6144319829850147
Energy: 1.5589618736712638
Energy: 1.6144319829874214
Energy: 1.6262017582024746
Energy: 1.5939148241698355
Energy: 1.5414033548710693
Energy: 1.5939148241706376
Energy: 1.5898055932241084
Energy: 1.6111128877241774
Energy: 1.5542758081758075
Energy: 1.6111128877225729
Energy: 1.5431728716732316
Energy: 1.6598363516556323
Energy: 1.5687364590714925
Energy: 1.6598363516548298
Energy: 1.6724375439014256
Energy: 1.6534237336718367
Energy: 1.550614410710714
Energy: 1.6534237336718367
Energy: 1.5496725005713015
Energy: 1.6408635808913736
Energy: 1.8361851539907166
Energy: 1.6408635808897691
Energy: 1.7654736081897997
Energy: 1.7685925446409263
Energy: 1.5542031925600042
Energy: 1.7685925446401238
Energy: 1.5376659973431
Energy: 1.569579882723525
Energy: 1.7693129723085221
Energy: 1.5695798827251295
Energy: 1.819190002592562
Energy: 1.6489963260012548
Energy: 1.536732843845275
Energy: 1.6489963259932319
Energy: 1.55435997042712
Energy: 1.6521876451773427
Energy: 1.5531018705761896
Energy: 1.6521876451765405

minimum gb energy = 1.5272838067980268 eV
minimum distance =  2.24398658929949 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.5365667205862177
Energy: 1.5368888960740759
Energy: 1.6135811153849737
Energy: 1.5368888960762948
Energy: 1.5299501787285263
Energy: 1.7653475015540485
Energy: 1.4961680594592341
Energy: 1.765347501552939
Energy: 1.4543163839271651
Energy: 1.536556197786618
Energy: 2.0218304059302876
Energy: 1.536556197788837
Energy: 1.5537132399463105
Energy: 1.6342867670878178
Energy: 1.476969864357403
Energy: 1.6342867670878178
Energy: 1.4543953595315835
Energy: 1.6843351262913873
Energy: 1.8534699983927125
Energy: 1.6843351262891684
Energy: 1.456020133959935
Energy: 1.7628593492419595
Energy: 1.4763870998059625
Energy: 1.7628593492452875
Energy: 1.4541832281868985
Energy: 1.684231176047178
Energy: 1.511995456343377
Energy: 1.6842311760493964
Energy: 1.4546672400098724
Energy: 1.5414410420096631
Energy: 1.5343229286405733
Energy: 1.5414410420118816
Energy: 1.5356770579351915
Energy: 1.5332770873303905
Energy: 1.559181439173492
Energy: 1.5332770873314998
Energy: 1.5356704824373009
Energy: 1.5333111480008152
Energy: 1.5329596147706406
Energy: 1.5333111479997061
Energy: 1.4549285269045
Energy: 1.5415411863131516
Energy: 1.503766289833911
Energy: 1.5415411862976214
Energy: 1.4546419761406415
Energy: 1.6847340703873221
Energy: 1.5215456980296103
Energy: 1.6847340703839944
Energy: 1.4557158173269615
Energy: 1.762523541385591
Energy: 1.4768439454229827
Energy: 1.762523541384482
Energy: 1.454259005311453
Energy: 1.6841855061197417
Energy: 1.7256946394467647
Energy: 1.6841855061219604
Energy: 1.5537780197621365
Energy: 1.6352512639567347
Energy: 1.4773248762688331
Energy: 1.6352512639545163
Energy: 1.4542667893443557
Energy: 1.536315777581512
Energy: 1.614481273338944
Energy: 1.5363157775804024
Energy: 1.5301695105578599
Energy: 1.544243994673236
Energy: 1.4961911863346322
Energy: 1.544243994672127
Energy: 1.5365667205873268
Energy: 1.536888896072967
Energy: 1.6283673409758883
Energy: 1.5368888960796225
Energy: 1.5299501787296355
Energy: 1.7653475015551576
Energy: 1.4961680594592341
Energy: 1.765347501552939
Energy: 1.4543163839282744
Energy: 1.5365561977855595
Energy: 2.0218304059291783
Energy: 1.5365561977899462
Energy: 1.5537132399452012
Energy: 1.6342867670878178
Energy: 1.4769698643585123
Energy: 1.634286767088927
Energy: 1.4543953595326928
Energy: 1.6843351262913873
Energy: 1.8336689253671075
Energy: 1.6843351262891684
Energy: 1.456020133959935
Energy: 1.7628593492419595
Energy: 1.4763870998048534
Energy: 1.7628593492430689
Energy: 1.4541832281868985
Energy: 1.6842311760460684
Energy: 1.4893332581069048
Energy: 1.684231176048287

minimum gb energy = 1.4541832281868985 eV
minimum distance =  2.26651770752918 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.5168644791711312
Energy: 1.5196286213602974
Energy: 1.7890103865990212
Energy: 1.5196286213630399
Energy: 1.7232031596206119
