Model name: model_name=MEAM_LAMMPS_ChoiJoSohn_2018_CoNiCrFeMn__MO_115454747503_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450349977833563
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.020522605195718066
Energy: 0.5149113947571056
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5149113947555822
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5149113947571056
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5120357713566901
Energy: 0.02407224472606614
Energy: 0.5124626563540906
Energy: 0.5120357713566901
Energy: 0.024072244727589526
Energy: 0.5124626563540906
Energy: 0.5120357713566901
Energy: 0.024072244727589526
Energy: 0.5124626563540906
Energy: 0.5120357713566901
Energy: 1.070214923410112
Energy: 0.2506152397047516
Energy: 1.0566005659358362
Energy: 1.5645376628080143
Energy: 0.021006251617378624
Energy: 1.0566005659358362
Energy: 1.7859382920906794
Energy: 0.02100625161890201
Energy: 1.0566005659358362
Energy: 1.6198203864148475
Energy: 0.5120357713582135
Energy: 0.5124626563540906
Energy: 0.02407224472606614
Energy: 0.5120357713582135
Energy: 0.5124626563540906
Energy: 0.024072244727589526
Energy: 0.5120357713566901
Energy: 0.5124626563540906
Energy: 0.02407224472606614
Energy: 0.5120357713582135
Energy: 0.020522605195718066
Energy: 0.5149113947571056
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5149113947571056
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5149113947571056
Energy: 0.5149113947571056
Energy: 0.020522605195718066
Energy: 0.5120357713566901
Energy: 0.024072244727589526
Energy: 0.5124626563540906
Energy: 0.5120357713582135
Energy: 0.02407224472606614
Energy: 0.5124626563540906
Energy: 0.5120357713566901
Energy: 0.02407224472606614
Energy: 0.5124626563540906
Energy: 0.5120357713582135
Energy: 1.254777678548128
Energy: 0.02100625161890201
Energy: 0.31156435329856075
Energy: 1.254721804330684
Energy: 0.021006251617378624
Energy: 0.31156435329856075
Energy: 1.2548445282114626
Energy: 0.021006251617378624
Energy: 0.31156435329856075
Energy: 1.2547110181557346

minimum gb energy = 0.020522605195718066 eV
minimum distance =  2.2889263548845 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 1.6720167316231378
Energy: 1.6725701764745289
Energy: 1.388718832819928
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Energy: 1.4173753730378504
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Energy: 1.7480255596546586
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Energy: 1.7480385832729095
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Energy: 1.2764502946662424
Energy: 1.7480255596434642
Energy: 1.769062656597415
Energy: 1.2764502946625107
Energy: 1.6555095298705864
Energy: 1.336916608911322
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Energy: 1.6555095298705864
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Energy: 1.6555095298668547
Energy: 1.4456635749053044
Energy: 1.7197134338182807
Energy: 1.5993323017498995
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Energy: 1.7197134338220121
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Energy: 1.6274083390455891
Energy: 1.4131129048413853
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Energy: 1.4134807743129043
Energy: 1.4441211755324148
Energy: 1.6274083390530523
Energy: 1.4131129048413853
Energy: 1.4441211755324148
Energy: 1.4527523423915412
Energy: 1.6720167316231378
Energy: 1.6725701764745289
Energy: 1.394974916962689
Energy: 1.6720167316231378
Energy: 1.6725701764745289
Energy: 1.4527523423915412
Energy: 1.6720167316231378
Energy: 1.6725701764745289
Energy: 1.394974916962689
Energy: 1.4845323678741527
Energy: 1.4173753730378504
Energy: 1.646089090415781
Energy: 1.484532368635042
Energy: 1.417375373034119
Energy: 1.646089090415781
Energy: 1.4845323679450515
Energy: 1.417375373034119
Energy: 1.6460890904194445
Energy: 1.484532368720867
Energy: 1.610875635942158
Energy: 1.7762680443594416
Energy: 1.7190051994854885
Energy: 1.595801856946604
Energy: 1.7762680443631733
Energy: 1.7190051994854885
Energy: 1.610875635942158
Energy: 1.7762680443594416
Energy: 1.7190051994817572
Energy: 1.5958018569428725
Energy: 1.670033368310894
Energy: 1.6729122180400262
Energy: 1.3367030720064326
Energy: 1.6700333683146256
Energy: 1.6729122180400262
Energy: 1.3367030720064326
Energy: 1.670033368318357
Energy: 1.6729122180400262
Energy: 1.3367030720064326
Energy: 1.670033368318357

minimum gb energy = 1.2761862263961172 eV
minimum distance =  2.22006704123994 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 1.3518702889202112
Energy: 1.3506081025365588
Energy: 1.5402023054416882
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minimum gb energy = 1.3383244157023437 eV
minimum distance =  2.2139656652392 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.660471746621941
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Energy: 1.5925813576563563
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Energy: 1.6525819867276745
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Energy: 1.5952672255781484
Energy: 1.6221338087067363
Energy: 1.6227140339002906
Energy: 1.5952672255802023
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Energy: 1.6227140339002906
Energy: 1.5952672255781484
Energy: 1.6221338087067363
Energy: 1.6227140339023447
Energy: 1.5952672255781484
Energy: 1.5842890415137332
Energy: 1.6450672255494216
Energy: 1.617129312959937
Energy: 1.5842890415137332
Energy: 1.6387447532701955
Energy: 1.6171293129619912
Energy: 1.5842890415137332
Energy: 1.6450672255473673
Energy: 1.6171293129619912
Energy: 1.5842890415157873
Energy: 1.885082244799882
Energy: 1.6445616318717327
Energy: 1.6777310591309507
Energy: 1.8850822448019362
Energy: 1.6445656463581406
Energy: 1.6777310591309507
Energy: 1.8850822448019362
Energy: 1.6445616318717327
Energy: 1.677731059133005
Energy: 1.8850822448019362
Energy: 1.5022814461951797
Energy: 1.6246266382492602
Energy: 1.4975372320094194
Energy: 1.5022814461931258
Energy: 1.6246266382513144
Energy: 1.4975372320094194
Energy: 1.5022814461931258
Energy: 1.6246266382492602
Energy: 1.4975372320094194
Energy: 1.5022814461931258
Energy: 1.6711624714301487
Energy: 1.7643871939403033
Energy: 1.6148531118077551
Energy: 1.6711624714280946
Energy: 1.7638809665143407
Energy: 1.614853111809809
Energy: 1.6711624714301487
Energy: 1.7643871939403033
Energy: 1.614853111809809
Energy: 1.6711624714301487
Energy: 1.6627696026910432
Energy: 1.6776356543705335
Energy: 1.6763247662318252
Energy: 1.6627696026910432
Energy: 1.6830736417265855
Energy: 1.6763247662338794
Energy: 1.6627696026910432
Energy: 1.6776356543684792
Energy: 1.6763247662318252
Energy: 1.6627696026930974
Energy: 1.654164169563438
Energy: 1.5370426761723297
Energy: 1.655088904746598
Energy: 1.654164169563438
Energy: 1.5370465809471037
Energy: 1.655088904746598
