Model name: model_name=EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5192936509847637
cohesive_energy=4.450092204567907
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.8377341505302611
Energy: 1.0732616762504785
Energy: 0.8377341505305921
Energy: 1.4944110152570005
Energy: 0.8377341505302611
Energy: 1.1662486604136506
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.8377341505305921
Energy: 1.4944110152572945
Energy: 0.8377341505302611
Energy: 1.166248660416261
Energy: 0.8377341505302611
Energy: 1.166248660416261
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.01817550270131448
Energy: 0.8377341505302611
Energy: 0.8377341505302611
Energy: 1.1662486604133564
Energy: 0.8377341505302611
Energy: 1.1662486604194966
Energy: 0.8377341505302611
Energy: 1.166248660416261

minimum gb energy = 0.01817550270131448 eV
minimum distance =  2.33944414187412 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.3076912016282183
Energy: 1.245278534383631
Energy: 1.3076912016282183
Energy: 1.2452785343812416
Energy: 1.3076912016274218
Energy: 1.245278534382038
Energy: 1.3599971393662507
Energy: 1.1588011162249865
Energy: 1.3599971393662507
Energy: 1.1588011162249865
Energy: 1.3599971393654542
Energy: 1.1588011162249865
Energy: 1.2383548781068787
Energy: 1.3018901113746153
Energy: 1.2383548781052858
Energy: 1.301890111369836
Energy: 1.2383548781068787
Energy: 1.3018901113722257
Energy: 1.4027285587970462
Energy: 1.190711543999705
Energy: 1.4027285587970462
Energy: 1.190711543999705
Energy: 1.4027285587978429
Energy: 1.190711543999705
Energy: 1.2598664283173961
Energy: 1.362365777876955
Energy: 1.2598664283189893
Energy: 1.3623657778777514
Energy: 1.2598664283181928
Energy: 1.362365777876955
Energy: 1.3293632465336538
Energy: 1.1999576541812735
Energy: 1.3293632465336538
Energy: 1.1999576541804768
Energy: 1.3293632465336538
Energy: 1.1999576541804768
Energy: 1.2099858311379945
Energy: 1.3445568209747618
Energy: 1.2903561603362246
Energy: 1.3445568209747618
Energy: 1.250371697923492
Energy: 1.3445568209747618
Energy: 1.2262301852375037
Energy: 1.3710195448576674
Energy: 1.2262301852375037
Energy: 1.371019544858464
Energy: 1.2262301852375037
Energy: 1.371019544858464
Energy: 1.3524824326232294
Energy: 1.2961366763046291
Energy: 1.352482432622433
Energy: 1.2961366763038327
Energy: 1.3524824326216363
Energy: 1.2961366763038327
Energy: 1.1533504027807566
Energy: 1.3781468869432727
Energy: 1.15335040277996
Energy: 1.3781468869432727
Energy: 1.1533504027807566
Energy: 1.3781468869432727
Energy: 1.3401734798805587
Energy: 1.179000221107697
Energy: 1.3401734798821516
Energy: 1.179000221107697
Energy: 1.340173479879762
Energy: 1.179000221107697
Energy: 1.1043797001699354
Energy: 1.335066422600346
Energy: 1.1043797001683422
Energy: 1.335066422600346
Energy: 1.104379700167546
Energy: 1.3350664226011426
Energy: 1.4234163156911
Energy: 1.099816091003936
Energy: 1.4234163156895068
Energy: 1.0998160910063257
Energy: 1.4234163156903032
Energy: 1.0998160910055292
Energy: 1.1884495876692087
Energy: 1.249831587883588
Energy: 1.1884495876692087
Energy: 1.249831587883588
Energy: 1.188449587668412
Energy: 1.249831587883588
Energy: 1.4221917062703553
Energy: 1.1626399666983973
Energy: 1.4221917062703553
Energy: 1.1626399666976008
Energy: 1.4221917062695588
Energy: 1.1626399666983973
Energy: 1.4160146727869856
Energy: 1.305294200843826
Energy: 1.4160146727853924
Energy: 1.3052942008430295
Energy: 1.416014672786189
Energy: 1.3052942008446222
Energy: 1.3265773132128267
Energy: 1.2487142601316812
Energy: 1.3265773132128267
Energy: 1.2487142601316812
Energy: 1.3265773132136232
Energy: 1.2487142601316812
Energy: 1.3329185243944797
Energy: 1.2090979129309678
Energy: 1.3329185243936832
Energy: 1.2090979129309678
Energy: 1.3329185243952764
Energy: 1.2090979129301713
Energy: 1.193945756059108
Energy: 1.2058033936090977
Energy: 1.1939457560599045
Energy: 1.2058033936059118
Energy: 1.193945756060701
Energy: 1.2058033936090977
Energy: 1.298549477911121
Energy: 1.19974874216881
Energy: 1.298549477911121
Energy: 1.1997487421696065
Energy: 1.298549477911121
Energy: 1.1997487421696065
Energy: 1.1607590338068023
Energy: 1.5239451416059642
Energy: 1.1607590338068023
Energy: 1.5239451416059642
Energy: 1.1607590338068023
Energy: 1.5239451416059642
Energy: 1.3287191354314651
Energy: 1.2939393124333975
Energy: 1.3287191354314651
Energy: 1.293939312432601
Energy: 1.3287191354298722
Energy: 1.293939312432601
Energy: 1.1468227638764152
Energy: 1.3578139454424913
Energy: 1.1468227638764152
Energy: 1.3578139454424913
Energy: 1.1468227638756188
Energy: 1.3578139454424913