Energy: 1.4974631209474456
Energy: 1.4683428234565523
Energy: 1.4974631209481313
Energy: 1.4627048859208651
Energy: 1.4965950839894127
Energy: 1.8176881852810356
Energy: 1.4965950839873559
Energy: 1.5706710982557353
Energy: 1.7765403645582918
Energy: 1.4627220793760873
Energy: 1.776540364559663
Energy: 1.4600876382977355
Energy: 1.6104058332378177
Energy: 1.527071193400711
Energy: 1.6104058332378177
Energy: 1.4655241286476435
Energy: 2.0235351580839485
Energy: 1.4846169891214354
Energy: 2.0235351580818914
Energy: 1.4846180141940575
Energy: 1.5838971929825363
Energy: 1.4963715772849524
Energy: 1.5838971929825363
Energy: 1.4729056833623309
Energy: 1.8042047279101336
Energy: 1.4546662238288761
Energy: 1.8042047279101336
Energy: 1.5140591985963547
Energy: 1.8060159308635177
Energy: 1.5218011578567436
Energy: 1.806015930864889
Energy: 1.5156697678573623
Energy: 1.8020393444165197
Energy: 1.4645163523215032
Energy: 1.8020393444185765
Energy: 1.469012923063721
Energy: 1.773847667503112
Energy: 1.4560634866303415
Energy: 1.7738476675010548
Energy: 1.4725611287957734
Energy: 1.5755613233931511
Energy: 1.4599005189699188
Energy: 1.575561323393837
Energy: 1.470437988592923
Energy: 2.0695439938311107
Energy: 1.4684634121550009
Energy: 2.069543993832482
Energy: 1.4652680181894793
Energy: 1.6086392889177834
Energy: 1.516964019522987
Energy: 1.6086392889164123
Energy: 1.4628588225354104
Energy: 1.7818623424958817
Energy: 1.5290111359463732
Energy: 1.7818623424965674
Energy: 1.4710844406858246
Energy: 1.4977077563819081
Energy: 1.5188220143005768
Energy: 1.4977077563825936
Energy: 1.5036423346424266
Energy: 1.7839833671051757
Energy: 1.465631639766813
Energy: 1.7839833671072325
Energy: 1.4564405700264822
Energy: 1.6643067244009435
Energy: 1.505234739450438
Energy: 1.6643067243988865
Energy: 1.7053905566866538
Energy: 1.8080642918945609
Energy: 1.467823370748149
Energy: 1.8080642918911327
Energy: 1.4778869900813325
Energy: 1.4980422094976074
Energy: 1.5868102335697278
Energy: 1.4980422094962362
Energy: 1.4965991595172632
Energy: 1.4845490792895242
Energy: 1.4820039637126794
Energy: 1.4845490792888387
Energy: 1.4822039915591232
Energy: 1.5168719905138182
Energy: 1.5244375399154027
Energy: 1.5168719905131327
Energy: 1.7051197177780069
Energy: 1.7921384195263717
Energy: 1.4803210014550974
Energy: 1.7921384195243146
Energy: 1.4686798242287975
Energy: 1.586208103579611
Energy: 1.71962577356722
Energy: 1.586208103579611
Energy: 1.5376035722117647
Energy: 1.6638282668609485
Energy: 1.458831531776621
Energy: 1.6638282668595772
Energy: 1.4687819883323885
Energy: 1.6130917450808968
Energy: 1.4704510362143095
Energy: 1.6130917450815825
Energy: 1.6987988397680354
Energy: 1.5564366249871817
Energy: 1.4735943598190604
Energy: 1.556436624985125
Energy: 1.535552845694448
Energy: 1.7835955178944085
Energy: 1.458125023659307
Energy: 1.7835955178957799
Energy: 1.51594379809724
Energy: 1.6079861174113914
Energy: 1.4720343386922412
Energy: 1.6079861174148193
Energy: 1.4686663471585664
Energy: 2.0691053460706095
Energy: 1.5094269651327141
Energy: 2.0691053460719804
Energy: 1.4574235529596222
Energy: 1.608436406390037
Energy: 1.4685464819749379
Energy: 1.6084364063893515
Energy: 1.4586975905651067
Energy: 1.7737075855665987
Energy: 1.474191810670008
Energy: 1.7737075855685933
Energy: 1.4740146782739767
Energy: 1.4903455997162396
Energy: 1.7330909561132817
Energy: 1.4903455996538466
Energy: 1.5296687949202343
Energy: 1.8077793646423752
Energy: 1.4968589640773544
Energy: 1.8077793646410039
Energy: 1.454627122022193
Energy: 1.5186635976596516
Energy: 1.5300354417158857
Energy: 1.5186635976610228
Energy: 1.4983668263812622
Energy: 1.5866827634959677
Energy: 1.4899336378191987
Energy: 1.586682763493911
Energy: 1.4807227384590214
Energy: 1.7975677524204872
Energy: 1.4769078891742544
Energy: 1.7975677524204872
Energy: 1.5125739120824448
Energy: 1.6127999695500126
Energy: 1.4708467645133056
Energy: 1.612799969550698

minimum gb energy = 1.454627122022193 eV