Energy: 1.6541641695613836
Energy: 1.5370426761702758
Energy: 1.655088904746598
Energy: 1.654164169563438

minimum gb energy = 1.4597676254054608 eV
minimum distance =  2.18141922470271 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.4816957177221464
Energy: 1.605117525519499
Energy: 1.6034075566873105
Energy: 1.4258990956308872
Energy: 1.605117525519499
Energy: 1.6034075567119923
Energy: 1.4816957177221464
Energy: 1.605117525519499
Energy: 1.6034075566640396
Energy: 1.4258990956308872
Energy: 1.671417651361724
Energy: 1.4234794900482453
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Energy: 1.6714176513603136
Energy: 1.5433252212367654
Energy: 1.6216472871833902
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Energy: 1.7313506897584074
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Energy: 1.5423121561061686
Energy: 1.7042326485810415
Energy: 1.7790813734646247
Energy: 1.4870396305147524
Energy: 1.7042326485789259
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Energy: 1.5423121561047581
Energy: 1.7042326485803363
Energy: 1.779081373461163
Energy: 1.4870396305154574
Energy: 1.5573261270510963
Energy: 1.5364152782718907
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Energy: 1.5364152782711855
Energy: 1.638525665036081
Energy: 1.5573261270518015
Energy: 1.5364152782711855
Energy: 1.7345325639291223
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Energy: 1.7020591933957556
Energy: 1.444595561157985
Energy: 1.702969899697668
Energy: 1.7020591933964606
Energy: 1.44459556115869
Energy: 1.7029698996969627
Energy: 1.7020591933957556
Energy: 1.4445955611572796
Energy: 1.702969899698373
Energy: 1.7020591933950502
Energy: 1.5972358547475154
Energy: 1.434671270459899
Energy: 1.634699454663686
Energy: 1.5972358547475154
Energy: 1.4346712704613092
Energy: 1.6346994546643911
Energy: 1.597235854746105
Energy: 1.4346712704606042
Energy: 1.6346994546643911
Energy: 1.59723585474681
Energy: 1.6078069293618549
Energy: 1.6098039015155345
Energy: 1.423585113200695
Energy: 1.6078069293625599
Energy: 1.6098039015141241
Energy: 1.4235851132021051
Energy: 1.6078069293618549
Energy: 1.6098039015141241
Energy: 1.423585113200695
Energy: 1.6078069293625599
Energy: 1.4258990956294768
Energy: 1.605117525518794
Energy: 1.6034075566908366
Energy: 1.4258990956315922
Energy: 1.605117525518794
Energy: 1.6034075566859003
Energy: 1.4258990956287716
Energy: 1.605117525518794
Energy: 1.6034075566971833
Energy: 1.4258990956315922

minimum gb energy = 1.4234240237315345 eV
minimum distance =  2.28262659022946 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.4502742780252225
Energy: 1.4689124803043883
Energy: 1.4688965057526298
Energy: 1.4502742780252225
Energy: 1.4689124803043883
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Energy: 1.3519330528197926
Energy: 1.4577172044348654
Energy: 1.423963105694002
Energy: 1.3519330528170563
Energy: 1.4577172044348654
Energy: 1.423963105694002
Energy: 1.3519330528197926
Energy: 1.4577172044348654
Energy: 1.423963105694002
Energy: 1.3519330528170563
Energy: 1.4016456590990345
Energy: 1.5101735054206276
Energy: 1.2542197790098666
Energy: 1.4016456590990345
Energy: 1.5101735054206276
Energy: 1.2542197790126024
Energy: 1.4016456590962985
Energy: 1.5101735054178917
Energy: 1.2542197790126024
Energy: 1.4016456590990345
Energy: 1.4638264802448253
Energy: 1.463000868606804
Energy: 1.2553996463249235
Energy: 1.4638264802448253
Energy: 1.4630008686095402
Energy: 1.2553996463249235
Energy: 1.4638264802420893
Energy: 1.4630008686013318
Energy: 1.2553996463221875
Energy: 1.4638264802448253
Energy: 1.2858456387534076
Energy: 1.6230405083796835
Energy: 1.339885402263134
Energy: 1.2858456387561437
Energy: 1.6230405083824198
Energy: 1.339885402263134
Energy: 1.2858456387561437
Energy: 1.6230405083824198
Energy: 1.3398854022603979
Energy: 1.2858456387561437
Energy: 1.3549886532311228
Energy: 1.3168240078504503
Energy: 1.319867933496608
Energy: 1.3549886532283866
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Energy: 1.319867933496608
Energy: 1.3549886532283866
Energy: 1.3168240078531859
Energy: 1.3198679334993442
Energy: 1.3549886532283866
Energy: 1.404826049634772
Energy: 1.5125674675984193
Energy: 1.3947462043705006
Energy: 1.404826049634772
Energy: 1.5125674675984193
Energy: 1.3947462043705006
Energy: 1.404826049634772
Energy: 1.5125674675984193
Energy: 1.3947462043705006
Energy: 1.404826049634772
Energy: 1.5900174165156145
Energy: 1.4601181479952112
Energy: 1.3600796142111344
Energy: 1.5900174165156145
Energy: 1.4601181479952112
Energy: 1.3600796142083984
Energy: 1.5900174165156145
Energy: 1.4601181479952112
Energy: 1.3600796142111344
Energy: 1.5900174165156145
Energy: 1.4712553079778474
Energy: 1.344116670654287
Energy: 1.4513568440044537
Energy: 1.4712553079778474
Energy: 1.3441165668963606
Energy: 1.4513568440044537
Energy: 1.4712553079778474
Energy: 1.3441163730902952
Energy: 1.4513568440044537
Energy: 1.4712553079778474
Energy: 1.2560491696827474
Energy: 1.6233026352568842
Energy: 1.3737892700650955
Energy: 1.2560491696827474
Energy: 1.6233026352568842
Energy: 1.3737892700650955
Energy: 1.2560491696827474
Energy: 1.6233026352568842
Energy: 1.3737892700650955
Energy: 1.2560491696827474
Energy: 1.2865961329681568
Energy: 1.2747923893161899
Energy: 1.2744143747602343
Energy: 1.286596132965421
Energy: 1.2747923893161899
Energy: 1.2744143747602343
Energy: 1.2865961329681568
Energy: 1.2747923893161899
Energy: 1.2744143747602343
Energy: 1.286596132965421
Energy: 1.2752191522361804
Energy: 1.2830785328127732
Energy: 1.320054941492854
Energy: 1.2752191522443888
Energy: 1.2830785328127732
Energy: 1.32005494149559
Energy: 1.2752191522389167
Energy: 1.2830785328127732
Energy: 1.320054941492854
Energy: 1.275219152249861
Energy: 1.65490555816657
Energy: 1.2809757531828652
Energy: 1.377650907734009
Energy: 1.65490555816657
Energy: 1.2809757531828652
Energy: 1.377650907736745
Energy: 1.65490555816657
Energy: 1.2809757531801291
Energy: 1.377650907734009
Energy: 1.65490555816657
Energy: 1.4649272142670096
Energy: 1.4225704144657911
Energy: 1.2581300250670828
Energy: 1.4649272139989733
Energy: 1.4225704144657911
Energy: 1.2581300250670828
Energy: 1.4649272138239637
Energy: 1.4225704144657911
Energy: 1.2581300250670828
Energy: 1.4649272142396486

minimum gb energy = 1.2541670423217144 eV
minimum distance =  2.21795602231091 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 1.1501994439616126
Energy: 0.6938279574510687
Energy: 0.6940652898233383
Energy: 0.8483250126794565
Energy: 0.6938279574526632
Energy: 0.6940652898233383
Energy: 1.1501994439616126
Energy: 0.6938279574543167
Energy: 0.694065289822984
Energy: 0.8483250126794565
Energy: 1.0322402562944744
Energy: 0.682116673208226
Energy: 0.9138031223601102
Energy: 0.9652666787237613
Energy: 0.6821166732075764