minimum gb energy = 1.099816091003936 eV
minimum distance =  2.25972219522155 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.3250415134533107
Energy: 1.3349315043040024
Energy: 1.325041513454217
Energy: 1.3349315043044554
Energy: 1.3250415134528577
Energy: 1.3349315043044554
Energy: 1.308309421952663
Energy: 1.2307907493821284
Energy: 1.308309421952663
Energy: 1.2307907493825814
Energy: 1.3083094219535691
Energy: 1.2307907493825814
Energy: 1.086447849557232
Energy: 1.2027283568991374
Energy: 1.086447849556326
Energy: 1.202728356905027
Energy: 1.0864478495540604
Energy: 1.2027283569000433
Energy: 1.363314620156371
Energy: 1.3606606748089143
Energy: 1.363314620156371
Energy: 1.3606606748093673
Energy: 1.363314620156371
Energy: 1.3606606748107264
Energy: 1.2041455327043589
Energy: 1.2424315549161182
Energy: 1.2041455327039061
Energy: 1.242431554916571
Energy: 1.2041455327043589
Energy: 1.2424315549170244
Energy: 1.2273491767112152
Energy: 1.0879046799995322
Energy: 1.2273491767103093
Energy: 1.0879046800058751
Energy: 1.2273491767107623
Energy: 1.0879046800036096
Energy: 1.336943180321345
Energy: 1.3420965877688957
Energy: 1.3369431803267815
Energy: 1.3420965877688957
Energy: 1.336943180339014
Energy: 1.3420965877688957
Energy: 1.099017238285334
Energy: 1.3439575051119228
Energy: 1.099017238284428
Energy: 1.3439575051110166
Energy: 1.0990172382835632
Energy: 1.3439575051137351
Energy: 1.181471024152945
Energy: 1.0905953244089193
Energy: 1.1814710241543043
Energy: 1.090595324408466
Energy: 1.181471024153398
Energy: 1.090595324408466
Energy: 1.1191843578126865
Energy: 1.3501030695433132
Energy: 1.1191843578122338
Energy: 1.3501030695356113
Energy: 1.119184357814046
Energy: 1.350103069541954
Energy: 1.350477928786199
Energy: 1.1065936341046325
Energy: 1.3504779287997908
Energy: 1.1065936341041795
Energy: 1.3504779288038682
Energy: 1.1065936341041795
Energy: 1.0863665682985708
Energy: 1.1830729560204902
Energy: 1.0863665682985708
Energy: 1.183072956019584
Energy: 1.0863665682990238
Energy: 1.1830729560204902
Energy: 1.3427887518298016
Energy: 1.098604069778647
Energy: 1.3427887518153452
Energy: 1.098604069778647
Energy: 1.3427887518234587
Energy: 1.098604069778647
Energy: 1.3449022907443882
Energy: 1.3374204929197278
Energy: 1.3449022907457475
Energy: 1.337420492922899
Energy: 1.344902290741217
Energy: 1.337420492922899
Energy: 1.2592610572235583
Energy: 1.231055830453664
Energy: 1.2592610572226524
Energy: 1.231055830453664
Energy: 1.259261057221293
Energy: 1.2310558304532109
Energy: 1.0879730279915445
Energy: 1.212257788611156
Energy: 1.0879730279838427
Energy: 1.2122577886116093
Energy: 1.0879730279992463
Energy: 1.2122577886116093
Energy: 1.3674946891004178
Energy: 1.3671673935447286
Energy: 1.367494689101324
Energy: 1.3671673935456348
Energy: 1.3674946890972466
Energy: 1.3671673935451816
Energy: 1.2023685010478224
Energy: 1.087771124384275
Energy: 1.2023685010487284
Energy: 1.0877711243883523
Energy: 1.2023685010460101
Energy: 1.0877711243847281
Energy: 1.2265514704940745
Energy: 1.2895236939880912
Energy: 1.2265514704931684
Energy: 1.289523693986279
Energy: 1.2265514704945277
Energy: 1.2895236939885442
Energy: 1.3370387019273577
Energy: 1.328082231930773
Energy: 1.3370387019282641
Energy: 1.32808223193032
Energy: 1.3370387019282641
Energy: 1.32808223193032
Energy: 1.113729894204189
Energy: 1.3065802289254387
Energy: 1.1137298942032827
Energy: 1.3065802289258919
Energy: 1.11372989420283
Energy: 1.3065802289254387
Energy: 1.2017903191178916
Energy: 1.090692032184946
Energy: 1.2017903191310302
Energy: 1.090692032184493
Energy: 1.2017903191260466
Energy: 1.090692032184493
Energy: 1.1039145626119533
Energy: 1.4278905933673436
Energy: 1.1039145626128597
Energy: 1.4278905933677966
Energy: 1.1039145626128597
Energy: 1.4278905933682497
Energy: 1.3538809991203316
Energy: 1.2033735519448532
Energy: 1.3538809991180663
Energy: 1.2033735519448532
Energy: 1.35388099911716
Energy: 1.2033735519444004
Energy: 1.0877168898186969
Energy: 1.1839281185202262
Energy: 1.0877168898159784
Energy: 1.1839281185202262
Energy: 1.0877168898159784
Energy: 1.1839281185202262
Energy: 1.3448397779017136
Energy: 1.3285090390957703
Energy: 1.3448397779021668
Energy: 1.3285090390980356
Energy: 1.3448397779012606
Energy: 1.3285090390971295
Energy: 1.3448928584280158
Energy: 1.3284886716497633
Energy: 1.3448928584271096
Energy: 1.3284886716484043
Energy: 1.3448928584266566
Energy: 1.3284886716506694
Energy: 1.0879029684663983
Energy: 1.1837561226096265
Energy: 1.0879029684645858
Energy: 1.1837561226096265
Energy: 1.0879029684659451
Energy: 1.1837561226096265
Energy: 1.3535050062372485
Energy: 1.2034644079695338
Energy: 1.3535050062377014
Energy: 1.2034644079695338
Energy: 1.3535050062390608
Energy: 1.20346440797044
Energy: 1.103895828656545
Energy: 1.4279026221178133
Energy: 1.1038958286569982
Energy: 1.4279026221187194
Energy: 1.103895828656545
Energy: 1.4279026221164541
Energy: 1.2018484055383947
Energy: 1.0907206850200601
Energy: 1.2018484055433782
Energy: 1.0907206850196072
Energy: 1.2018484055429253
Energy: 1.0907206850200601
Energy: 1.1137926337698287
Energy: 1.3065461874324866
Energy: 1.1137926337698287
Energy: 1.3065461874324866
Energy: 1.113792633770282
Energy: 1.3065461874329398
Energy: 1.3370772159653603
Energy: 1.3280831644562763
Energy: 1.3370772159649071
Energy: 1.3280831644562763
Energy: 1.3370772159649071
Energy: 1.3280831644562763
Energy: 1.226540007765055
Energy: 1.2895860773615953
Energy: 1.2265400077664144
Energy: 1.2895860773584238
Energy: 1.226540007765055
Energy: 1.2895860773615953
Energy: 1.202448933610967
Energy: 1.0878547477156706
Energy: 1.2024489336136854
Energy: 1.0878547477124991
Energy: 1.2024489336123263
Energy: 1.0878547477138585
Energy: 1.367869482568099
Energy: 1.3666016019078242
Energy: 1.3678694825730826
Energy: 1.3666016019073712
Energy: 1.3678694825694584
Energy: 1.3666016019069183
Energy: 1.088096359842484
Energy: 1.2121338912141828
Energy: 1.0880963598465614
Energy: 1.2121338912141828
Energy: 1.0880963598388596
Energy: 1.2121338912141828
Energy: 1.2595705461614437
Energy: 1.2311098608727244
Energy: 1.2595705461582722
Energy: 1.2311098608727244
Energy: 1.2595705461609905
Energy: 1.2311098608731772
Energy: 1.3448943725756919
Energy: 1.3371431109773382
Energy: 1.344894372577504
Energy: 1.337143110982322
Energy: 1.3448943725779572
Energy: 1.337143110984134
Energy: 1.342668630197954
Energy: 1.0982784632756917
Energy: 1.3426686301916113
Energy: 1.098278463275239
Energy: 1.3426686302024846
Energy: 1.098278463275239
Energy: 1.0863738738379254
Energy: 1.183704142043634
Energy: 1.0863738738388315
Energy: 1.1837041420431809
Energy: 1.0863738738392845
Energy: 1.1837041420431809

minimum gb energy = 1.0863665682985708 eV
minimum distance =  2.31490241990055 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.2627169152030169
Energy: 1.2576040357709677
Energy: 1.2627169152040667
Energy: 1.2576040357699183
Energy: 1.2627169152030169
Energy: 1.2576040357699183
Energy: 1.3205839466533227
Energy: 1.2291073596701776
Energy: 1.3205839466533227
Energy: 1.2291073596701776
Energy: 1.3205839466522726
Energy: 1.2291073596701776
Energy: 1.238271711564048
Energy: 1.4412600877249309
Energy: 1.2382717115629984
Energy: 1.4412600877249309
Energy: 1.2382717115650979
Energy: 1.4412600877249309
Energy: 1.2645757500858839
Energy: 1.1309759552460072
Energy: 1.2645757500858839
Energy: 1.1309759552460072
Energy: 1.2645757500869337
Energy: 1.1309759552460072
Energy: 1.2980867080101655
Energy: 1.2402067109889
Energy: 1.2980867080080662
Energy: 1.2402067109889
Energy: 1.2980867080091159
Energy: 1.2402067109889
Energy: 1.2991175354436526
Energy: 1.239491195147534
Energy: 1.2991175354447022
Energy: 1.239491195147534
Energy: 1.2991175354436526
Energy: 1.239491195147534
Energy: 1.2233219757932923
Energy: 1.2395694875257341
Energy: 1.223321975794342
Energy: 1.2395694875257341
Energy: 1.223321975794342
Energy: 1.2395694875257341
Energy: 1.2194125802822806
Energy: 1.2856468992568528
Energy: 1.219412580281231
Energy: 1.2856468992568528
Energy: 1.2194125802822806
Energy: 1.2856468992568528
Energy: 1.448561828874296
Energy: 1.1296863307326186
Energy: 1.448561828874296
Energy: 1.1296863307326186
Energy: 1.448561828874296
Energy: 1.1296863307326186
Energy: 1.1311892583961711
Energy: 1.4390189987598543
Energy: 1.1311892583972205
Energy: 1.4390189987588047
Energy: 1.1311892583972205
Energy: 1.4390189987588047
Energy: 1.2853651505052728
Energy: 1.1587433987620726
Energy: 1.2853651505063226
Energy: 1.1587433987620726
Energy: 1.2853651505063226
Energy: 1.1587433987620726
Energy: 1.2649032217530578
Energy: 1.2600954954992307
Energy: 1.264903221752008
Energy: 1.2600954954992307
Energy: 1.2649032217530578
Energy: 1.2600954954992307
Energy: 1.3220485769922474
Energy: 1.2141452955964884
Energy: 1.3220485769922474
Energy: 1.2141452955964884
Energy: 1.3220485769922474
Energy: 1.2141452955964884
Energy: 1.2801970229608597
Energy: 1.2058124485749
Energy: 1.2801970229608597
Energy: 1.2058124485749
Energy: 1.2801970229608597
Energy: 1.2058124485749
Energy: 1.2675057781654884
Energy: 1.2596756961007471
Energy: 1.2675057781665382
Energy: 1.2596756961007471
Energy: 1.2675057781665382
Energy: 1.2596756961007471
Energy: 1.2996522205891092
Energy: 1.2393289464723998
Energy: 1.2996522205901588
Energy: 1.2393289464723998
Energy: 1.2996522205901588
Energy: 1.2393289464734494
Energy: 1.2999184680398332
Energy: 1.369982906534302
Energy: 1.2999184680387834
Energy: 1.369982906535352
Energy: 1.2999184680398332
Energy: 1.369982906534302
Energy: 1.2598066307060114
Energy: 1.2471616040987066
Energy: 1.259806630707061
Energy: 1.2471616040987066
Energy: 1.259806630707061
Energy: 1.2471616040987066