minimum distance =  2.25341704270918 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.3371346763433185
Energy: 1.3373690214747378
Energy: 1.4090521394012252
Energy: 1.337369021472944
Energy: 1.3379686202600731
Energy: 1.3879634919985526
Energy: 1.3575622613550928
Energy: 1.3879634919985526
Energy: 1.3546616802036286
Energy: 1.5978771386271364
Energy: 2.219817707632115
Energy: 1.5978771386163726
Energy: 1.3598969352151171
Energy: 1.3879334257196037
Energy: 1.3577470067588262
Energy: 1.3879334257196037
Energy: 1.3544781345231751
Energy: 1.4766843647224608
Energy: 1.3382955040174391
Energy: 1.4766843647224608
Energy: 1.3542360137874123
Energy: 1.3390814600119776
Energy: 1.3413193796187015
Energy: 1.3390814600101835
Energy: 1.354852028912951
Energy: 1.6031117299987756
Energy: 1.337030544175057
Energy: 1.6031117299987756
Energy: 1.3496521652660238
Energy: 1.597238791273551
Energy: 1.3577862554438414
Energy: 1.597238791273551
Energy: 1.353873426513093
Energy: 1.476812193861352
Energy: 1.3596212398531877
Energy: 1.4768121938595578
Energy: 1.3879725407909944
Energy: 1.4717929866207136
Energy: 1.354087738683295
Energy: 1.4717929865902157
Energy: 1.3366762914436392
Energy: 1.3892485849854297
Energy: 1.354135974862617
Energy: 1.3892485849836356
Energy: 1.3373234267067828
Energy: 1.5980339547016282
Energy: 1.3582874663267985
Energy: 1.5980339547016282
Energy: 1.3538938913784566
Energy: 1.3416846140389227
Energy: 1.3604399005169003
Energy: 1.3416846140389227
Energy: 1.3541038869481457
Energy: 1.4725770148492625
Energy: 1.354007357806607
Energy: 1.4725770148510564
Energy: 1.362549689318636
Energy: 1.3415954571342796
Energy: 1.3537472285496681
Energy: 1.3415954571324855

minimum gb energy = 1.3366762914436392 eV
minimum distance =  2.28326706048947 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.3335833239446977
Energy: 1.7569453091450113
Energy: 1.6613888714865341
Energy: 1.7569453091344844
Energy: 1.3721967324554385
Energy: 1.5427371086591697
Energy: 1.2673367311025554
Energy: 1.5427371086659372
Energy: 1.2817728927562535
Energy: 1.7646023561268054
Energy: 1.5151749261498915
Energy: 1.7646023561132709
Energy: 1.2758056876454855
Energy: 1.545177695904497
Energy: 1.2632343213138104
Energy: 1.5451776958992338
Energy: 1.296941147307811
Energy: 1.611767178427749
Energy: 1.3446229223039567
Energy: 1.6117671784254932
Energy: 1.2629298088155536
Energy: 1.3158617260665515
Energy: 1.299159689940139
Energy: 1.3158617260740706
Energy: 1.2890857287213797
Energy: 1.612048931831476
Energy: 1.4841702471212141
Energy: 1.6120489318277162
Energy: 1.2528651168727452
Energy: 1.7888851554923126
Energy: 1.299500874759174
Energy: 1.7888851554900573
Energy: 1.2897957852951742
Energy: 1.6106994610962486
Energy: 1.5341111129736902
Energy: 1.610699461103016
Energy: 1.5299097686734415
Energy: 1.6376143830932262
Energy: 1.2634689841209816
Energy: 1.6376143830849552
Energy: 1.2892812016474118
Energy: 1.4124311186870704
Energy: 1.2623078447258465
Energy: 1.4124311186960932
Energy: 1.7286543139652342
Energy: 1.638266327415103
Energy: 1.2716237502837675
Energy: 1.6382663274203664
Energy: 1.3463298106203447
Energy: 1.3053335522907212
Energy: 1.2823914851604132
Energy: 1.3053335522929772
Energy: 1.7721411491701162
Energy: 1.4123901526304263
Energy: 1.271540823469062
Energy: 1.4123901526311784
Energy: 1.2895804252890173
Energy: 1.280011793469789
Energy: 1.280013230721116
Energy: 1.2800117934667814
Energy: 1.2739144462405805
Energy: 1.4124539603241741
Energy: 1.2751856477481984
Energy: 1.4124539603271817
Energy: 1.2897979735850176
Energy: 1.3717252919091614
Energy: 1.2602340893703707
Energy: 1.3717252918978824
Energy: 1.3181043069381824
Energy: 1.378081630337546
Energy: 1.2956204096117
Energy: 1.378081630339802
Energy: 1.2899364682832584
Energy: 1.3072365783316755
Energy: 1.2948850353856671
Energy: 1.307236578336939
Energy: 1.2898888754769329
Energy: 1.3058055604882988
Energy: 1.294930140592602
Energy: 1.3058055604913064
Energy: 1.318362849634616
Energy: 1.3780484002906195