Energy: 1.026196775704371
Energy: 1.0322402562964232
Energy: 0.6821166732101746
Energy: 0.913803122361114
Energy: 0.9652666787221668
Energy: 0.8431753357762991
Energy: 0.7244196521907952
Energy: 0.9141500924367983
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Energy: 0.8453509503191264
Energy: 0.8431753357782478
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Energy: 0.9436382457906904
Energy: 1.096943002017856
Energy: 0.6947054359231356
Energy: 0.9113824637807545
Energy: 1.096943002019805
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Energy: 0.9149977962218807
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Energy: 1.0969430020185058
Energy: 0.694329110486455
Energy: 0.7241940473839341
Energy: 0.7922399465544898
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Energy: 0.7241940473852334
Energy: 0.7905320146651004
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Energy: 0.7241940473803911
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Energy: 0.6943291104874588
Energy: 1.0192088943890645
Energy: 1.0105870323605668
Energy: 0.9590220620801361
Energy: 1.0192088943864661
Energy: 1.1285736300594036
Energy: 0.9248537015607737
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Energy: 1.010587032362811
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Energy: 1.0192088943884148
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Energy: 1.1168454922606519
Energy: 0.6941330949788317
Energy: 1.0163036518470707
Energy: 0.8995148568113156
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Energy: 1.0163036518477204
Energy: 0.900609794537517
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Energy: 1.0163036518470707
Energy: 0.8995148568080678
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Energy: 1.0163036518467754
Energy: 0.7679968115313032
Energy: 0.9560019973292252
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Energy: 0.9660118049432431
Energy: 0.8880171452947635
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Energy: 0.7679968115336061
Energy: 0.9560019973289299
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Energy: 0.9660118049448967
Energy: 0.8460722811631095
Energy: 0.8407173638345172
Energy: 0.6822386145497571
Energy: 0.7439037304868956
Energy: 0.7452035352564208
Energy: 0.6822386145465094
Energy: 0.8460722811634047
Energy: 0.840717363834163
Energy: 0.6822386145455054
Energy: 0.7439037304846517
Energy: 0.896177749276335
Energy: 1.1168508568796052
Energy: 0.7244660834355942
Energy: 0.8993006859575459
Energy: 1.1168508568802546
Energy: 0.7244660834359485
Energy: 0.8961777492766893
Energy: 1.1168508568796052
Energy: 0.7244660834327006
Energy: 0.8993006859579001
Energy: 0.6396575304983223
Energy: 0.6938279574523679
Energy: 0.6940652898233383
Energy: 0.7448199425310069
Energy: 0.6938279574526632
Energy: 0.694065289822039
Energy: 0.6396575304924762
Energy: 0.6938279574526632
Energy: 0.6940652898226886
Energy: 0.7448199425310069
Energy: 0.898531035464431
Energy: 0.6821166732085211
Energy: 1.1295122000668156
Energy: 0.896319677689391
Energy: 0.682116673207222
Energy: 1.0629489128116558
Energy: 0.8985310354634863
Energy: 0.6821166732088755
Energy: 1.1295122000658118
Energy: 0.8963196776916941
Energy: 0.8461797041028386
Energy: 0.7244196521907952
Energy: 0.7447425130448431
Energy: 0.7439733291762477
Energy: 0.7244196521907952
Energy: 0.8466958160022897
Energy: 0.8461797041002403
Energy: 0.7244196521898504
Energy: 0.7447425130461423
Energy: 0.7439733291732951
Energy: 1.0969430020185058
Energy: 0.6947054359218364
Energy: 0.9123005568432594
Energy: 1.0969430020194504
Energy: 0.6947054359221908
Energy: 0.9110612594465909
Energy: 1.096943002017856
Energy: 0.6947054359221908
Energy: 0.9123005568426098
Energy: 1.0969430020182103
Energy: 0.6943291104861596
Energy: 0.7241940473823397
Energy: 0.9006486373860857
Energy: 0.6943291104851558
Energy: 0.7241940473836389
Energy: 0.899776670466949
Energy: 0.6943291104858054
Energy: 0.7241940473803911
Energy: 0.9006486373870306
Energy: 0.6943291104868092
Energy: 1.0192088943890645
Energy: 0.9904588288618826
Energy: 0.9221366745078897
Energy: 1.0192088943877653
Energy: 1.011675029790958
Energy: 1.0313847831578642
Energy: 1.0192088943858166
Energy: 0.9904588288625323
Energy: 0.9221366745088937
Energy: 1.0192088943907178
Energy: 0.6941330949785364
Energy: 0.9111654107820794
Energy: 1.116845492259648
Energy: 0.6941330949801308
Energy: 0.8702312809483785
Energy: 1.1168454922609472
Energy: 0.6941330949781821
Energy: 0.9111654107823747
Energy: 1.1168454922606519
Energy: 0.6941330949778868
Energy: 1.0163036518477204
Energy: 0.7904541572708506
Energy: 0.7245710381794188
Energy: 1.0163036518493738
Energy: 0.7922376055034424
Energy: 0.7245710381804228
Energy: 1.016303651847425
Energy: 0.7904541572676027
Energy: 0.7245710381791237
Energy: 1.0163036518457715
Energy: 0.8959855760872748
Energy: 0.926352272091305
Energy: 0.6941215475168354
Energy: 0.8698769072064887
Energy: 0.9250093569788431
Energy: 0.6941215475158906
Energy: 0.8959855760836726
Energy: 0.9263522720948482
Energy: 0.6941215475116388
Energy: 0.8698769072048351
Energy: 0.8430807363880394
Energy: 0.8473051552022768
Energy: 0.6822386145497571
Energy: 0.9436289700280338
Energy: 0.9138668625848113
Energy: 0.6822386145478085
Energy: 0.8430807363909328
Energy: 0.8473051552009776
Energy: 0.6822386145455054
Energy: 0.9436289700283882
Energy: 1.031804891247365
Energy: 1.1168508568809044
Energy: 0.724466083435299
Energy: 0.9903140687750257
Energy: 1.1168508568799003
Energy: 0.7244660834349446
Energy: 1.0318048912493136
Energy: 1.1168508568799003
Energy: 0.7244660834333502
Energy: 0.9903140687750257
Energy: 1.1501994439619079
Energy: 0.6938279574517183
Energy: 0.6940652898242831
Energy: 0.8483250126794565
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Energy: 0.6940652898223344
Energy: 1.1501994439616126
Energy: 0.6938279574536671
Energy: 0.694065289822039
Energy: 0.8483250126794565
Energy: 1.032240256295124
Energy: 0.6821166732088755
Energy: 0.9138031223601102
Energy: 0.9652666787208677
Energy: 0.6821166732069268
Energy: 1.0261967757027766
Energy: 1.0322402562957735
Energy: 0.6821166732091707
Energy: 0.9138031223617636
Energy: 0.9652666787228164
Energy: 0.8431753357766534
Energy: 0.7244196521911495
Energy: 0.9141500924364441
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Energy: 0.8453509503174729
Energy: 0.8431753357786022
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Energy: 0.9436382457903363
Energy: 1.0969430020185058
Energy: 0.6947054359221908
Energy: 0.911382463781404
Energy: 1.09694300201886
Energy: 0.6947054359228403
Energy: 0.9149977962218807
Energy: 1.09694300201886
Energy: 0.694705435922486
Energy: 0.911382463781404
Energy: 1.096943002019805
Energy: 0.6943291104858054
Energy: 0.7241940473829893
Energy: 0.7922399465544898