minimum gb energy = 1.1296863307326186 eV
minimum distance =  2.2595952678267 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.1695463934834547
Energy: 1.2504385760052983
Energy: 1.024312955009258
Energy: 1.250438576004053
Energy: 1.1695463934847
Energy: 1.2504385760028076
Energy: 1.2546314493542154
Energy: 1.0926049575886558
Energy: 1.2546314493529704
Energy: 1.092604957588033
Energy: 1.2546314493573287
Energy: 1.0926049575905237
Energy: 1.2078775491376892
Energy: 1.309340902780572
Energy: 1.207877549134576
Energy: 1.3093409027780814
Energy: 1.2078775491370664
Energy: 1.3093409027780814
Energy: 1.2408780674900268
Energy: 1.210948827821671
Energy: 1.2408780674900268
Energy: 1.2107325887879026
Energy: 1.2408780674887816
Energy: 1.2109488278191802
Energy: 1.213659081431177
Energy: 1.0959890285386773
Energy: 1.2136590814317998
Energy: 1.0232150229145909
Energy: 1.213659081429932
Energy: 1.0959890285380545
Energy: 1.0816347524723038
Energy: 1.0959282300854893
Energy: 1.0816347524772851
Energy: 1.0232571978129767
Energy: 1.0816347524772851
Energy: 1.0959282300848665
Energy: 1.0941488659303886
Energy: 1.262725975700268
Energy: 1.0941488659341245
Energy: 1.262725975701485
Energy: 1.0941488659341245
Energy: 1.2627259756977773
Energy: 1.2498110472161699
Energy: 1.5214695242280158
Energy: 1.2498188887659964
Energy: 1.5214695242305063
Energy: 1.249811047221123
Energy: 1.5214695242286385
Energy: 1.2375061251347765
Energy: 1.2399576964139185
Energy: 1.2375061251385122
Energy: 1.2399576964151637
Energy: 1.2375061251378898
Energy: 1.2399576964176544
Energy: 1.0243129550086352
Energy: 1.2504385760046757
Energy: 1.024312955009258
Energy: 1.250438576004053
Energy: 1.0243129550086352
Energy: 1.250438576004053
Energy: 1.2546314493535928
Energy: 1.0926049575874104
Energy: 1.2546314493523478
Energy: 1.0926049575874104
Energy: 1.254631449355461
Energy: 1.0926049575892782
Energy: 1.2078775491376892
Energy: 1.3093409027824399
Energy: 1.2078775491358211
Energy: 1.309340902778704
Energy: 1.2078775491364437
Energy: 1.309340902778704
Energy: 1.240878067488159
Energy: 1.2072824520456975
Energy: 1.2408780674887816
Energy: 1.207353016154459
Energy: 1.2408780674869135
Energy: 1.2072824520419616
Energy: 1.2136590814317998
Energy: 1.0232150229189494
Energy: 1.2136590814324224
Energy: 1.0959802754838073
Energy: 1.2136590814305543
Energy: 1.0232150229170816
Energy: 1.0816347524710586
Energy: 1.0232571978135994
Energy: 1.0816347524772851
Energy: 1.095988600625389
Energy: 1.0816347524785306
Energy: 1.023257197814222
Energy: 1.094148865929766
Energy: 1.2627259756990226
Energy: 1.0941488659328795
Energy: 1.2627259756996454
Energy: 1.094148865931634
Energy: 1.2627259756971547
Energy: 1.255830441834954
Energy: 1.5214695242280158
Energy: 1.2586403488723907
Energy: 1.5214695242311291
Energy: 1.2558304418324633
Energy: 1.521469524227393
Energy: 1.1177613726830766
Energy: 1.2399576964145411
Energy: 1.2375061251385122
Energy: 1.2399576964151637
Energy: 1.1177613726805862
Energy: 1.2399576964176544
Energy: 1.1695463934822092
Energy: 1.250438576005921
Energy: 1.0243129550086352
Energy: 1.2504385760046757
Energy: 1.1695463934822092
Energy: 1.2504385760034304
Energy: 1.2546314493535928
Energy: 1.0926049575892782
Energy: 1.2546314493535928
Energy: 1.092604957588033
Energy: 1.2546314493579513
Energy: 1.092604957589901
Energy: 1.2078775491383118
Energy: 1.309340902780572
Energy: 1.2078775491358211
Energy: 1.3093409027780814
Energy: 1.2078775491364437
Energy: 1.3093409027780814
Energy: 1.240878067489404
Energy: 1.2109488278247842
Energy: 1.2408780674900268
Energy: 1.2107325887879026
Energy: 1.2408780674887816
Energy: 1.210948827821671
Energy: 1.2136590814317998
Energy: 1.0959890285399227
Energy: 1.2136590814317998
Energy: 1.0232150229145909
Energy: 1.2136590814305543
Energy: 1.0959890285393
Energy: 1.0816347524716812
Energy: 1.095928230086112
Energy: 1.0816347524779077
Energy: 1.0232571978135994
Energy: 1.0816347524772851
Energy: 1.0959282300854893
Energy: 1.0941488659303886
Energy: 1.2627259756996454
Energy: 1.094148865931634
Energy: 1.2627259757008624
Energy: 1.0941488659310112
Energy: 1.2627259756984
Energy: 1.2498110472161699
Energy: 1.5214695242261476
Energy: 1.2498188887659964
Energy: 1.5214695242305063
Energy: 1.2498110472217459
Energy: 1.5214695242267704
Energy: 1.237506125135399
Energy: 1.2399576964126733
Energy: 1.2375061251391066
Energy: 1.2399576964139185
Energy: 1.2375061251385122
Energy: 1.2399576964176544
Energy: 1.0243129550086352
Energy: 1.2504385760046757
Energy: 1.024312955009258
Energy: 1.2504385760046757
Energy: 1.0243129550086352
Energy: 1.2504385760034304
Energy: 1.254631449355461
Energy: 1.0926049575886558
Energy: 1.2546314493542154
Energy: 1.0926049575886558
Energy: 1.2546314493579513
Energy: 1.0926049575911465
Energy: 1.2078775491383118
Energy: 1.3093409027811946
Energy: 1.2078775491351983
Energy: 1.309340902778704
Energy: 1.2078775491364437
Energy: 1.309340902778704

minimum gb energy = 1.0232150229145909 eV
minimum distance =  2.28734934207447 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.0010883758316969
Energy: 0.9727598574967086
Energy: 1.0010883758316969
Energy: 0.9727598574967086
Energy: 1.0010883758316969
Energy: 0.9727598574967086
Energy: 1.3295597455796113
Energy: 1.0275658684395637
Energy: 1.3295597455796113
Energy: 1.0275658684395637
Energy: 1.3295597455796113
Energy: 1.0275658684395637
Energy: 1.088148234335426
Energy: 1.1541878069386666
Energy: 1.0881482343369513
Energy: 1.1541878069386666
Energy: 1.0881482343369513
Energy: 1.1541878069386666
Energy: 1.2268163783842672
Energy: 0.9607166465117717
Energy: 1.2268163783827417
Energy: 0.9607166465117717
Energy: 1.2268163783842672
Energy: 0.9607166465102465
Energy: 1.358898746898828
Energy: 0.9604658172644938
Energy: 1.358898746898828
Energy: 0.960465817266019
Energy: 1.358898746898828
Energy: 0.960465817266019
Energy: 1.219040391567833
Energy: 1.2939067424031412
Energy: 1.2190403915693582
Energy: 1.2939067424031412
Energy: 1.219040391567833
Energy: 1.2939067424046662
Energy: 0.9596064967691524
Energy: 1.0280924746042026
Energy: 1.1453017148263789
Energy: 1.0280924746042026
Energy: 1.1453017148263789
Energy: 1.0280924746026774
Energy: 0.9990799783948181
Energy: 0.9740245549004038
Energy: 0.9990799783948181
Energy: 0.9740245549004038
Energy: 0.9990799783948181
Energy: 0.9740245549004038
Energy: 1.1063545771114802
Energy: 1.0883148482624718
Energy: 1.1063545771114802
Energy: 1.0883148482624718
Energy: 1.1063545771114802
Energy: 1.0883148482639973
Energy: 1.229642010337389
Energy: 1.1691850381189999
Energy: 1.2296420103358638
Energy: 1.1691850381189999
Energy: 1.2296420103389143
Energy: 1.1691850381189999
Energy: 1.0466691465993245
Energy: 0.9612763627810503
Energy: 1.04666914660085
Energy: 0.9612763627810503
Energy: 1.1810337351653417
Energy: 0.9612763627810503
Energy: 1.284157606267395
Energy: 1.1085704031683392
Energy: 1.2841576062658697
Energy: 1.1085704031683392
Energy: 1.284157606267395
Energy: 1.1085704031683392