Energy: 1.295239244897855
Energy: 1.378048400303402
Energy: 1.289349498245569
Energy: 1.3720718215086791
Energy: 1.2758619027737172
Energy: 1.3720718214966485
Energy: 1.274502485583053
Energy: 1.412230765992989
Energy: 1.2603837377379943
Energy: 1.412230765993741
Energy: 1.289852961597417
Energy: 1.2801146318746297
Energy: 1.2766882873160978
Energy: 1.2801146318813967
Energy: 1.768038685579671
Energy: 1.4121870643390138
Energy: 1.2723418733265173
Energy: 1.4121870643322467
Energy: 1.3487440653733411
Energy: 1.305885469492316
Energy: 1.2687081104228477
Energy: 1.3058854695103623
Energy: 1.7284991085091237
Energy: 1.6367859707060355
Energy: 1.2716765056554014
Energy: 1.6367859707052834
Energy: 1.289049441858533
Energy: 1.412883281054038
Energy: 1.2623285455743118
Energy: 1.4128832810495267
Energy: 1.52978211700534
Energy: 1.6379858693275426
Energy: 1.2634861049125514
Energy: 1.6379858693177674
Energy: 1.2888820078973193
Energy: 1.6107933808350132
Energy: 1.5188911276560149
Energy: 1.6107933808417805
Energy: 1.2528513824408338
Energy: 1.788972797694335
Energy: 1.299301105832281
Energy: 1.7889727976950869
Energy: 1.2899932419434732
Energy: 1.6117040679126455
Energy: 1.7570781481244664
Energy: 1.6117040679021188
Energy: 1.2794257156511202
Energy: 1.315825232397313
Energy: 1.2992012784648104
Energy: 1.315825232407088
Energy: 1.2897956591365112
Energy: 1.6115759372709597
Energy: 1.7294126660127593
Energy: 1.6115759372754708
Energy: 1.275900317357472
Energy: 1.5439387240800007
Energy: 1.2634290353366948
Energy: 1.543938724074737

minimum gb energy = 1.2528513824408338 eV
minimum distance =  2.25210200890561 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.2289146995489302
Energy: 1.2283529654806884
Energy: 1.399277458574962
Energy: 1.2283529654819525
Energy: 1.3062397379753454
Energy: 1.2298158904107748
Energy: 1.1617178969639066
Energy: 1.2298158904107748
Energy: 1.1774604290870467
Energy: 1.3995334077814743
Energy: 1.9751068230830233
Energy: 1.3995334077814743
Energy: 1.1511158028120736
Energy: 1.596517936010012
Energy: 1.1620112080659917
Energy: 1.596517936010012
Energy: 1.1604471747015137
Energy: 1.2280966727294307
Energy: 1.1508901764571937
Energy: 1.2280966727307243
Energy: 1.145478650684023
Energy: 1.2281473163865384
Energy: 1.154687222775677
Energy: 1.2281473163994456
Energy: 1.1608101696519366
Energy: 2.123774295538121
Energy: 1.5600286437013478
Energy: 2.123774295538121
Energy: 1.1599760624933397
Energy: 1.2292220647278085
Energy: 1.2325691851047667
Energy: 1.2292220647278085
Energy: 1.160190758441547
Energy: 1.228022545968467
Energy: 1.76419615069932
Energy: 1.228022545968467
Energy: 1.5766115437194912
Energy: 1.7330118742662601
Energy: 1.1545755749122444
Energy: 1.7330118742662601
Energy: 1.1951641071897796
Energy: 2.1125924565132914
Energy: 1.1510087928140973
Energy: 2.112592456511998
Energy: 1.6003453807769743
Energy: 1.2283616142529405
Energy: 1.161885503295216
Energy: 1.2283616142529405
Energy: 1.15046228894032
Energy: 1.2280574763743601
Energy: 1.1705787721798762
Energy: 1.2280574763743601
Energy: 1.5599273392719095
Energy: 1.6428505322127553
Energy: 1.1602186247861526
Energy: 1.6428505321519533
Energy: 1.2279276160228594
Energy: 1.299028070976511
Energy: 1.1598303829432435
Energy: 1.299028070976511
Energy: 1.2284738860853934
Energy: 1.2278963026237897
Energy: 1.1620149038616125
Energy: 1.2278963026276708
Energy: 1.1505583037534202
Energy: 1.3745018360295176
Energy: 1.1703166418130915
Energy: 1.3745018360295176
Energy: 1.1508410908076574
Energy: 2.113759880860964
Energy: 1.160011916806425
Energy: 2.11375988085967
Energy: 1.1606804860234115
Energy: 1.2301078874504194
Energy: 1.1598933828059583
Energy: 1.230107887451713
Energy: 1.1598954998271163
Energy: 1.2277957092046392
Energy: 1.150552744182869
Energy: 1.2277957092059328

minimum gb energy = 1.145478650684023 eV
minimum distance =  2.29744049120069 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.3026569075319159
Energy: 1.376048780962368
Energy: 1.0272540927554175