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Energy: 0.7241940473842885
Energy: 0.7905320146638012
Energy: 0.6943291104861596
Energy: 0.7241940473810407
Energy: 0.7922399465561432
Energy: 0.6943291104874588
Energy: 1.0192088943884148
Energy: 1.010587032361866
Energy: 0.9590220620824389
Energy: 1.0192088943877653
Energy: 1.128573630059699
Energy: 0.9248537015604194
Energy: 1.0192088943858166
Energy: 1.010587032362811
Energy: 0.959022062081435
Energy: 1.019208894389714
Energy: 0.6941330949765877
Energy: 0.9090243593709713
Energy: 1.1168454922580535
Energy: 0.6941330949801308
Energy: 0.9482134504044214
Energy: 1.1168454922606519
Energy: 0.6941330949762333
Energy: 0.9090243593696721
Energy: 1.1168454922602977
Energy: 0.6941330949772372
Energy: 1.0163036518477204
Energy: 0.8995148568113156
Energy: 0.7245710381794188
Energy: 1.0163036518464212
Energy: 0.9006097945381666
Energy: 0.7245710381804228
Energy: 1.0163036518457715
Energy: 0.8995148568090716
Energy: 0.7245710381778244
Energy: 1.0163036518457715
Energy: 0.767996811531008
Energy: 0.9560019973282803
Energy: 0.694121547517485
Energy: 0.966011804945192
Energy: 0.8880171452944683
Energy: 0.6941215475168354
Energy: 0.7679968115342557
Energy: 0.9560019973285756
Energy: 0.6941215475135875
Energy: 0.9660118049438927
Energy: 0.8460722811647039
Energy: 0.8407173638351668
Energy: 0.6822386145497571
Energy: 0.7439037304875452
Energy: 0.7452035352570703
Energy: 0.6822386145474542
Energy: 0.8460722811624599
Energy: 0.8407173638354621
Energy: 0.6822386145452102
Energy: 0.7439037304859509
Energy: 0.8961777492769846
Energy: 1.1168508568822033
Energy: 0.724466083434295
Energy: 0.8993006859585497
Energy: 1.1168508568796052
Energy: 0.7244660834346494
Energy: 0.8961777492769846
Energy: 1.1168508568779516
Energy: 0.7244660834327006
Energy: 0.8993006859572505

minimum gb energy = 0.6396575304924762 eV
minimum distance =  2.34851244989048 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.2445478644457741
Energy: 1.3581677564941692
Energy: 1.3584155246803462
Energy: 1.1951256828848378
Energy: 1.3581677564941692
Energy: 1.3584155246821292
Energy: 1.2445478644439911
Energy: 1.3581677564959522
Energy: 1.3584155246821292
Energy: 1.1951256828848378
Energy: 1.378103475045246
Energy: 1.2076637007255053
Energy: 1.315583445660222
Energy: 1.378103475043463
Energy: 1.2076637007237223
Energy: 1.315583445660222
Energy: 1.378103475043463
Energy: 1.2076637007272883
Energy: 1.315583445660222
Energy: 1.378103475043463
Energy: 1.2762963730219714
Energy: 1.1375199134851743
Energy: 1.2367662405689397
Energy: 1.2772133917110893
Energy: 1.1375199134851743
Energy: 1.2367662405671567
Energy: 1.2762963730219714
Energy: 1.1375199134833913
Energy: 1.2367662405689397
Energy: 1.2772133917146553
Energy: 1.475227201165847
Energy: 1.208398975254912
Energy: 1.4642398776526828
Energy: 1.475227201165847
Energy: 1.208398975254912
Energy: 1.4642398776544658
Energy: 1.475227201165847
Energy: 1.208398975256695
Energy: 1.4642398776562489
Energy: 1.47522720116763
Energy: 1.4168446535499677
Energy: 1.3055754114055147
Energy: 1.184790095102617
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Energy: 1.184790095102617
Energy: 1.4168446535499677
Energy: 1.3055754114055147
Energy: 1.184790095102617
Energy: 1.4168446535481847
Energy: 1.325532242321147
Energy: 1.3736924529833778
Energy: 1.376032471048301
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Energy: 1.376032471048301
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Energy: 1.197982495974468
Energy: 1.3242791311418376
Energy: 1.3829156253851809
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Energy: 1.1979733403794623
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Energy: 1.2713240710015234
Energy: 1.321920280589933
Energy: 1.1764741369077434
Energy: 1.3452301615673081
Energy: 1.3219202805881503
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Energy: 1.321920280589933
Energy: 1.1764741369059604
Energy: 1.345230161565525
Energy: 1.321920280591716
Energy: 1.3359005468067655
Energy: 1.2063891059240306
Energy: 1.4831241395219668
Energy: 1.3359005468085483
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Energy: 1.4831241395201837
Energy: 1.3359005468085483
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Energy: 1.4831241395219668
Energy: 1.3359005468085483
Energy: 1.3548894060032173
Energy: 1.394475621119533
Energy: 1.2393110108710956
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Energy: 1.394475621121316
Energy: 1.2392743790578806
Energy: 1.3548894060032173
Energy: 1.394475621121316
Energy: 1.2393110108746617
Energy: 1.3548894060014343
Energy: 1.2080496828788396
Energy: 1.3987206111404067
Energy: 1.468946858744595
Energy: 1.2080496828788396
Energy: 1.3979300757250015
Energy: 1.4665801093954138
Energy: 1.2080496828788396
Energy: 1.3987206111404067
Energy: 1.468946858746378
Energy: 1.2080496828770566
Energy: 1.200440064159539
Energy: 1.2365644439914383
Energy: 1.236480696905488
Energy: 1.200440064161322
Energy: 1.2361851155751098
Energy: 1.2363191435271297
Energy: 1.200440064161322
Energy: 1.2365644439914383
Energy: 1.2364806969037052
Energy: 1.200440064161322
Energy: 1.20789768151423
Energy: 1.357412097419767
Energy: 1.2898763940425095
Energy: 1.2078976815160127
Energy: 1.3415466132625447
Energy: 1.2898763940442926
Energy: 1.2078976815177958
Energy: 1.357412097423333
Energy: 1.2898763940442926
Energy: 1.20789768151423
Energy: 1.3608875580015125
Energy: 1.2212257036792307
Energy: 1.3415539826109444
Energy: 1.3608875580015125
Energy: 1.1964405122970736
Energy: 1.3415539826109444
Energy: 1.3608875580068613
Energy: 1.2212257036792307
Energy: 1.3415539826091614
Energy: 1.3608875580032953
Energy: 1.3525365671351888
Energy: 1.3753641011570488
Energy: 1.2073817927125656
Energy: 1.3525365671351888
Energy: 1.3753641011588318
Energy: 1.2073817927125656
Energy: 1.3525365671351888
Energy: 1.3753641011606148
Energy: 1.2073817927107828
Energy: 1.352536567131623
Energy: 1.3233605006567826
Energy: 1.3850749345975637
Energy: 1.2412215324427194
Energy: 1.3233605006549998
Energy: 1.3850749345975637
Energy: 1.2412215324409366
Energy: 1.3233605006567826
Energy: 1.3850749345957807
Energy: 1.2412215324427194
Energy: 1.3233605006567826
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Energy: 1.3530489329435964
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Energy: 1.3718249606873796
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Energy: 1.277462771564958
Energy: 1.3573970168963219
Energy: 1.1845709255514225

minimum gb energy = 1.1375199134833913 eV
minimum distance =  2.21022209564658 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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Energy: 1.6949785156090775
Energy: 1.7090662178698655
Energy: 1.3987103603214721
Energy: 1.6949785156078976
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Energy: 1.6949785156090775