minimum gb energy = 0.9596064967691524 eV
minimum distance =  2.19421187959672 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.0858551015123454
Energy: 1.0601315263126432
Energy: 1.0858551015132023
Energy: 1.0601315263126432
Energy: 1.0858551015119167
Energy: 1.0601315263122146
Energy: 1.3388699150725598
Energy: 1.0453671260049944
Energy: 1.3388699150742742
Energy: 1.1078515361626786
Energy: 1.3388699150725598
Energy: 1.044165381816346
Energy: 0.9350854989222936
Energy: 1.405410029784615
Energy: 0.9350854989201509
Energy: 1.4054100297850436
Energy: 0.9350854989231507
Energy: 1.4054100297850436
Energy: 0.91371302173952
Energy: 0.8856411448665944
Energy: 0.913713021741234
Energy: 0.8856411448670231
Energy: 0.9137130217390913
Energy: 0.8856411448665944
Energy: 1.10946461478973
Energy: 1.0230508392630207
Energy: 1.1094646147880156
Energy: 1.023050839261735
Energy: 1.1094646147893013
Energy: 1.0230508392630207
Energy: 1.0569166203643925
Energy: 1.0814840045864877
Energy: 1.0569166203665352
Energy: 1.119565313290659
Energy: 1.0569166203652494
Energy: 1.0692004823824288
Energy: 0.9521853241702746
Energy: 1.1404372572303367
Energy: 0.9521853241724174
Energy: 1.1404372572303367
Energy: 0.9521853241702746
Energy: 1.1404372572307653
Energy: 0.8677744071293122
Energy: 1.1449010922654537
Energy: 0.8677744071305977
Energy: 1.1449010922654537
Energy: 0.8677744071305977
Energy: 1.1449010922654537
Energy: 1.2898273382234453
Energy: 1.0230398834408476
Energy: 1.289827338224731
Energy: 1.0230398834408476
Energy: 1.2898273382243024
Energy: 1.023039883440419
Energy: 1.0808614948912876
Energy: 0.9949697281237618
Energy: 1.080861494890859
Energy: 0.9949697281241903
Energy: 1.0808614948917163
Energy: 0.9949697281237618
Energy: 0.9144634198104075
Energy: 0.8930446295255607
Energy: 0.9144634198078363
Energy: 0.8930446295251323
Energy: 0.9144634198104075
Energy: 0.8930446295255607
Energy: 1.0171922540474005
Energy: 0.973492728888621
Energy: 1.0171922540499718
Energy: 0.9734927288881925
Energy: 1.0171922540482579
Energy: 0.973492728888621
Energy: 0.9843721871499778
Energy: 1.0618949244946314
Energy: 0.9843721871504064
Energy: 1.0618949244946314
Energy: 0.9843721871512636
Energy: 1.0618949244946314
Energy: 1.0644118088637935
Energy: 1.1016969780173256
Energy: 1.064411808863365
Energy: 1.1016969780173256
Energy: 1.0644118088642218
Energy: 1.101696978016897
Energy: 0.904636481451363
Energy: 1.1129085474945035
Energy: 0.9046364814487917
Energy: 1.1129085474945035
Energy: 0.904636481451363
Energy: 1.112908547494932
Energy: 0.9596742869274572
Energy: 1.0451212547082724
Energy: 0.9596742869266001
Energy: 1.0451212547082724
Energy: 0.9596742869287428
Energy: 1.0451212547082724
Energy: 1.2101898239320064
Energy: 0.8856516186109746
Energy: 1.2101898239320064
Energy: 0.8856516186109746
Energy: 1.2101898239324351
Energy: 0.8856516186101177
Energy: 0.9189304127161236
Energy: 1.0187454266669886
Energy: 0.918930412716981
Energy: 1.0187454266669886
Energy: 0.9189304127174094
Energy: 1.0187454266674172
Energy: 0.8632754616198984
Energy: 1.2279653509860757
Energy: 0.8632754616181844
Energy: 1.2279653509873611
Energy: 0.8632754616177949
Energy: 1.2279653509865043
Energy: 1.4142037830860776
Energy: 1.0916219115973533
Energy: 1.414203783083117
Energy: 1.1324409585627107
Energy: 1.4142037830860776
Energy: 1.1115075380137625
Energy: 0.8632188930173492
Energy: 1.2279604566362823
Energy: 0.8632188930152067
Energy: 1.2279604566358537
Energy: 0.8632188930156351
Energy: 1.2279604566362823
Energy: 0.9189660224010643
Energy: 1.0187874718039425
Energy: 0.9189660224006359
Energy: 1.0187874718039425
Energy: 0.9189660223997789
Energy: 1.0187874718039425
Energy: 1.2100004154859545
Energy: 0.8854342512859189
Energy: 1.2100004154868114
Energy: 0.8854342512854904
Energy: 1.21000041548724
Energy: 0.8854342512859189
Energy: 0.9595082318176514
Energy: 0.9737001924053742
Energy: 0.9595082318159371
Energy: 0.9737001924058027
Energy: 0.9595082318163657
Energy: 0.9737001924053742
Energy: 0.9046289706379568
Energy: 1.1127479562444396
Energy: 0.9046289706370998
Energy: 1.112747956244868
Energy: 0.9046289706375283
Energy: 1.1127479562444396
Energy: 1.0652889083583748
Energy: 1.1016886649764501
Energy: 1.0652889083570893
Energy: 1.101688664976879
Energy: 1.0652889083579462
Energy: 1.101688664976879
Energy: 0.9844820838730552
Energy: 1.061844574276078
Energy: 0.9844820838760551
Energy: 1.061844574276078
Energy: 0.984482083874341
Energy: 1.0618445742765066
Energy: 1.0172121566829153
Energy: 0.9015324888059906
Energy: 1.0172121566846295
Energy: 0.9015324888059906
Energy: 1.017212156683344
Energy: 0.9015324888064191
Energy: 0.9144223475053478
Energy: 0.8933881086381287
Energy: 0.9144223475049191
Energy: 0.8933881086385572
Energy: 0.914422347504062
Energy: 0.8933881086381287
Energy: 1.080857467534826
Energy: 1.1745809834377825
Energy: 1.0808574675352545
Energy: 1.1745809834377825
Energy: 1.0808574675339688
Energy: 1.1745809834377825
Energy: 1.2897133287862168
Energy: 1.0227404122781572
Energy: 1.2897133287866451
Energy: 1.0227404122785857
Energy: 1.2897133287870737
Energy: 1.0227404122781572
Energy: 0.8677667190145801
Energy: 1.144952974359473
Energy: 0.8677667190137232
Energy: 1.144952974359473
Energy: 0.8677667190158659
Energy: 1.144952974359044
Energy: 0.9523402005240924
Energy: 1.1404101275698084
Energy: 0.9523402005245208
Energy: 1.1404101275685228
Energy: 0.9523402005249494
Energy: 1.1404101275693799
Energy: 1.0567983521404116
Energy: 1.2137884029704913
Energy: 1.0567983521416975
Energy: 1.2137884029709198
Energy: 1.0567983521408404
Energy: 1.2137884029704913
Energy: 1.1093637950979356
Energy: 1.0224687819383433
Energy: 1.1093637951000783
Energy: 1.0224687819387719
Energy: 1.109363795098793
Energy: 1.0224687819383433
Energy: 0.913810263502166
Energy: 0.8856584351155892
Energy: 0.9138102635000233
Energy: 0.8856584351155892
Energy: 0.9138102635008803
Energy: 0.8856584351155892
Energy: 0.9347818216201041
Energy: 1.4054458182289842
Energy: 0.9347818216226755
Energy: 1.4054458182294127
Energy: 0.9347818216213898
Energy: 1.4054458182289842
Energy: 1.338756129889803
Energy: 1.0786507970715176
Energy: 1.3387561298919457
Energy: 1.0786507970689465
Energy: 1.3387561298910884
Energy: 1.0786507970706605
Energy: 1.0858551015110596
Energy: 1.0601315263135
Energy: 1.0858551015119167
Energy: 1.0601315263122146
Energy: 1.085855101510631
Energy: 1.0601315263130717
Energy: 1.3388699150682746
Energy: 1.0453671260049944
Energy: 1.3388699150699885
Energy: 1.0453671260049944
Energy: 1.3388699150669887
Energy: 1.0453671260049944
Energy: 0.9350854989240079
Energy: 1.4054100297862901
Energy: 0.9350854989231507
Energy: 1.4054100297862901
Energy: 0.9350854989252935
Energy: 1.4054100297859007
Energy: 0.9137130217425198
Energy: 0.8856411448691658
Energy: 0.9137130217425198
Energy: 0.8856411448691658
Energy: 0.9137130217433768
Energy: 0.8856411448691658
Energy: 1.10946461478973
Energy: 1.0230508392613065
Energy: 1.1094646147884442
Energy: 1.0230508392613065
Energy: 1.1094646147884442
Energy: 1.0230508392604494

minimum gb energy = 0.8632188930152067 eV
minimum distance =  2.29360562416529 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 1.1105907496444878
Energy: 0.9051236302413646
Energy: 1.1105907496444878
Energy: 0.9051236302423401
Energy: 1.1105907496444878
Energy: 0.9051236302413646
Energy: 0.6187246597825673
Energy: 0.8043393730112587
Energy: 0.6187246597815917
Energy: 0.8043393730122342
Energy: 0.6187246597815917
Energy: 0.8043393730161363
Energy: 0.867589116599941
Energy: 1.1458908142878168
Energy: 0.867589116599941
Energy: 1.1458908142887922
Energy: 0.8675891165989655
Energy: 1.1458908142887922
Energy: 0.8612149576033113
Energy: 0.8817107728851964
Energy: 0.8612149576042869
Energy: 0.8817107728851964
Energy: 0.8612149576023358
Energy: 0.8817107728842208
Energy: 0.5885707205621684
Energy: 0.6198037605035944
Energy: 0.5885707205621684
Energy: 0.6198037605035944
Energy: 0.588570720561193
Energy: 0.61980376050457
Energy: 0.8560364908523449
Energy: 0.8810410400942296
Energy: 0.856036490856247
Energy: 0.8810410400932541
Energy: 0.8560364908542959
Energy: 0.8810410400942296
Energy: 0.8558869974204009
Energy: 0.84401611281068
Energy: 0.8558869974194696
Energy: 0.84401611281068
Energy: 0.8558869974204009
Energy: 0.84401611281068
Energy: 0.6210474733786564
Energy: 0.5937277569192602
Energy: 0.6210474733786564
Energy: 0.5937277569192602
Energy: 0.6210474733786564
Energy: 0.5937277569192602
Energy: 0.8628002819928965
Energy: 0.8815342946442262
Energy: 0.862800281993872
Energy: 0.8815342946452017
Energy: 0.8628002819919209
Energy: 0.8815342946442262
Energy: 0.8201552988215599
Energy: 1.0644569808843984
Energy: 0.8201552988205845
Energy: 1.0644569808824473
Energy: 0.8201552988205845
Energy: 1.064456980883423
Energy: 0.5864323174814298
Energy: 0.8020611148216081
Energy: 0.5864323174824053
Energy: 0.8020611148167306
Energy: 0.5864323174814298
Energy: 0.8020611148225837
Energy: 1.1105907496425367
Energy: 0.9051236302423401
Energy: 1.1105907496415612
Energy: 0.9051236302423401
Energy: 1.1105907496425367
Energy: 0.9051236302433157
Energy: 0.6187246597835427
Energy: 0.8043393730132097
Energy: 0.6187246597835427
Energy: 0.8043393730122342
Energy: 0.6187246597835427
Energy: 0.8043393730161363
Energy: 0.867589116601892
Energy: 1.1458908142858657
Energy: 0.8675891166009164
Energy: 1.1458908142848903
Energy: 0.867589116601892
Energy: 1.1458908142858657
Energy: 0.8612149575974581
Energy: 0.8817107728871475
Energy: 0.8612149575994094
Energy: 0.8817107728871475
Energy: 0.8612149575994094
Energy: 0.8817107728871475
Energy: 0.5885707205602174
Energy: 0.6198037605026189
Energy: 0.5885707205602174
Energy: 0.6198037605026189
Energy: 0.5885707205602174
Energy: 0.6198037605026189
Energy: 0.8560364908484428
Energy: 0.8810410400961807
Energy: 0.8560364908572224
Energy: 0.8810410400971561
Energy: 0.8560364908621001
Energy: 0.8810410400971561
Energy: 0.8558869974243029
Energy: 0.8440161128077533
Energy: 0.8558869974233274
Energy: 0.8440161128077533
Energy: 0.8558869974243029
Energy: 0.8440161128087289
Energy: 0.621047473381583
Energy: 0.5937277569192602
Energy: 0.621047473381583
Energy: 0.5937277569192602
Energy: 0.621047473381583
Energy: 0.5937277569192602