Energy: 1.376048780961358
Energy: 1.5574245896324304
Energy: 1.3801431820348244
Energy: 1.0720006978704142
Energy: 1.3801431820338141
Energy: 1.2224758275738663
Energy: 1.223523811636074
Energy: 1.3627577988631883
Energy: 1.2235238116320333
Energy: 1.2871853432453566
Energy: 1.550679029025698
Energy: 1.0789615429981463
Energy: 1.550679029024688
Energy: 1.0946497656030292
Energy: 1.6685214458188156
Energy: 1.1203716967412214
Energy: 1.6685214458167952
Energy: 1.1827494532058485
Energy: 1.3698343399524069
Energy: 1.0949537047243378
Energy: 1.3698343399524069
Energy: 1.0748819787127029
Energy: 1.3564649169302654
Energy: 1.2890690991521954
Energy: 1.3564649169353165
Energy: 1.0495004093183113
Energy: 1.2822079501603754
Energy: 1.2248800217056228
Energy: 1.2822079501613857
Energy: 1.0740394677506917
Energy: 1.3793137923103127
Energy: 1.5855135725306224
Energy: 1.3793137923103127
Energy: 1.030479687637268
Energy: 1.3547662859420257
Energy: 1.1468898690018996
Energy: 1.3547662859400054
Energy: 1.0751497912725294
Energy: 1.065857796204018
Energy: 1.6532947327234757
Energy: 1.0658577961999773
Energy: 1.3627948792940736
Energy: 1.7163134972662009
Energy: 1.2248868127684118
Energy: 1.7163134972662009
Energy: 1.0812835651606199
Energy: 1.2708611526496973
Energy: 1.4983247338363945
Energy: 1.2708611526456566
Energy: 1.3811330147421788
Energy: 1.3559159405228813
Energy: 1.0951816516622215
Energy: 1.355915940544095
Energy: 1.0969241132471599
Energy: 1.2115256957669105
Energy: 1.1836183961718534
Energy: 1.2115256957679206
Energy: 1.5268954857202426
Energy: 1.5273410131457492
Energy: 1.0731982645069933
Energy: 1.527341013144739
Energy: 1.230992648842903
Energy: 1.2821444270668532
Energy: 1.1804869493902719
Energy: 1.2821444270658429
Energy: 1.5380599499097316
Energy: 1.243836557574239
Energy: 1.0721006555165613
Energy: 1.2438365575752492
Energy: 1.3097532723427616
Energy: 1.089280135033855
Energy: 1.0315686370337904
Energy: 1.0892801350318344
Energy: 1.7912841116278728
Energy: 1.5271460031865096
Energy: 1.0731953607669131
Energy: 1.5271460031854995
Energy: 1.2301542243592059
Energy: 1.7197866303738205
Energy: 1.0270128246470989
Energy: 1.7197866303768508
Energy: 1.2247282394327499
Energy: 1.1294235641917447
Energy: 1.0834494267272798
Energy: 1.1294235641887145
Energy: 1.0932225870989734
Energy: 1.067401405321722
Energy: 1.3824684205069597
Energy: 1.0674014053227323
Energy: 1.1840724999733823
Energy: 1.2618844460027314
Energy: 1.0930651566627745
Energy: 1.2618844460098027
Energy: 1.0728835883884884
Energy: 1.5257810031218173
Energy: 1.5234635797986127
Energy: 1.5257810031208072
Energy: 1.0425590710304589
Energy: 1.2824409175200708
Energy: 1.2327691903685336
Energy: 1.282440917521081

minimum gb energy = 1.0270128246470989 eV
minimum distance =  2.25470695181037 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.459164236278499
Energy: 1.4599488563938408
Energy: 0.9431050856063902
Energy: 1.4599488563930125
Energy: 1.505565717232063
Energy: 1.2089802920824408
Energy: 0.959722549128048
Energy: 1.2089802920824408
Energy: 0.9997479082501894
Energy: 1.1935043581393359
Energy: 1.6791250927617212
Energy: 1.1935043581393359
Energy: 1.263837033105593
Energy: 1.4469982181215335
Energy: 0.9596170270650073
Energy: 1.446998218119049
Energy: 0.9535070466498383
Energy: 1.4834208425921318
Energy: 1.00512661641098
Energy: 1.4834208425921318
Energy: 1.0140454332625761
Energy: 1.208060532587159
Energy: 0.959663369455954
Energy: 1.2080605325846743
Energy: 0.9586681131912513
Energy: 1.451016321654905
Energy: 1.0132649467387584
Energy: 1.451016321654905
Energy: 0.9302424887028298
Energy: 1.2288565689254276
Energy: 0.954863527242765
Energy: 1.2288565689245994
Energy: 0.9630319271763925
Energy: 1.2283876296768388
Energy: 1.2579298905859047
Energy: 1.2283876296768388
Energy: 0.9357072454939644
Energy: 1.1937686889751709
Energy: 1.0009534989677058
Energy: 1.1937686889851091
Energy: 0.9586436032440568
Energy: 1.2092429766769728
Energy: 1.6570202694154497