Energy: 1.7090662178698655
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Energy: 1.7381946124212673
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Energy: 1.6810007921583752
Energy: 1.7381946124212673
Energy: 1.6070050365592685
Energy: 1.6810007921583752
Energy: 1.7381946124212673

minimum gb energy = 1.3882786450100773 eV
minimum distance =  2.26039457150079 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: 1.758300696347432
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minimum gb energy = 1.581672826597595 eV
minimum distance =  2.20629193858575 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.5985770176106238
Energy: 1.5770965165998256
Energy: 1.588018166629796
Energy: 1.5985770176106238
Energy: 1.5770965165998256
Energy: 1.6780924975004714
Energy: 1.7203464354609805
Energy: 1.6366903952202734
Energy: 1.6627524455868599
Energy: 1.7203464354609805
Energy: 1.6366903952202734
Energy: 1.6780924975031368
Energy: 1.7203464354609805
Energy: 1.6366903952202734
Energy: 1.6627524455841942
Energy: 1.631347840383586
Energy: 1.9402625934315958
Energy: 1.908763790282034
Energy: 1.6209882211604576
Energy: 1.9402625934315958
Energy: 1.908763790282034
Energy: 1.6313478403782555
Energy: 1.940262593434261
Energy: 1.9087637902793682
Energy: 1.6209882211604576
Energy: 1.672568308550555
Energy: 1.6342422462865567
Energy: 1.6863583798353854
Energy: 1.672568308550555
Energy: 1.6342422462865567
Energy: 1.6863583798380506
Energy: 1.672568308550555
Energy: 1.6342422462865567
Energy: 1.6863583798353854
Energy: 1.6725683085532204
Energy: 1.5854317045107753
Energy: 1.6071830755414918
Energy: 1.5897617693039823
Energy: 1.5854317045107753
Energy: 1.6071093412284816
Energy: 1.5897617693066477
Energy: 1.5854317045134405
Energy: 1.6071830755414918
Energy: 1.589761769309313
Energy: 1.5854317045107753
Energy: 1.6819873301289938
Energy: 1.5996529230564736
Energy: 1.9283548004575752
Energy: 1.6819873301289938
Energy: 1.5997292008911421
Energy: 1.9283548004575752
Energy: 1.6819873301289938
Energy: 1.5996529230538081
Energy: 1.9283548004575752
Energy: 1.6819873301289938
Energy: 1.7736957226917505
Energy: 1.6058154003672287
Energy: 1.7003891369079351
Energy: 1.7736957226917505
Energy: 1.6058154003698941
Energy: 1.7003891369079351
Energy: 1.7736957226917505
Energy: 1.6058154003672287
Energy: 1.7003891369079351
Energy: 1.7736957226917505
Energy: 1.7009507190548663
Energy: 1.709419591976017
Energy: 1.6589598299643546
Energy: 1.7009507190575317
Energy: 1.709419591976017
Energy: 1.6589167921003616
Energy: 1.7009507190575317
Energy: 1.709419591976017
Energy: 1.6589598299616892
Energy: 1.7009507190548663
Energy: 1.6292090321908055
Energy: 1.600223650727264
Energy: 1.635806278099428
Energy: 1.6292090321908055
Energy: 1.600223650727264
Energy: 1.6358062780967628
Energy: 1.629209032193471
Energy: 1.6002236507245986
Energy: 1.6358062780967628
Energy: 1.629209032193471
Energy: 1.7060784481869948
Energy: 1.5756945601147376
Energy: 1.575299047859741
Energy: 1.7060784481896598
Energy: 1.5756945601147376
Energy: 1.575299047859741
Energy: 1.7060784481923252
Energy: 1.5756945601147376
Energy: 1.575299047862406
Energy: 1.7060784481896598
Energy: 1.6343674349010289
Energy: 1.6611365771445568
Energy: 1.6141197086470989
Energy: 1.6343674349010289
Energy: 1.6611365771445568
Energy: 1.6141197086444334
Energy: 1.6343674349010289
Energy: 1.6611365771472217
Energy: 1.614119708649764
Energy: 1.6343674349036938
Energy: 1.5711515203662
Energy: 1.6637897937543735
Energy: 1.708598262633146
Energy: 1.571151520363535
Energy: 1.6637897937543735
Energy: 1.708598262633146
Energy: 1.571151520363535
Energy: 1.663789793757039
Energy: 1.708598262633146
Energy: 1.571151520363535
Energy: 1.7864200481463661
Energy: 1.6538994332177985
Energy: 1.5986339264100005
Energy: 1.7864200481490313
Energy: 1.6538994332151329
Energy: 1.5985127099876646
Energy: 1.7864200481490313
Energy: 1.6538994332177985
Energy: 1.5986339264100005
Energy: 1.7864200481490313
Energy: 1.6800694014594182
Energy: 1.8840341651229708
Energy: 1.6060572930409194
Energy: 1.6800694014594182
Energy: 1.8840341651229708
Energy: 1.6060572930382542
Energy: 1.6800694014594182
Energy: 1.8840341651229708
Energy: 1.6060572930382542
Energy: 1.6800694014620836

minimum gb energy = 1.571151520363535 eV
minimum distance =  2.20763602620484 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.4839504651174442
Energy: 1.4845716886695073
Energy: 1.4845151570233417
Energy: 1.4839504651174442
Energy: 1.4845716886685438
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4845716886690257
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576494069
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576479618
Energy: 1.4821576091316444
Energy: 1.484418716589903
Energy: 1.4845999576489253
Energy: 1.4821576091321262
Energy: 1.4814036879569397
Energy: 1.4816383660490067
Energy: 1.7330180962351673
Energy: 1.4814036879579031
Energy: 1.4816383660494885
Energy: 1.7330180951233203
Energy: 1.4814036879579031
Energy: 1.4816383660490067
Energy: 1.7330180945917466
Energy: 1.4814036879574215
Energy: 1.7329850348774547
Energy: 1.481533484572144
Energy: 1.481411104276683
Energy: 1.732985034261095
Energy: 1.4815334845726256
Energy: 1.481411104277165
Energy: 1.7329850348360254
Energy: 1.481533484572144
Energy: 1.481411104277165
Energy: 1.732985033823416
Energy: 1.484706071284483
Energy: 1.4844583970320984
Energy: 1.4820789499878713
Energy: 1.4847060712840012
Energy: 1.4844583970316165
Energy: 1.4820789499873896
Energy: 1.484706071284483
Energy: 1.4844583970311347
Energy: 1.482078949986908
Energy: 1.4847060712840012
Energy: 1.4845716886695073
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4845716886690257
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4845716886685438
Energy: 1.4845151570223782
Energy: 1.4839504651169624
Energy: 1.4845716886690257
Energy: 1.4844187165889395
Energy: 1.4845999576484434
Energy: 1.4821576091316444
Energy: 1.4844187165894211
Energy: 1.4845999576494069
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576489253
Energy: 1.4821576091316444
Energy: 1.4844187165894211
Energy: 1.4816383660490067
Energy: 1.7330180941694389
Energy: 1.4814036879574215
Energy: 1.4816383660490067
Energy: 1.7330180943057265
Energy: 1.4814036879574215
Energy: 1.481638366048525
Energy: 1.733018093653237
Energy: 1.4814036879574215
Energy: 1.4816383660490067
Energy: 1.481533484572144
Energy: 1.4814111042762015
Energy: 1.732985036452513
Energy: 1.4815334845716621
Energy: 1.481411104277165
Energy: 1.732985035635357
Energy: 1.481533484572144
Energy: 1.481411104276683
Energy: 1.7329850357105079
Energy: 1.4815334845716621
Energy: 1.4844583970316165
Energy: 1.4820789499878713
Energy: 1.4847060712835196
Energy: 1.4844583970311347
Energy: 1.4820789499873896
Energy: 1.4847060712835196