minimum gb energy = 0.5864323174814298 eV
minimum distance =  2.39374178911482 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.9829508715403527
Energy: 1.0301789565139514
Energy: 0.9829508715417818
Energy: 1.0301789565139514
Energy: 0.9829508715403527
Energy: 1.0301789565139514
Energy: 1.1772639338203876
Energy: 1.0007896764011206
Energy: 1.1772639338203876
Energy: 1.0007896764025497
Energy: 1.1772639338225315
Energy: 1.0007896764011206
Energy: 1.1308854585992083
Energy: 1.3660273662125362
Energy: 1.128249944865061
Energy: 1.366027366213251
Energy: 1.128249944865061
Energy: 1.366027366213251
Energy: 1.1876820645695205
Energy: 0.9230576695593723
Energy: 1.187682064567377
Energy: 0.9230576695600868
Energy: 1.187682064570235
Energy: 0.9230576695600868
Energy: 1.0056199834016597
Energy: 0.8745696314030766
Energy: 1.0056199834016597
Energy: 0.8745696314037912
Energy: 1.0056199834009452
Energy: 0.8745696314037912
Energy: 1.0226570696724868
Energy: 1.0668536750194988
Energy: 1.022657069671772
Energy: 1.0668536750194988
Energy: 1.022657069671772
Energy: 1.0668536750194988
Energy: 0.8510831464237201
Energy: 1.185969612525018
Energy: 0.8510831464272929
Energy: 1.185969612525018
Energy: 0.8510831464258639
Energy: 1.1859696125257326
Energy: 1.0733479300266262
Energy: 0.8345901019721625
Energy: 1.0733479300273405
Energy: 0.8345901019721625
Energy: 1.0733479300244821
Energy: 0.834590101972877
Energy: 1.0738094323726388
Energy: 0.8384766167070815
Energy: 1.0738094323712095
Energy: 0.8384766167070815
Energy: 1.0738094323719243
Energy: 0.8384766167070815
Energy: 0.846854290409473
Energy: 1.2286869253144124
Energy: 0.8468542904123313
Energy: 1.2286869253144124
Energy: 0.8468542904109021
Energy: 1.228686925315127
Energy: 1.0425379306936637
Energy: 1.2149631458271757
Energy: 1.0425379306958076
Energy: 1.2149631458271757
Energy: 1.0425379306965221
Energy: 1.2149631458271757
Energy: 1.0115586737002817
Energy: 0.8796876398267649
Energy: 1.0115586737017108
Energy: 0.8796876398267649
Energy: 1.0115586737017108
Energy: 0.8796876398267649
Energy: 1.0451355667606486
Energy: 0.9203153538009134
Energy: 1.045135566761363
Energy: 0.9203153538009134
Energy: 1.045135566761363
Energy: 0.9203153538009134
Energy: 1.1589349995202072
Energy: 1.3302760667668665
Energy: 1.1589349995194926
Energy: 1.3302760667668665
Energy: 1.158934999518778
Energy: 1.3302760667668665
Energy: 1.125732799262664
Energy: 1.0048238147226107
Energy: 1.1257327992619492
Energy: 1.0048238147226107
Energy: 1.125732799261235
Energy: 1.0048238147226107
Energy: 0.9845225912437535
Energy: 1.0313913832964343
Energy: 0.9845225912416098
Energy: 1.0313913832971489
Energy: 0.9845225912437535
Energy: 1.0313913832971489
Energy: 0.9106896067874017
Energy: 1.0056671160021617
Energy: 0.9106896067881164
Energy: 1.0056671160021617
Energy: 0.910689606785258
Energy: 1.0056671160021617
Energy: 1.2570593893070934
Energy: 1.2120269255293405
Energy: 1.2570593893085227
Energy: 1.2120269255286258
Energy: 1.2570593893063788
Energy: 1.2120269255293405
Energy: 1.1833000991630556
Energy: 0.9213775346194143
Energy: 1.183300099162341
Energy: 0.9213775346194143
Energy: 1.1833000991644846
Energy: 0.921377534620129
Energy: 1.005134208418041
Energy: 0.9917833185632045
Energy: 1.0051342084187556
Energy: 0.9917833185624901
Energy: 1.005134208418041
Energy: 0.9917833185632045
Energy: 0.848664059301109
Energy: 1.0697266594791606
Energy: 0.8486640593025383
Energy: 1.0697266594791606
Energy: 0.8486640593018236
Energy: 1.0697266594791606
Energy: 1.048535311727949
Energy: 1.1450574435276988
Energy: 1.04853531172652
Energy: 1.1450574435276988
Energy: 1.0485353117286635
Energy: 1.145057443528413
Energy: 1.0762453906356781
Energy: 0.9972015279322662
Energy: 1.0762453906342488
Energy: 0.9972015279322662
Energy: 1.0762453906342488
Energy: 0.9972015279322662
Energy: 1.0817666164441824
Energy: 0.9280426584180643
Energy: 1.0817666164441824
Energy: 0.9280426584180643
Energy: 1.081766616443468
Energy: 0.9280426584180643
Energy: 0.8479626075201933
Energy: 1.2264854768261135
Energy: 0.8479626075209079
Energy: 1.2264854768261135
Energy: 0.8479626075209079
Energy: 1.226485476826828
Energy: 1.3956888757966226
Energy: 1.2183230552834206
Energy: 1.395688875795908
Energy: 1.2183230552834206
Energy: 1.3956888757951935
Energy: 1.2183230552834206

minimum gb energy = 0.8345901019721625 eV
minimum distance =  2.27757100674549 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.1064131304260532
Energy: 0.9501247784132238
Energy: 1.106413130426616
Energy: 0.9501247784132238
Energy: 1.106413130426616
Energy: 0.9501247784126607
Energy: 1.2292819444784864
Energy: 1.1998263892826475
Energy: 1.229281944480176
Energy: 1.1998263892826475
Energy: 1.22928194447736
Energy: 1.1998263892826475
Energy: 1.305791271736612
Energy: 1.5215097445370587
Energy: 1.3057912717371756
Energy: 1.5215097445364956
Energy: 1.3057912717388651
Energy: 1.5215097445370587
Energy: 1.1095592892498276
Energy: 0.9365890451294702
Energy: 1.1095592892509538
Energy: 0.9365890451300335
Energy: 1.1095592892498276
Energy: 0.9365890451300335
Energy: 0.9037114061926602
Energy: 0.9948583540034014
Energy: 0.9037114061937868
Energy: 0.9948583540034014
Energy: 0.9037114061920971
Energy: 0.9948583540034014
Energy: 1.1086800814288387
Energy: 1.2671863331894226
Energy: 1.108680081427712
Energy: 1.2671863331894226
Energy: 1.108680081427712
Energy: 1.2671863331894226
Energy: 0.9542601013537906
Energy: 1.2250708501474297
Energy: 0.9542601013543539
Energy: 1.225070850147993
Energy: 0.9542601013532275
Energy: 1.2250708501474297
Energy: 0.9660660318356892
Energy: 0.936633605420497
Energy: 0.9660660318345627
Energy: 0.936633605420497
Energy: 0.9660660318356892
Energy: 0.936633605420497
Energy: 0.9452955611894416
Energy: 0.9774832283858552
Energy: 0.9452955611894416
Energy: 0.9774832283858552
Energy: 0.9452955611894416
Energy: 0.9774832283858552
Energy: 1.0657677540505341
Energy: 1.3552734231216765
Energy: 1.0657677540510975
Energy: 1.3552734231211134
Energy: 1.0657677540510975
Energy: 1.3552734231216765
Energy: 1.06639299927458
Energy: 1.3420367793921935
Energy: 1.0663929992757064
Energy: 1.3420367793921935
Energy: 1.0663929992757064
Energy: 1.3420367793921935
Energy: 0.9445226138780514
Energy: 1.0679702519078247
Energy: 0.9445226138774883
Energy: 1.067970251908388
Energy: 0.9445226138780514
Energy: 1.0679702519078247
Energy: 0.9631558594724481
Energy: 0.9381816450237893
Energy: 0.9631558594724481
Energy: 0.9381816450237893
Energy: 0.963155859471885
Energy: 0.9381816450232262
Energy: 0.9022419510391138
Energy: 1.2368807596295368
Energy: 0.9022419510385504
Energy: 1.2368807596301001
Energy: 0.902241951039677
Energy: 1.2368807596301001
Energy: 1.1087885973766154
Energy: 1.2657780924433542
Energy: 1.1087885973805578
Energy: 1.2657780924433542
Energy: 1.1087885973766154
Energy: 1.2657780924439173
Energy: 0.9043898123892637
Energy: 1.186620029788059
Energy: 0.9043898123909534
Energy: 1.2552889171775223
Energy: 0.9043898123903901
Energy: 1.0419738560254759
Energy: 0.9566029311293592
Energy: 0.9382340938678453
Energy: 0.9566029311271064
Energy: 0.9382340938678453
Energy: 0.9566029311299226
Energy: 0.9382340938678453
Energy: 1.2039555748258317
Energy: 1.5236685659920868
Energy: 1.2039555748258317
Energy: 1.5236685659915237
Energy: 1.2039555748258317
Energy: 1.5236685659915237
Energy: 1.22877116195245
Energy: 1.1909923526572352
Energy: 1.228771161951887
Energy: 1.1909923526572352
Energy: 1.228771161951887
Energy: 1.1909923526572352
Energy: 1.0665758356300439
Energy: 1.143690468287758
Energy: 1.066575835630607
Energy: 1.1818204561603363
Energy: 1.0665758356294803
Energy: 1.0686941368561518
Energy: 0.9459791099484829
Energy: 1.1954881509864392
Energy: 0.9459791099484829
Energy: 1.1954881509864392
Energy: 0.9459791099490462
Energy: 1.1954881509858761
Energy: 1.4026884400178086
Energy: 1.527258922916209
Energy: 1.4026884400172452
Energy: 1.527258922916209
Energy: 1.402688440018935
Energy: 1.527258922916209
Energy: 1.1093131330148573
Energy: 0.9367042537071015
Energy: 1.1093131330142942
Energy: 0.9367042537071015
Energy: 1.1093131330148573
Energy: 0.9367042537071015
Energy: 0.9045797613449794
Energy: 1.2894707289775744
Energy: 0.9045797613472325
Energy: 1.1229702709299694
Energy: 0.9045797613472325
Energy: 1.1229702709294063
Energy: 0.9022406497121271
Energy: 1.2665592937710501
Energy: 0.9022406497104373
Energy: 1.2665592937710501
Energy: 0.9022406497104373
Energy: 1.2665592937710501
Energy: 0.951171630442048
Energy: 1.3244434959806568
Energy: 0.951171630442048
Energy: 1.3244434959800937
Energy: 0.9511716304414848
Energy: 1.3244434959800937
Energy: 0.9624881508030614
Energy: 0.936762439570075
Energy: 0.9624881508013715
Energy: 0.9367624395706381
Energy: 0.962488150802498
Energy: 0.9367624395706381
Energy: 0.9468905696293569
Energy: 1.0940766519391942
Energy: 0.9468905696299201
Energy: 1.0940766519397576
Energy: 0.9468905696293569
Energy: 1.0940766519391942
Energy: 1.065815343630895
Energy: 1.293087556445961
Energy: 1.0658153436325846
Energy: 1.293087556445961
Energy: 1.0658153436303317
Energy: 1.2930875564453976
Energy: 1.3581983677893845
Energy: 1.2002220274267952
Energy: 1.3581983677893845
Energy: 1.2002220274267952
Energy: 1.3581983677893845
Energy: 1.2002220274267952
Energy: 0.944357814099769
Energy: 1.051163957054618
Energy: 0.9443578140986425
Energy: 1.051163957054055
Energy: 0.9443578140992057
Energy: 1.051163957054055
Energy: 0.9576090191646558
Energy: 0.9398554468138154
Energy: 0.9576090191646558
Energy: 0.9398554468138154
Energy: 0.9576090191657823
Energy: 0.9398554468138154
Energy: 0.9025587211363699
Energy: 1.1288597640883287
Energy: 0.9025587211352434
Energy: 1.1288597640877656
Energy: 0.9025587211358067
Energy: 1.1288597640877656