Energy: 1.209242976677801
Energy: 0.9337241571706945
Energy: 1.2315245861166584
Energy: 1.4602358273611944
Energy: 1.231524586114174
Energy: 0.9628329357751749
Energy: 1.6279308431828354
Energy: 1.6574967986356397
Energy: 1.6279308431828354
Energy: 1.202042632004642
Energy: 1.418352029764885
Energy: 1.0011760066266395
Energy: 1.4183520297640566
Energy: 0.9587613939425191
Energy: 0.9753807300589946
Energy: 1.4499003756640432
Energy: 0.9753807300680293
Energy: 1.2179047088326154
Energy: 1.4802279216234293
Energy: 0.9547956908883964
Energy: 1.4802279216242575
Energy: 0.9630808433097011
Energy: 1.629239610508192
Energy: 1.191341744675141
Energy: 1.6292396105098483
Energy: 1.2114756480345716
Energy: 1.3960408786640068
Energy: 0.9596287305786789
Energy: 1.3960408786631786
Energy: 0.9586599618660382
Energy: 1.0001486594488318
Energy: 0.9303215635041762
Energy: 1.0001486594513165
Energy: 1.2266139749832938
Energy: 1.228355799308983
Energy: 0.9667586482836762
Energy: 1.228355799308983
Energy: 1.0045578322803292
Energy: 1.3955656546203452
Energy: 0.9351582176609775
Energy: 1.395565654621173
Energy: 1.6669417557487045
Energy: 1.7821293551820798
Energy: 0.9599911549158016
Energy: 1.7821293551812514
Energy: 1.4630083094941233
Energy: 1.2297002222764115
Energy: 0.9359372235286414
Energy: 1.2297002222764115
Energy: 1.480765979344236
Energy: 1.627262349435272
Energy: 0.9683646108149302
Energy: 1.6272623494336156
Energy: 1.004515886505498
Energy: 1.097592221779274
Energy: 0.9339054450330965
Energy: 1.0975922217850715
Energy: 1.4372924592813323
Energy: 1.7797906287389182
Energy: 0.9598900599016582
Energy: 1.7797906287397465
Energy: 0.9586108990107817
Energy: 1.2282635399333592
Energy: 1.2186198027936996
Energy: 1.2282635399300466
Energy: 0.9546096308150964
Energy: 1.397362213409079
Energy: 0.9667388220747039
Energy: 1.3973622134065944
Energy: 0.9631771067087413
Energy: 1.097807052952122
Energy: 1.211601616821294
Energy: 1.0978070529496375
Energy: 0.9301502804792875
Energy: 1.6783930344454308
Energy: 0.9643721456138203
Energy: 1.6783930344486682
Energy: 0.9671403088455695
Energy: 1.2284423549871533
Energy: 1.2263283115715997
Energy: 1.2284423549871533
Energy: 0.9360540150160824
Energy: 1.3950313230830744
Energy: 1.0101851077575459
Energy: 1.3950313230830744

minimum gb energy = 0.9301502804792875 eV
minimum distance =  2.2671893396219 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.3240520399025613
Energy: 0.9064683068653817
Energy: 1.6412369679782017
Energy: 0.9064683068626391
Energy: 1.6767765997361819
Energy: 1.098606256600431
Energy: 0.9030248107800073
Energy: 1.0986062566032373
Energy: 0.9414436598707696
Energy: 1.2958090066510244
Energy: 1.5824839032924065
Energy: 1.295809006651726
Energy: 1.4733755735966487
Energy: 1.1022450923013771
Energy: 0.9029693517557832
Energy: 1.1022450923020788
Energy: 0.8989648593736832
Energy: 1.2847705062830883
Energy: 0.9170254774852409
Energy: 1.2847705062823864
Energy: 1.292911577155975
Energy: 1.096630359989114
Energy: 0.9028641078023042
Energy: 1.096630359987711
Energy: 0.9024293067975259
Energy: 1.3127245227119881
Energy: 0.9218380642753253
Energy: 1.3127245227126896
Energy: 1.079742195885871
Energy: 1.1155559823156505
Energy: 0.9027590191672209
Energy: 1.1155559823969703
Energy: 0.9051715915554037
Energy: 0.9224281743273594
Energy: 1.23032447139865
Energy: 0.9224281743280609
Energy: 0.8561271714393607
Energy: 0.9010828352283216
Energy: 0.9000941104981719
Energy: 0.9010828350522878
Energy: 0.9027443456679156
Energy: 1.0984284274313545
Energy: 1.5127570534105312
Energy: 1.09842842742925
Energy: 0.8596499760896391
Energy: 1.0978372180900073
Energy: 0.9422024204822623
Energy: 1.0978372180724678
Energy: 0.9054015756363505
Energy: 0.9230061105371287
Energy: 1.6593063659731977
Energy: 0.9230061105041544
Energy: 0.859692516327744
Energy: 0.9063446572296858
Energy: 1.3244334357356027
Energy: 0.9063446572324922
Energy: 0.9022427650948189
Energy: 1.099515712155841
Energy: 1.6710759672002942
Energy: 1.0995157136705602