Energy: 1.4844583970316165
Energy: 1.4820789499878713
Energy: 1.484706071284483
Energy: 1.4844583970316165
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4845716886685438
Energy: 1.4845151570233417
Energy: 1.4839504651169624
Energy: 1.4845716886685438
Energy: 1.48451515702286
Energy: 1.4839504651174442
Energy: 1.4845716886699891
Energy: 1.4845151570233417
Energy: 1.4845999576484434
Energy: 1.482157609132608
Energy: 1.4844187165889395
Energy: 1.4845999576484434
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576494069
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576498887
Energy: 1.733018094074581
Energy: 1.4814036879574215
Energy: 1.4816383660490067
Energy: 1.7330180950539942
Energy: 1.4814036879569397
Energy: 1.4816383660490067
Energy: 1.733018093467856
Energy: 1.4814036879574215
Energy: 1.4816383660490067
Energy: 1.7330180936686523
Energy: 1.4814111042776466
Energy: 1.7329850363648809
Energy: 1.481533484572144
Energy: 1.481411104277165
Energy: 1.7329850373712716
Energy: 1.4815334845716621
Energy: 1.4814111042776466
Energy: 1.7329850427840585
Energy: 1.4815334845726256
Energy: 1.4814111042762015
Energy: 1.482078949986908
Energy: 1.4847060712840012
Energy: 1.4844583970316165
Energy: 1.4820789499873896
Energy: 1.484706071284483
Energy: 1.4844583970316165
Energy: 1.4820789499878713
Energy: 1.4847060712835196
Energy: 1.4844583970311347
Energy: 1.4820789499878713
Energy: 1.4839504651169624
Energy: 1.4845716886675804
Energy: 1.4845151570223782
Energy: 1.4839504651174442
Energy: 1.4845716886690257
Energy: 1.4845151570233417
Energy: 1.4839504651174442
Energy: 1.4845716886690257
Energy: 1.4845151570238235
Energy: 1.4839504651174442
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576498887
Energy: 1.482157609132608
Energy: 1.4844187165889395
Energy: 1.4845999576498887
Energy: 1.4821576091316444
Energy: 1.4844187165894211
Energy: 1.4845999576489253
Energy: 1.4821576091321262
Energy: 1.4814036879569397
Energy: 1.481638366048525
Energy: 1.733018093893054
Energy: 1.4814036879569397
Energy: 1.4816383660490067
Energy: 1.733018093748095
Energy: 1.4814036879569397
Energy: 1.4816383660490067
Energy: 1.733018094033677
Energy: 1.4814036879574215
Energy: 1.7329850380767085
Energy: 1.4815334845716621
Energy: 1.4814111042776466
Energy: 1.7329850390922081
Energy: 1.4815334845726256
Energy: 1.481411104276683
Energy: 1.7329850380294982
Energy: 1.4815334845716621
Energy: 1.481411104277165
Energy: 1.7329850375157048
Energy: 1.4847060712840012
Energy: 1.4844583970320984
Energy: 1.4820789499878713
Energy: 1.4847060712830378
Energy: 1.4844583970316165
Energy: 1.4820789499873896
Energy: 1.484706071284483
Energy: 1.4844583970316165
Energy: 1.4820789499878713
Energy: 1.484706071284483
Energy: 1.4845716886690257
Energy: 1.4845151570233417
Energy: 1.4839504651174442
Energy: 1.4845716886690257
Energy: 1.48451515702286
Energy: 1.4839504651174442
Energy: 1.4845716886685438
Energy: 1.48451515702286
Energy: 1.4839504651174442
Energy: 1.4845716886675804
Energy: 1.4844187165889395
Energy: 1.4845999576484434
Energy: 1.4821576091321262
Energy: 1.4844187165894211
Energy: 1.4845999576498887
Energy: 1.482157609132608
Energy: 1.4844187165894211
Energy: 1.4845999576484434
Energy: 1.4821576091321262
Energy: 1.484418716589903

minimum gb energy = 1.4814036879569397 eV
minimum distance =  2.29077540358451 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.597423344320116
Energy: 1.7012368207995923
Energy: 1.654013238435091
Energy: 1.5567240812789036
Energy: 1.7012368207974087
Energy: 1.6540132380313046
Energy: 1.5974233443244834
Energy: 1.7012368208039599
Energy: 1.6540132385092972
Energy: 1.5567240812789036
Energy: 1.566049822087615
Energy: 1.6262346168559652
Energy: 1.7301835309243843
Energy: 1.566049822085431
Energy: 1.6262346168581487
Energy: 1.7301835309243843
Energy: 1.566049822085431
Energy: 1.6262346168559652
Energy: 1.7301835309265678
Energy: 1.566049822087615
Energy: 1.7197352198585847
Energy: 1.581447970523696
Energy: 1.7925032066349211
Energy: 1.7197352198607683
Energy: 1.5814479705149609
Energy: 1.7925032066458395
Energy: 1.7197352198585847
Energy: 1.5814479705171445
Energy: 1.7925032066371047
Energy: 1.719735219862952
Energy: 1.539074912876207
Energy: 1.5824053002660516
Energy: 1.5399124981879666
Energy: 1.5390749128718395
Energy: 1.5824053002682352
Energy: 1.5399124981857828
Energy: 1.539074912876207
Energy: 1.5824053002682352
Energy: 1.5399124981857828
Energy: 1.5390749128740233
Energy: 1.7521145287961502
Energy: 1.5760020042328027
Energy: 1.6878329985306275
Energy: 1.7521145287961502
Energy: 1.5760020042349865
Energy: 1.6878329985306275
Energy: 1.7521145287983342
Energy: 1.5760020042393539
Energy: 1.6878329985306275
Energy: 1.7521145287983342
Energy: 1.6260050372414678
Energy: 1.7768788437348186
Energy: 1.5429000704633786
Energy: 1.6260050372392842
Energy: 1.7768788437348186
Energy: 1.5429000704633786
Energy: 1.6260050372414678
Energy: 1.7768788437348186
Energy: 1.542900070461195
Energy: 1.626005037248019
Energy: 1.582480681128485
Energy: 1.6945921701497482
Energy: 1.6157394571851447
Energy: 1.5827973338893477
Energy: 1.6945921701453808
Energy: 1.6157394571873283
Energy: 1.5824806811263015
Energy: 1.6945921701497482
Energy: 1.6157394571851447
Energy: 1.582797333887164
Energy: 1.5828479529513855
Energy: 1.7665955419633865
Energy: 1.7836228000278502
Energy: 1.582847952955753
Energy: 1.7665955419633865
Energy: 1.7836228000278502
Energy: 1.5828479529513855
Energy: 1.7665955419655706
Energy: 1.783622800030034
Energy: 1.5828479529513855
Energy: 1.806147439167821
Energy: 1.578132356793099
Energy: 1.5769411340093147
Energy: 1.806147439165637
Energy: 1.5574503578548533
Energy: 1.5563398992117363
Energy: 1.806147439165637
Energy: 1.5781323567952825
Energy: 1.5769411340136823
Energy: 1.8061474391634533
Energy: 1.577869895252224
Energy: 1.7205472247279479
Energy: 1.7654681244606747
Energy: 1.5779875092657558
Energy: 1.720547224677762
Energy: 1.7799140556201567
Energy: 1.5778698952500403
Energy: 1.7205472247127014
Energy: 1.765468124458491
Energy: 1.5779875092679394
Energy: 1.6127792473235205
Energy: 1.5727524395250418
Energy: 1.6527056066779968
Energy: 1.6127792473278482
Energy: 1.5727524395250418
Energy: 1.6527056066779968
Energy: 1.6127792473235205
Energy: 1.5727524395250418
Energy: 1.6527056066801806
Energy: 1.6127792473213367
Energy: 1.66747999740249
Energy: 1.5430068360482443
Energy: 1.7333432666210407
Energy: 1.6674799974003065
Energy: 1.5430006216180967
Energy: 1.7333432666210407
Energy: 1.66747999740249
Energy: 1.5430068360482443
Energy: 1.7333432666210407
Energy: 1.66747999740249
Energy: 1.8654865516447607
Energy: 1.5389090194195585
Energy: 1.6936489668459334
Energy: 1.8654865516469443
Energy: 1.538909019421742
Energy: 1.6936489668437498
Energy: 1.865486551642577
Energy: 1.5389090194239257