minimum gb energy = 0.9022406497104373 eV
minimum distance =  2.27556764953727 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.04002354960664
Energy: 0.9757056136764011
Energy: 1.0400235496101613
Energy: 0.9757056136740294
Energy: 1.0400235496074306
Energy: 0.9757056136771917
Energy: 1.3400017972785496
Energy: 0.966339953896236
Energy: 1.340001797276178
Energy: 0.966339953896236
Energy: 1.3400017972766092
Energy: 0.9663399538958766
Energy: 1.340991902500901
Energy: 1.4609726169656811
Energy: 1.3409919025060755
Energy: 1.4609726169561945
Energy: 1.3409919025072252
Energy: 1.4609726169541823
Energy: 1.2334814299002823
Energy: 0.9737832433353384
Energy: 1.2334814298928083
Energy: 0.9737832433250615
Energy: 1.2334814298979109
Energy: 0.9737832433392912
Energy: 0.9722335064813306
Energy: 1.4212177646219846
Energy: 0.9722335064821211
Energy: 1.4212177646239967
Energy: 0.9722335064805402
Energy: 1.4212177646235657
Energy: 1.3638468211866075
Energy: 1.0320957664710964
Energy: 1.3638468211763304
Energy: 1.0320957664734678
Energy: 1.3638468211779116
Energy: 1.0320957664695152
Energy: 1.0300352908914232
Energy: 1.3047249709418631
Energy: 1.030035290879565
Energy: 1.3047249709434443
Energy: 1.0300352908843082
Energy: 1.30472497093827
Energy: 1.0692663766629615
Energy: 1.112763139670383
Energy: 1.0692663766613804
Energy: 1.1127631396751263
Energy: 1.0692663766618118
Energy: 1.1127631396731141
Energy: 1.378691089238845
Energy: 1.0323748018100196
Energy: 1.3786910892400668
Energy: 1.0323748018100196
Energy: 1.3786910892527156
Energy: 1.0323748018096601
Energy: 1.461966584793057
Energy: 1.048391161487682
Energy: 1.4619665847938477
Energy: 1.048391161487682
Energy: 1.4619665847887449
Energy: 1.048391161487682
Energy: 1.0726220729341023
Energy: 1.0708403500516388
Energy: 1.072622072930509
Energy: 1.0708403500449555
Energy: 1.0726220729360427
Energy: 1.0708403500647192
Energy: 1.5266668651393254
Energy: 0.9738169914252853
Energy: 1.5266668651396846
Energy: 0.9738169914265071
Energy: 1.5266668651396846
Energy: 0.9738169914241355
Energy: 1.034095857053307
Energy: 1.3803406235290796
Energy: 1.0340958570525165
Energy: 1.3803406235298703
Energy: 1.0340958570525165
Energy: 1.3803406235322415
Energy: 1.112416344676364
Energy: 1.068417152771721
Energy: 1.1124163446847004
Energy: 1.068417152789113
Energy: 1.112416344679526
Energy: 1.068417152784801
Energy: 1.177384313860091
Energy: 1.0199237587616692
Energy: 1.17738431385851
Energy: 1.0199237587632504
Energy: 1.1773843138707993
Energy: 1.0199237587723775
Energy: 1.0325058936483051
Energy: 1.3637553691229531
Energy: 1.0325058936593725
Energy: 1.3637553691289181
Energy: 1.0325058936502454
Energy: 1.363755369124534
Energy: 1.4261164855806665
Energy: 0.9745325459343974
Energy: 1.426116485581026
Energy: 0.9745325459339663
Energy: 1.426116485581457
Energy: 0.9745325459343974
Energy: 0.9736553307093007
Energy: 1.0704181574147884
Energy: 0.9736553307057793
Energy: 1.0704181574389358
Energy: 0.9736553306939212
Energy: 1.0704181574254967
Energy: 1.4611296239026768
Energy: 1.3399784409250615
Energy: 1.4611296239109413
Energy: 1.3399784409230493
Energy: 1.4611296239192777
Energy: 1.339978440931386
Energy: 1.4256310151395244
Energy: 1.0335894115657702
Energy: 1.4256310151398839
Energy: 1.0335894115657702
Energy: 1.4256310151398839
Energy: 1.0335894115657702
Energy: 0.976962814034472
Energy: 1.036633586654426
Energy: 0.9769628140360531
Energy: 1.036633586653276
Energy: 0.9769628140340407
Energy: 1.0366335866556478
Energy: 0.9674403607660604
Energy: 1.3421685372681815
Energy: 0.9674403607672822
Energy: 1.3421685372686125
Energy: 0.9674403607680726
Energy: 1.3421685372681815
Energy: 1.3617055539119438
Energy: 1.2116916498851495
Energy: 1.3617055539170464
Energy: 1.2116916498843593
Energy: 1.36170555389218
Energy: 1.211691649885509
Energy: 0.9749667151767509
Energy: 1.2371776253320106
Energy: 0.9749667151779007
Energy: 1.2371776253335915
Energy: 0.9749667151767509
Energy: 1.2371776253335915
Energy: 1.4191938309312793
Energy: 0.9742181460465823
Energy: 1.4191938309316388
Energy: 0.974218146046223
Energy: 1.41919383093207
Energy: 0.974218146046223
Energy: 1.0317544348561611
Energy: 1.3620299162862057
Energy: 1.031754434865576
Energy: 1.3620299162929614
Energy: 1.0317544348545802
Energy: 1.3620299162869962
Energy: 1.3446909768286959
Energy: 1.0305847560949595
Energy: 1.3446909768302768
Energy: 1.030584756103224
Energy: 1.3446909768294864
Energy: 1.030584756094169
Energy: 1.0371086722558824
Energy: 0.9812586947168198
Energy: 1.0371086722543013
Energy: 0.9812586947179699
Energy: 1.037108672240862
Energy: 0.9812586947163887
Energy: 1.0285940229274286
Energy: 1.2371721584840214
Energy: 1.0285940229274286
Energy: 1.2371721584927173
Energy: 1.0285940229266382
Energy: 1.2371721584871835
Energy: 1.0433959315958594
Energy: 1.4654803259537945
Energy: 1.0433959315674
Energy: 1.4654803259530043
Energy: 1.0433959315906849
Energy: 1.4654803259537945
Energy: 1.073499881854614
Energy: 0.9726901685327619
Energy: 1.0734998818502302
Energy: 0.9726901685260783
Energy: 1.073499881853033
Energy: 0.9726901685082551
Energy: 0.9747826228391061
Energy: 1.5310806495705203
Energy: 0.9747826228394654
Energy: 1.5310806495705203
Energy: 0.9747826228398967
Energy: 1.5310806495708795
Energy: 1.2342453128798532
Energy: 1.0384512703482347
Energy: 1.2342453128715882
Energy: 1.0384512703478035
Energy: 1.2342453128672763
Energy: 1.0384512703478035
Energy: 1.0683750127655958
Energy: 1.1120517537111463
Energy: 1.068375012770339
Energy: 1.1120517537198422
Energy: 1.0683750127620741
Energy: 1.112051753723795
Energy: 1.0682147207598507
Energy: 1.1138140970647352
Energy: 1.068214720755467
Energy: 1.1138140970477026
Energy: 1.068214720755467
Energy: 1.1138140970706283
Energy: 1.2343192000047574
Energy: 1.0385059396839966
Energy: 1.234319200015825
Energy: 1.038505939683206
Energy: 1.2343192000114411
Energy: 1.038505939683206
Energy: 0.9747636011686347
Energy: 1.5310558645331467
Energy: 0.9747636011686347
Energy: 1.5310558645331467
Energy: 0.9747636011686347
Energy: 1.5310558645331467
Energy: 1.072674085095584
Energy: 0.9723455844176
Energy: 1.0726740850960153
Energy: 0.9723455844191811
Energy: 1.0726740850947936
Energy: 0.972345584424643
Energy: 1.043476243304908
Energy: 1.4654938243758873
Energy: 1.0434762433041174
Energy: 1.4654938243730844
Energy: 1.0434762433128133
Energy: 1.4654938243735156
Energy: 1.0281729324935935
Energy: 1.2416205027625082
Energy: 1.0281729324907907
Energy: 1.241620502765239
Energy: 1.0281729324907907
Energy: 1.241620502758915
Energy: 1.0351133273125181
Energy: 0.9812878307163689
Energy: 1.0351133273204236
Energy: 0.9812878307143567
Energy: 1.0351133273243764
Energy: 0.9812878307139973
Energy: 1.344784388618206
Energy: 1.0307786545231055
Energy: 1.3447843886202184
Energy: 1.0307786545242552
Energy: 1.3447843886202184
Energy: 1.0307786545207338
Energy: 1.0321735637161373
Energy: 1.3625938545340703
Energy: 1.032173563705429
Energy: 1.3625938545293272
Energy: 1.0321735637145562
Energy: 1.3625938545380232
Energy: 1.4192543468056567
Energy: 0.9742169922715291
Energy: 1.4192543468056567
Energy: 0.9742169922715291
Energy: 1.4192543468056567
Energy: 0.9742169922711699
Energy: 0.9749706012904541
Energy: 1.2372937595407876
Energy: 0.9749706012936163
Energy: 1.2372937595435904
Energy: 0.9749706012916758
Energy: 1.2372937595420093
Energy: 1.3617386723769216
Energy: 1.2115030962589515
Energy: 1.3617386723868394
Energy: 1.2115030962593107
Energy: 1.3617386723634826
Energy: 1.2115030962585203
Energy: 0.9675873406835396
Energy: 1.3421761730258657
Energy: 0.9675873406843302
Energy: 1.3421761730246438
Energy: 0.9675873406835396
Energy: 1.3421761730250752