Energy: 1.085075651028942
Energy: 1.0976397858591276
Energy: 0.9421721771952356
Energy: 1.0976397858591276
Energy: 0.9051835823362916
Energy: 0.9224374003683116
Energy: 1.4967029648039287
Energy: 0.9224374003669084
Energy: 1.1025241550623004
Energy: 1.285814135513322
Energy: 0.9001426012373197
Energy: 1.2858141355119188
Energy: 0.9023164245101379
Energy: 1.0968223918485611
Energy: 1.2942059461808595
Energy: 1.0968223918548756
Energy: 1.096486340404517
Energy: 1.103404786763439
Energy: 0.90290603952366
Energy: 1.1034047868756285
Energy: 0.905338288524497
Energy: 1.1328522700850916
Energy: 1.184499085934628
Energy: 1.132852270080882
Energy: 1.1045029244346163
Energy: 0.9242977194125399
Energy: 0.9090238589065963
Energy: 0.9242977194083304
Energy: 0.9021009501161543
Energy: 0.9006120615554726
Energy: 0.8557552183908548
Energy: 0.9006120615526662
Energy: 1.5320640840847046
Energy: 1.0970052732979116
Energy: 0.9030305692343626
Energy: 1.097005273300718
Energy: 0.9450190667313352
Energy: 1.1330822209531275
Energy: 0.862445021686527
Energy: 1.1330822209580385
Energy: 1.4966165945721952
Energy: 0.9214503326379531
Energy: 0.9089764351161108
Energy: 0.9214503326386547
Energy: 1.327428870660412
Energy: 0.9008581509275795
Energy: 0.8593940712947622
Energy: 0.9008581509268779
Energy: 1.66444605313452
Energy: 1.0966713906247518
Energy: 0.903288201007226
Energy: 1.0966713905792125
Energy: 0.9446180497681579
Energy: 1.312492628288594
Energy: 0.8729827982101539
Energy: 1.3124926282892955
Energy: 1.2955729568118364
Energy: 0.9209610215875178
Energy: 0.9088057889981844
Energy: 0.9209610215819053
Energy: 0.9022790372040624
Energy: 1.278447137313753
Energy: 1.1029268466040234
Energy: 1.278447137310245
Energy: 1.3204967491968032
Energy: 0.9019363667459096
Energy: 0.9032816340847535
Energy: 0.9019363667431033
Energy: 0.9051858011673446
Energy: 1.3149580954028404
Energy: 1.0963210540192951
Energy: 1.3149580954042432
Energy: 0.8712777541187623
Energy: 1.1325483318448197
Energy: 0.908634394067297
Energy: 1.1325483318420133
Energy: 0.8916607360925689
Energy: 0.9808197119769019
Energy: 1.104989217700824
Energy: 0.9808197119740956
Energy: 0.8555670841640944
Energy: 0.8999256092593332
Energy: 0.9058061568712531
Energy: 0.8999256092565269
Energy: 0.9052179444232016
Energy: 1.3148506678354523
Energy: 1.540725206581185
Energy: 1.3148506678389602

minimum gb energy = 0.8555670841640944 eV
minimum distance =  2.28314296649573 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.259826503182429
Energy: 0.9000317114871956
Energy: 1.0383177143107714
Energy: 0.900031711486587
Energy: 1.5471972274738879
Energy: 1.0449226356938768
Energy: 0.8370268316959718
Energy: 1.0449226356981087
Energy: 1.2015815656691846
Energy: 1.2023170885769094
Energy: 1.022430493605953
Energy: 1.2023170885763013
Energy: 1.485120767416211
Energy: 1.046351108057288
Energy: 0.8368336890853955
Energy: 1.0463511080639813
Energy: 0.8899399083011335
Energy: 1.159461289864017
Energy: 0.7696594434195939
Energy: 1.1594612898627998
Energy: 1.314074092697689
Energy: 1.0484007829695994
Energy: 0.8368023605904649
Energy: 1.048400782970208
Energy: 0.8328472122741895
Energy: 1.2298909965873035
Energy: 0.8788551056809739
Energy: 1.2298909965866953
Energy: 1.1485974694902816
Energy: 1.0462706327820204
Energy: 0.8367695059462233
Energy: 1.0462706327820204
Energy: 0.8362153531678617
Energy: 1.1808933065534968
Energy: 1.0583238276887805
Energy: 1.1808933065541054
Energy: 0.9649189464542738
Energy: 1.229730652308795
Energy: 0.8336685104746184
Energy: 1.2297306523081863
Energy: 0.8390243599124567
Energy: 1.044600611380048
Energy: 1.2387468547287677
Energy: 1.044600611380048
Energy: 0.7698783949634591
Energy: 0.8899097827271235
Energy: 0.8909304753264158
Energy: 0.889909782726515
Energy: 0.8360600306139255
Energy: 1.18036945463847
Energy: 1.5825905715337452
Energy: 1.18036945463847
Energy: 0.7696870827996248
Energy: 1.2021660379003136
Energy: 1.2026998532513846
Energy: 1.2021660379003136