Energy: 1.693648966841566
Energy: 1.8654865516403933
Energy: 1.5478392260450238
Energy: 1.5448556907579762
Energy: 1.9769037462599157
Energy: 1.54783922604284
Energy: 1.5448556907623439
Energy: 1.9769037462599157
Energy: 1.54783922604284
Energy: 1.5448556907623439
Energy: 1.9769037462599157
Energy: 1.54783922604284
Energy: 1.6738402259146241
Energy: 1.8301081921763647
Energy: 1.5620507348401123
Energy: 1.6738402259102565
Energy: 1.8301081921763647
Energy: 1.5620482261445467
Energy: 1.6738402259124403
Energy: 1.8301081921719975
Energy: 1.5620507348379287
Energy: 1.6738402259124403
Energy: 1.5577762991515043
Energy: 1.7815210598755367
Energy: 1.7217676142343583
Energy: 1.5577762991558717
Energy: 1.7815210598711693
Energy: 1.721767614118662
Energy: 1.5577762991558717
Energy: 1.7815210598689857
Energy: 1.7217676140291698
Energy: 1.557776299153688
Energy: 1.5669704044909807
Energy: 1.789917968876468
Energy: 1.7442623451926986
Energy: 1.5669704044909807
Energy: 1.789917968876468
Energy: 1.7442623451970662
Energy: 1.5669704044909807
Energy: 1.7899179688742846
Energy: 1.7442623451948824
Energy: 1.5669704044909807
Energy: 1.7887190815974574
Energy: 1.626369107490942
Energy: 1.5441298890435757
Energy: 1.7887190815952736
Energy: 1.6263691074931261
Energy: 1.5441298890392083
Energy: 1.7887190815952736
Energy: 1.6263691074931261
Energy: 1.5441298890457595
Energy: 1.7887190815952736
Energy: 1.5692188400498164
Energy: 1.7320864035289674
Energy: 1.7058986181409759
Energy: 1.569218840054184
Energy: 1.732086403531151
Energy: 1.7058986181409759
Energy: 1.569218840054184
Energy: 1.7320864035333345
Energy: 1.7058986181431597
Energy: 1.5692188400476328
Energy: 1.6932266199352468
Energy: 1.5616402023752223
Energy: 1.6182375576435528
Energy: 1.6932266199352468
Energy: 1.5616402023774063
Energy: 1.61823755764792
Energy: 1.6932266199308794
Energy: 1.5616402023774063
Energy: 1.61823755764792
Energy: 1.6932266199330632
Energy: 1.6271919539352033
Energy: 1.5780237590587378
Energy: 1.7223739243855687
Energy: 1.6271919539352033
Energy: 1.5780237590565542
Energy: 1.7223739243855687
Energy: 1.6271919539330195
Energy: 1.5780237590565542
Energy: 1.722373924383385
Energy: 1.6271919539352033
Energy: 1.7419644898191606
Energy: 1.9921235560513118
Energy: 1.54501289360948
Energy: 1.7419644898191606
Energy: 1.992123556049128
Energy: 1.54501289360948
Energy: 1.741964489816977
Energy: 1.9921235560513118
Energy: 1.5450128936116636
Energy: 1.741964489816977
Energy: 1.5806701375940693
Energy: 1.5818299874378052
Energy: 1.6174918570551093
Energy: 1.580037709452324
Energy: 1.5828841803153628
Energy: 1.617491857057293
Energy: 1.5806701375940693
Energy: 1.581829987439989
Energy: 1.617491857057293
Energy: 1.5800377094501403
Energy: 1.545997753382721
Energy: 1.6200375307307142
Energy: 1.5650924452361301
Energy: 1.5459977533783535
Energy: 1.6200375307285306
Energy: 1.5650924452404977
Energy: 1.54599775337617
Energy: 1.6200375307241632
Energy: 1.5650924452404977
Energy: 1.5459977533783535
Energy: 1.6971079450395588
Energy: 1.6001251543645023
Energy: 1.6002997813672535
Energy: 1.6971079450417426
Energy: 1.6001251543666863
Energy: 1.60029978136507
Energy: 1.6971079450417426
Energy: 1.6001251543666863
Energy: 1.6002997813694373
Energy: 1.6971079450417426
Energy: 1.578107185854796
Energy: 1.7660842012642892
Energy: 1.672045829969703
Energy: 1.5780525176859177
Energy: 1.7660842012642892
Energy: 1.6509089530613157
Energy: 1.5781071858526123
Energy: 1.7660842012642892
Energy: 1.6720458299718868
Energy: 1.5780525176859177
Energy: 1.6545227701491692
Energy: 1.5707997568024012
Energy: 1.650643532748109
Energy: 1.6545227701469856
Energy: 1.5707997568024012
Energy: 1.650643532748109
Energy: 1.6545227701469856
Energy: 1.5707997567980339
Energy: 1.6506435327459255
Energy: 1.6545227701491692
Energy: 1.7327318468567428
Energy: 1.7703604839581586
Energy: 1.733844512268924
Energy: 1.7327318468567428
Energy: 1.7703604839581586
Energy: 1.7338445122667405
Energy: 1.7327318468567428
Energy: 1.7703604839603422
Energy: 1.733844512271108
Energy: 1.7327318468567428
Energy: 1.7919848601546333
Energy: 1.544695414278229
Energy: 1.7027909262473981
Energy: 1.8483795072951277
Energy: 1.544714054602371
Energy: 1.7027909262452146
Energy: 1.791984860159001
Energy: 1.544695414278229
Energy: 1.702790926243031
Energy: 1.848379507292944
Energy: 1.6198614135179394
Energy: 1.5433993621790323
Energy: 1.7046438045840955
Energy: 1.6198614135179394
Energy: 1.5433993621790323
Energy: 1.7046438045819117
Energy: 1.6198614135179394
Energy: 1.5433993621790323
Energy: 1.704643804586279
Energy: 1.6198614135179394
Energy: 1.8060278224183777
Energy: 1.680047748063815
Energy: 1.5598981025484284
Energy: 1.8060278224183777
Energy: 1.680047748035427
Energy: 1.5599016997924722
Energy: 1.8060278224183777
Energy: 1.6800477481358373
Energy: 1.5598981025527956
Energy: 1.8060278224183777
Energy: 1.5617052912204652
Energy: 1.780771711362178
Energy: 1.7056584884149326
Energy: 1.5617052912182816
Energy: 1.7807717113599943
Energy: 1.7056584884171164
Energy: 1.5617052912204652
Energy: 1.7807717113578103
Energy: 1.7056584884149326
Energy: 1.5617052912204652
Energy: 1.5977551507099335
Energy: 1.694352388202237
Energy: 1.6791418949370873
Energy: 1.5567252869375894
Energy: 1.6943523885929215
Energy: 1.6791418949392711
Energy: 1.597755150714301
Energy: 1.6943523885667169
Energy: 1.6791418949392711
Energy: 1.5567252869419568
Energy: 1.596830199501383
Energy: 1.7761447509550936
Energy: 1.706253081743194
Energy: 1.5573506326243862
Energy: 1.77614475095291
Energy: 1.684362283109142
Energy: 1.5968301994970153
Energy: 1.7761447509550936
Energy: 1.706253081743194
Energy: 1.5573506326243862
Energy: 1.5699642808945342
Energy: 1.8720541920125948
Energy: 1.7707579146982457
Energy: 1.569964280896718
Energy: 1.8720541920125948
Energy: 1.7707579146982457
Energy: 1.5699642808945342
Energy: 1.8720541920147782
Energy: 1.7707579147004293
Energy: 1.5699642808945342
Energy: 1.8308966478712985
Energy: 1.5603566906848771
Energy: 1.8220276078620636
Energy: 1.830896647873482
Energy: 1.5603566906805098
Energy: 1.8220276078620636
Energy: 1.830896647873482
Energy: 1.5603566906805098
Energy: 1.8220276078620636
Energy: 1.8308966478712985
Energy: 1.7368426236534376
Energy: 1.7014054625396025
Energy: 1.54513125535738
Energy: 1.7368426236534376
Energy: 1.7014054625396025
Energy: 1.5449828655362012
Energy: 1.7368426236512537
Energy: 1.701405462541786
Energy: 1.5451312553551964
Energy: 1.7368426236556211
Energy: 1.9333872761392925
Energy: 1.7207137607041776
Energy: 1.5429302703962915
Energy: 1.9333872761371091
Energy: 1.720713760701994
Energy: 1.5429302703941077
Energy: 1.9333872761349251
Energy: 1.7207137607041776
Energy: 1.5429302703941077
Energy: 1.9333872761371091
Energy: 1.6950898397064769
Energy: 1.6929937893797706
Energy: 1.7116252998462167