minimum gb energy = 0.9663399538958766 eV
minimum distance =  2.26848048491966 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.3092354929918535
Energy: 1.5577102150346431
Energy: 1.3092354929918535
Energy: 1.5577102150346431
Energy: 1.412997591757796
Energy: 1.5577102150346431
Energy: 1.0092264781870552
Energy: 0.9786489626458484
Energy: 1.0092264781870552
Energy: 0.9786489626458484
Energy: 1.0092264781870552
Energy: 0.9786489626458484
Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.0232289979152531
Energy: 1.0087573779324308
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.009244756349929
Energy: 0.9786827612348133
Energy: 1.008293242067637
Energy: 1.5577102150346431
Energy: 1.008293242067637
Energy: 1.5577102150346431
Energy: 1.008293242067637
Energy: 1.5577102150346431

minimum gb energy = 0.9786489626458484 eV
minimum distance =  2.41088075145182 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.322183643459842
Energy: 1.1705671241085864
Energy: 1.322183643459842
Energy: 1.1705671241085864
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Energy: 1.2229929440505964
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Energy: 1.3124418839974161
Energy: 1.3764220809470435
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Energy: 1.1801212713329865
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Energy: 1.320209509626217
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Energy: 1.3202095096298119
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Energy: 1.2021210597035146
Energy: 1.407561505516861
Energy: 1.2021210597035146
Energy: 1.4075615055132664
Energy: 1.2021210597071095
Energy: 1.4075615055132664
Energy: 1.201595297884181
Energy: 1.2983779892154126
Energy: 1.2015952978805862
Energy: 1.2983779892118175
Energy: 1.2015952978805862
Energy: 1.2983779892154126
Energy: 1.2204633220516865
Energy: 1.2610017109503455
Energy: 1.2204633220480916
Energy: 1.2610017109503455
Energy: 1.2204633220516865
Energy: 1.2610017109503455
Energy: 1.4803893826249581
Energy: 1.2176761981405237
Energy: 1.4803893826249581
Energy: 1.2176761981405237
Energy: 1.4803893826249581
Energy: 1.2176761981405237
Energy: 1.2356931059811533
Energy: 1.4455348950070108
Energy: 1.2356931059811533
Energy: 1.4455348950070108
Energy: 1.2356931059776237
Energy: 1.4455348950070108
Energy: 1.2579506737151471
Energy: 1.2391870523951638
Energy: 1.257950673722337
Energy: 1.2391870523951638
Energy: 1.257950673718742
Energy: 1.2391870523951638
Energy: 1.3256016936340251
Energy: 1.1735466073899479
Energy: 1.3256016936376203
Energy: 1.1735466073899479
Energy: 1.3256016936340251
Energy: 1.1735466073899479
Energy: 1.4742725204954805
Energy: 1.2357883491151513
Energy: 1.4742725204954805
Energy: 1.2357883491151513
Energy: 1.4742725204954805
Energy: 1.2357883491151513
Energy: 1.2018041016650225
Energy: 1.4200309976484804
Energy: 1.2018041016578327
Energy: 1.4200309976484804
Energy: 1.2018041016614276
Energy: 1.4200309976484804
Energy: 1.1794682187716194
Energy: 1.2558336015720748
Energy: 1.1794682187716194
Energy: 1.2558336015720748
Energy: 1.1794682187680245
Energy: 1.2558336015720748
Energy: 1.2206410494455733
Energy: 1.2551372436801047
Energy: 1.2206410494491682
Energy: 1.2551372436801047
Energy: 1.2206410494455733
Energy: 1.2551372436801047
Energy: 1.3129917295979947
Energy: 1.3096120738097639
Energy: 1.3129917295979947
Energy: 1.3096120738133588
Energy: 1.3129917295979947
Energy: 1.3096120738133588
Energy: 1.2148661890971302
Energy: 1.2941961142158311
Energy: 1.2148661890935355
Energy: 1.294196114219426
Energy: 1.2148661890935355
Energy: 1.294196114219426