Energy: 0.837061157646841
Energy: 1.046200761111218
Energy: 1.639331628110838
Energy: 1.0462007611118267
Energy: 0.7717336701219409
Energy: 0.8996476386512215
Energy: 1.2605870224072941
Energy: 0.8996476386512215
Energy: 0.8360192750212617
Energy: 1.1807565410955014
Energy: 1.63973745672164
Energy: 1.1807565410955014
Energy: 0.9695532180589399
Energy: 1.2024083932831222
Energy: 1.202325062683215
Energy: 1.2024083932831222
Energy: 0.837163253689695
Energy: 1.0466018443434633
Energy: 1.484535432090745
Energy: 1.0466018443428549
Energy: 0.982616706873936
Energy: 0.8983806716469098
Energy: 0.8909107789373204
Energy: 0.8983806716469098
Energy: 0.8362382465249233
Energy: 1.1808886807335266
Energy: 1.3138579947833906
Energy: 1.180888680732918
Energy: 0.9802123099174387
Energy: 1.2168887086338358
Energy: 0.8339041813073945
Energy: 1.2168887086332274
Energy: 0.8370837252143168
Energy: 1.0448818011798722
Energy: 1.1373202839733598
Energy: 1.0448818011786554
Energy: 0.9971964274040072
Energy: 0.9297265339226716
Energy: 0.8368669940031612
Energy: 0.9297265339226716
Energy: 0.8360500317171551
Energy: 1.0453554219474805
Energy: 0.9648867699602429
Energy: 1.0453554219474805
Energy: 1.3425451669238138
Energy: 1.0442739531320753
Energy: 0.8375164192704916
Energy: 1.0442739531320753
Energy: 0.8933810790270384
Energy: 0.8900291754918036
Energy: 0.7698255818893355
Energy: 0.8900291754924122
Energy: 1.3669619857012418
Energy: 0.9300431452413531
Energy: 0.8367149539212314
Energy: 0.9300431452401361
Energy: 1.204699340533426
Energy: 1.044468137664901
Energy: 0.769749248368447
Energy: 1.0444681376642926
Energy: 1.6399303728829524
Energy: 1.0458773556531678
Energy: 0.837343368970595
Energy: 1.0458773556531678
Energy: 1.2625716888191265
Energy: 0.8899217452674965
Energy: 0.7723835608444369
Energy: 0.8899217452674965
Energy: 1.5229805193716999
Energy: 1.0772551405085162
Energy: 0.8369616857590141
Energy: 1.0772551405085162
Energy: 1.2049696566990904
Energy: 1.0445336123145228
Energy: 0.7681231341278569
Energy: 1.0445336123126974
Energy: 1.4843186362963088
Energy: 1.046326014375328
Energy: 0.8374362504442021
Energy: 1.046326014375328
Energy: 0.8932764544940374
Energy: 0.8898570420901603
Energy: 0.982590221093811
Energy: 0.8898570420883349
Energy: 1.1630190116545465
Energy: 0.9254395011399372
Energy: 0.8369154917916597
Energy: 0.9254395011405455
Energy: 0.8360929451514955
Energy: 1.044843345847859
Energy: 0.9800624410901825
Energy: 1.0448433458484674
Energy: 1.1409812679963665
Energy: 1.0447473972850787
Energy: 0.8382748684591759
Energy: 1.04474739728447
Energy: 0.8391773188328213
Energy: 0.8896986876152065
Energy: 0.9969212517106586
Energy: 0.8896986876200467
Energy: 0.7918915876581752
Energy: 1.1109396364719708
Energy: 0.8377394071392787
Energy: 1.1109396364725792
Energy: 0.835530066256239
Energy: 1.0444037733732103
Energy: 1.3496826265943813
Energy: 1.0444037733738187
Energy: 0.769655953522049
Energy: 0.8898142145047053
Energy: 0.8897228000576991
Energy: 0.8898142145065032
Energy: 0.837652743528357
Energy: 0.8896638913404356
Energy: 1.3679961280000306
Energy: 0.8896638913404356

minimum gb energy = 0.7681231341278569 eV
minimum distance =  2.30118390570919 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.020532982712549084
Energy: 0.021389815564824652
Energy: 2.0544705663185354
Energy: 0.021389815565760195
Energy: 1.171936004169536
Energy: 0.4601570193626372
Energy: 0.4594909785232472
Energy: 0.46015701936398856
Energy: 0.020532982712549084
Energy: 0.021389815564824652
Energy: 2.499111263670114
Energy: 0.02138981556617599
Energy: 1.171936004169536
Energy: 0.46015701936216946
Energy: 0.45949097851321613
Energy: 0.46015701936398856
Energy: 0.020532982712549084
Energy: 0.021389815564824652
Energy: 1.1732125992430615
Energy: 0.02138981556617599
Energy: 1.1719360041691205
Energy: 0.4601570193626372
Energy: 0.45949097851456744
Energy: 0.46015701936398856

minimum gb energy = 0.020532982712549084 eV
minimum distance =  2.46573227327912 Angstroms
sigma value = 1