Energy: 1.6950898397042933
Energy: 1.6929937893797706
Energy: 1.711625299844033
Energy: 1.6950898397086607
Energy: 1.6929937893797706
Energy: 1.7116252998462167
Energy: 1.6950898397064769
Energy: 1.8861101444288033
Energy: 1.748889705242317
Energy: 1.5658498434191899
Energy: 1.8861101444288033
Energy: 1.748889705244501
Energy: 1.5658498434191899
Energy: 1.886110144424436
Energy: 1.7488897052466845
Energy: 1.5658498434191899
Energy: 1.8861101444266197
Energy: 1.5800070631483478
Energy: 1.732669947445447
Energy: 1.6139819292907431
Energy: 1.580007063146164
Energy: 1.732669947445447
Energy: 1.6139819292907431
Energy: 1.5800070631439804
Energy: 1.7326699474476308
Energy: 1.6139819292907431
Energy: 1.5800070631439804
Energy: 1.7122258590655564
Energy: 1.579009066579529
Energy: 1.5795325607463493
Energy: 1.71222585906774
Energy: 1.5594084353543884
Energy: 1.5591104724852882
Energy: 1.7122258590699238
Energy: 1.579009066577385
Energy: 1.5795325607507167
Energy: 1.7122258590633728
Energy: 1.781628718121772
Energy: 1.5568773245928016
Energy: 1.8613001680421246
Energy: 1.7816287181261394
Energy: 1.556877324590618
Energy: 1.8613001680399408
Energy: 1.7816287181261394
Energy: 1.5568773245928016
Energy: 1.8613001680421246
Energy: 1.7816287181239556
Energy: 1.5822355118645994
Energy: 1.974311555238154
Energy: 1.5818016060989164
Energy: 1.5822355118624156
Energy: 1.9743115552337867
Energy: 1.5818016060989164
Energy: 1.5822355118645994
Energy: 1.9743115552337867
Energy: 1.5818016060989164
Energy: 1.5822355118624156
Energy: 1.614355259313351
Energy: 1.5443710054710562
Energy: 1.839492921035989
Energy: 1.6143552593024328
Energy: 1.5443646747972735
Energy: 1.839492921035989
Energy: 1.6143552593089838
Energy: 1.5443710054754236
Energy: 1.8394929210338051
Energy: 1.6143552593024328
Energy: 1.5909315615437674
Energy: 1.554683749120379
Energy: 1.7113691338850434
Energy: 1.5909315717501933
Energy: 1.554683749120379
Energy: 1.7113691338828598
Energy: 1.5909315737364889
Energy: 1.554683749120379
Energy: 1.7113691338828598
Energy: 1.590931578222012
Energy: 1.6630949919567475
Energy: 1.6317536772917902
Energy: 1.5622214828494494
Energy: 1.6630949919588918
Energy: 1.6317536772917902
Energy: 1.5622204368031232
Energy: 1.6630949919567475
Energy: 1.6317536772939738
Energy: 1.5622214828494494
Energy: 1.6630949919588918
Energy: 1.5651722786552034
Energy: 1.695415706528239
Energy: 1.692239181736141
Energy: 1.565172278650836
Energy: 1.6954157065304225
Energy: 1.6922391817383247
Energy: 1.565172278650836
Energy: 1.695415706532606
Energy: 1.6922391817383247
Energy: 1.5651722786486524
Energy: 1.5570614910952338
Energy: 1.6960977522163883
Energy: 1.7642036126312879
Energy: 1.5570614910952338
Energy: 1.6960977522142047
Energy: 1.7642036126312879
Energy: 1.55706149109305
Energy: 1.6960977522163883
Energy: 1.7642036126312879
Energy: 1.5570614910952338

minimum gb energy = 1.5389090194195585 eV
minimum distance =  2.21301994833392 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.5306531644214263
Energy: 1.5293124216754452
Energy: 1.5294638742387625
Energy: 1.530653164420631
Energy: 1.5293124216762406
Energy: 1.5294638742371718
Energy: 1.5306531644214263
Energy: 1.5293124216762406
Energy: 1.5294638742371718
Energy: 1.530653164420631
Energy: 1.6871247304413404
Energy: 1.5010751581252302
Energy: 1.7185132758772135
Energy: 1.6871247304413404
Energy: 1.5010751581244346
Energy: 1.7185132758772135
Energy: 1.6871247304405448
Energy: 1.5010751581252302
Energy: 1.7185132758772135
Energy: 1.6871247304421357
Energy: 1.6904517206824867
Energy: 1.4858307729355265
Energy: 1.8562239808583503
Energy: 1.6600143632229487
Energy: 1.485830772934731
Energy: 1.8562165056747988
Energy: 1.6904517206816911
Energy: 1.4858307729355265
Energy: 1.8562040720290853
Energy: 1.6600143632221531
Energy: 1.61812375987419
Energy: 1.763593907151802
Energy: 1.6217733438098874
Energy: 1.618123759875781
Energy: 1.7635939071541886
Energy: 1.621773343825003
Energy: 1.61812375987419
Energy: 1.7635939071533933
Energy: 1.621773343813865
Energy: 1.618123759875781
Energy: 1.6809269991814078
Energy: 1.5356442508697012
Energy: 1.8703874754554422
Energy: 1.6809269991822036
Energy: 1.5356442508704968
Energy: 1.8703874755047667
Energy: 1.6809269991814078
Energy: 1.5356442508697012
Energy: 1.8703874754244154
Energy: 1.6809269991822036
Energy: 1.7009901353538504
Energy: 1.724471491077497
Energy: 1.5016497882103441
Energy: 1.7009901353522594
Energy: 1.7244714910767016
Energy: 1.5016497882095488
Energy: 1.7009901353538504
Energy: 1.724471491077497
Energy: 1.50164978821114
Energy: 1.7009901353522594
Energy: 1.6227177051812922
Energy: 1.5613935103525285
Energy: 1.4857968004817117
Energy: 1.6227177051789057
Energy: 1.5613935103517331
Energy: 1.4857968004825073
Energy: 1.6227177051804966
Energy: 1.5613935103525285
Energy: 1.4857968004825073
Energy: 1.6227177051804966
Energy: 1.6182177903441008
Energy: 1.776016662914293
Energy: 1.6167757664036755
Energy: 1.6182177903448964
Energy: 1.776016662914293
Energy: 1.6167757664036755
Energy: 1.6182177903448964
Energy: 1.7760166629150886
Energy: 1.6167757664036755
Energy: 1.618217790345692
Energy: 1.898980779713355
Energy: 1.7186543694467942
Energy: 1.533960678555602
Energy: 1.898980779713355
Energy: 1.7186543694459986
Energy: 1.5339606785571929
Energy: 1.898980779713355
Energy: 1.71865436944759
Energy: 1.5339606785563975
Energy: 1.898980779713355
Energy: 1.6191004072769626
Energy: 1.6815240459157883
Energy: 1.7318790771361239
Energy: 1.6191004072777582
Energy: 1.6815240459650407
Energy: 1.731879077137715
Energy: 1.6191004072769626
Energy: 1.6815240458561211
Energy: 1.731879077137715
Energy: 1.6191004072769626
Energy: 1.60716461540283
Energy: 1.5001899623454715
Energy: 1.585866504099343
Energy: 1.607164615404421
Energy: 1.5001899623446757
Energy: 1.5858665040969562
Energy: 1.6071646154052166
Energy: 1.5001899623446757
Energy: 1.5858665040977515
Energy: 1.6071646154036257
Energy: 1.680862815671272
Energy: 1.5068810358340285
Energy: 1.687650319303775
Energy: 1.680862815671272
Energy: 1.5068810358332332
Energy: 1.6876503193029797
Energy: 1.6808628156720675
Energy: 1.5068810358340285
Energy: 1.687650319303775
Energy: 1.6808628156704764
Energy: 1.498844789901489
Energy: 1.6295360966619366
Energy: 1.499120866040143
Energy: 1.498844789901489
Energy: 1.6295360966603456
Energy: 1.499120866040143
Energy: 1.4988447899006934
Energy: 1.629536096662732
Energy: 1.4991208660393476
Energy: 1.4988447899006934
Energy: 1.5235426777820844
Energy: 1.5890954534217552
Energy: 1.6205928304433375
Energy: 1.5235426777843988
Energy: 1.5890954534217552
Energy: 1.6205928304473156
Energy: 1.5235426777843988
Energy: 1.5890954534217552
Energy: 1.6205928304473156
Energy: 1.5235426777843988

minimum gb energy = 1.4857968004817117 eV
minimum distance =  2.22823666366118 Angstroms
sigma value = 33