minimum gb energy = 1.156226648468595 eV
minimum distance =  2.19298090925229 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.244658137761601
Energy: 1.2316106955982407
Energy: 1.1975429047653199
Energy: 1.2316106955982407
Energy: 1.2446581377620947
Energy: 1.2316106955918265
Energy: 1.1505855142709527
Energy: 1.2485655733296805
Energy: 1.1505855142684855
Energy: 1.2485655733291872
Energy: 1.1505855142709527
Energy: 1.2485655733257335
Energy: 1.3704652513765185
Energy: 1.3715786161531986
Energy: 1.3369192116246487
Energy: 1.3715786161527053
Energy: 1.370465251377012
Energy: 1.371578616164053
Energy: 1.1994559929679098
Energy: 1.2985410101936228
Energy: 1.1994559929772848
Energy: 1.2985410101936228
Energy: 1.1994559929674165
Energy: 1.2985410101911559
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Energy: 1.0927268662502985
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Energy: 1.092726866245858
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Energy: 1.092726866243391
Energy: 1.230517215043049
Energy: 1.1979497467729463
Energy: 1.2305172150425556
Energy: 1.1979497467734397
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Energy: 1.19794974677492
Energy: 1.314527409758684
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Energy: 1.2638210318669891
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Energy: 1.2311330531982498
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Energy: 1.180432526289982
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Energy: 1.180432526289982
Energy: 1.14909380769444
Energy: 1.1804325262914621
Energy: 1.2639798964603202
Energy: 1.4005769216602602
Energy: 1.2639798964632807
Energy: 1.4005769216602602
Energy: 1.263979896461307
Energy: 1.4005769216681543
Energy: 1.3922053122715157
Energy: 1.2369519716623
Energy: 1.392205312270529
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Energy: 1.3922053122715157
Energy: 1.2369519716692075
Energy: 1.1781576649350138
Energy: 1.127446449933736
Energy: 1.1781576649374808
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Energy: 1.1781576649345205
Energy: 1.1274464499401502
Energy: 1.2353052027479847
Energy: 1.200348449522378
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Energy: 1.2003484495278054
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Energy: 1.2588182536026986
Energy: 1.369367843525471
Energy: 1.3426611575863652
Energy: 1.369367843521524
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Energy: 1.369367843525471
Energy: 1.3426611575770355
Energy: 1.303885127949775
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Energy: 1.3038851279507617
Energy: 1.2521740781538007
Energy: 1.303885127949775
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Energy: 1.219152594492462
Energy: 1.1820557546750186
Energy: 1.219152594493942
Energy: 1.1820557546750186
Energy: 1.2191525944929553
Energy: 1.182055754671565
Energy: 1.2491945699020688
Energy: 1.1860719551752326
Energy: 1.1985549444508605
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Energy: 1.2491945699020688
Energy: 1.1860719551762193
Energy: 1.2456006497939005
Energy: 1.2368608951984768
Energy: 1.2040226580315714
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Energy: 1.179185838590266
Energy: 1.26203523992862
Energy: 1.1791858385996405
Energy: 1.253788920976051
Energy: 1.3021135498506449
Energy: 1.253788920976051
Energy: 1.3021135498506449
Energy: 1.253788920976051
Energy: 1.3021135498501515
Energy: 1.3567503855496692
Energy: 1.35012772939147
Energy: 1.356750385547202
Energy: 1.35012772939147
Energy: 1.3567503855491756
Energy: 1.3501277293870293
Energy: 1.157264389665892
Energy: 1.2231076048779181
Energy: 1.157264389668359
Energy: 1.2231076048779181
Energy: 1.157264389665892
Energy: 1.2231076048779181
Energy: 1.2350621917720064
Energy: 1.2003621057714904
Energy: 1.2350621917690459
Energy: 1.2003621057714904
Energy: 1.2350621917724998
Energy: 1.2003621057749445
Energy: 1.2420291237637986
Energy: 1.1500909222819777
Energy: 1.2420451014287723
Energy: 1.1500909222819777
Energy: 1.2420291237637986
Energy: 1.150090922276057
Energy: 1.4007526844701061
Energy: 1.2179171688290789
Energy: 1.4007526844740532
Energy: 1.2179171688295722
Energy: 1.4007526844701061
Energy: 1.2179171688275987
Energy: 1.2996369217498835
Energy: 1.3918426751184754
Energy: 1.2996369217543242
Energy: 1.3918426751184754
Energy: 1.2996369217498835
Energy: 1.391842675112061
Energy: 1.0935787717803411
Energy: 1.1800896308354691
Energy: 1.0935787717793544
Energy: 1.1800896308354691
Energy: 1.0935787717798477
Energy: 1.180089630830535
Energy: 1.201647318583615
Energy: 1.2311780467429772
Energy: 1.2016473185757206
Energy: 1.2311780467434705
Energy: 1.2016473185841083
Energy: 1.2311780467380429
Energy: 1.2046738882987114
Energy: 1.3202875849121467
Energy: 1.2046738882932841
Energy: 1.3202875849121467
Energy: 1.204673888298218
Energy: 1.3202875849042524
Energy: 1.3023222994294492
Energy: 1.4521868768789956
Energy: 1.302346509905892
Energy: 1.4521868768789956
Energy: 1.3023222994294492
Energy: 1.4521868768735684
Energy: 1.2510438599555627
Energy: 1.299302535460673
Energy: 1.2510438599511218
Energy: 1.299302535460673
Energy: 1.2510438599555627
Energy: 1.299302535464127
Energy: 1.1775437598607736
Energy: 1.2174764598841539
Energy: 1.1775437598543594
Energy: 1.2174764598871142
Energy: 1.1775437598602803
Energy: 1.2174764598841539
Energy: 1.184893260559562
Energy: 1.2024788821727923
Energy: 1.1848932605620288
Energy: 1.202478882172299
Energy: 1.1848932605590685
Energy: 1.2024788821668715

minimum gb energy = 1.092726866243391 eV
minimum distance =  2.29391086326923 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.339016962425683
Energy: 1.1444639286503067
Energy: 1.3390169624238646
Energy: 1.1444639286503067
Energy: 1.339016962425077
Energy: 1.1444639286503067
Energy: 1.298286599439305
Energy: 1.2094861205406433
Energy: 1.2982865994399106
Energy: 1.2094861205400373
Energy: 1.2982865994399106
Energy: 1.2094861205400373
Energy: 1.2315811302637292
Energy: 1.3621521701234436
Energy: 1.1848981412693593
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Energy: 1.2315811302697897
Energy: 1.3621521701240495
Energy: 1.2809145782674891
Energy: 1.217034706265213
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Energy: 1.217034706265819
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Energy: 1.2081443805259016
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Energy: 1.2960612761118322
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Energy: 1.2656535736241885
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Energy: 1.2443913319286741
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Energy: 1.2392532698643284
Energy: 1.179540333944846
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Energy: 1.2392532698649068
Energy: 1.179540333945452
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Energy: 1.1902108118406647
Energy: 1.2986327779034792
Energy: 1.1902108118412706
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Energy: 1.2063704814294538
Energy: 1.3996036414742117
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Energy: 1.2063704814294538
Energy: 1.3996036414736055
Energy: 1.2465355604486603
Energy: 1.213896636024456
Energy: 1.2465355604492665
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Energy: 1.2465355604492665
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Energy: 1.23023373263419
Energy: 1.2071039423195713
Energy: 1.23023373263419
Energy: 1.2071039423195713
Energy: 1.23023373263419
Energy: 1.2071039423195713
Energy: 1.2557552641875416
Energy: 1.2105449438110771
Energy: 1.2557552641881475
Energy: 1.2105449438110771
Energy: 1.2557552641881475
Energy: 1.2105449438110771
Energy: 1.4323234017923272
Energy: 1.2034898173614943
Energy: 1.432323401790509
Energy: 1.2034898173614943
Energy: 1.4323234017917212
Energy: 1.2034898173614943
Energy: 1.4523886222088769
Energy: 1.1757938391498974
Energy: 1.4523886222088769
Energy: 1.1757938391505036
Energy: 1.4523886222082707
Energy: 1.1757938391505036
Energy: 1.2523765444742798
Energy: 1.2083297454976811
Energy: 1.252376544474886
Energy: 1.2083297454976811
Energy: 1.2523765444742798
Energy: 1.2083297454976811
Energy: 1.231896478916428
Energy: 1.2537369030173429
Energy: 1.231896478916428
Energy: 1.2537369030179488
Energy: 1.2318964789158218
Energy: 1.2537369030173429
Energy: 1.3229769504572202
Energy: 1.1877372241421449
Energy: 1.3229769504566142
Energy: 1.1877372241421449
Energy: 1.3229769504566142
Energy: 1.1877372241421449
Energy: 1.2070187772508842
Energy: 1.3420017842844925
Energy: 1.2070187772490664
Energy: 1.3420017842844925
Energy: 1.2070187772514904
Energy: 1.3420017842844925
Energy: 1.1914039420792895
Energy: 1.2971716606568744
Energy: 1.1914039420792895
Energy: 1.2971716606568744
Energy: 1.1914039420786833
Energy: 1.2971716606568744
Energy: 1.2396130187887409
Energy: 1.174491341943516
Energy: 1.2396130187875287
Energy: 1.174491341943516
Energy: 1.2396130187881345
Energy: 1.174491341943516
Energy: 1.3979549243976066
Energy: 1.225466565983744
Energy: 1.3979549243976066
Energy: 1.225466565983744
Energy: 1.3979549243970002
Energy: 1.225466565983744
Energy: 1.2247392526449516
Energy: 1.279989593910379
Energy: 1.2247392526449516
Energy: 1.279989593910379
Energy: 1.2247392526449516
Energy: 1.2799895939097727
Energy: 1.2425741205767054
Energy: 1.1659012651970109
Energy: 1.2425741205761267
Energy: 1.1659012651970109
Energy: 1.2425741205767054
Energy: 1.1659012651970109
Energy: 1.2395412312358527
Energy: 1.2054581697377758
Energy: 1.2395412312334284
Energy: 1.2054581697377758
Energy: 1.2395412312358527
Energy: 1.2054581697377758
Energy: 1.366338664355876
Energy: 1.4135215284385034
Energy: 1.36633866435527
Energy: 1.4135215284385034
Energy: 1.366338664355876
Energy: 1.4135215284385034
Energy: 1.1956511064865285
Energy: 1.2962609171275958
Energy: 1.1956511064865285
Energy: 1.2962609171269899
Energy: 1.1956511064865285
Energy: 1.2962609171269899

minimum gb energy = 1.1444639286503067 eV
minimum distance =  2.25671199949217 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.2293041956798596
Energy: 1.0993467567707584
Energy: 1.2293041956798596
Energy: 1.0993467567707584
Energy: 1.2293041956798596
Energy: 1.0993467567715434
Energy: 1.1731668627288965
Energy: 1.1233420190383383
Energy: 1.1731668627296812
Energy: 1.1233420190383383
Energy: 1.1731668627296812
Energy: 1.123342019039123
Energy: 1.1785390256179795
Energy: 1.319064825181391
Energy: 1.1785390256187644
Energy: 1.319064825181391
Energy: 1.1785390256179795
Energy: 1.3190648251806065
Energy: 1.3129513546586378
Energy: 1.1746741895986075
Energy: 1.312951354657853
Energy: 1.1746741895986075
Energy: 1.3129513546586378
Energy: 1.1746741895986075
Energy: 1.4045009146727978
Energy: 1.1791626500864039
Energy: 1.4045009146727978
Energy: 1.1791626500864039
Energy: 1.4045009146735825
Energy: 1.1791626500864039
Energy: 1.1807557246775056
Energy: 1.124612755078709
Energy: 1.18075572467829
Energy: 1.124612755078709
Energy: 1.1807557246775056
Energy: 1.1246127550779244
Energy: 1.2751290259323018
Energy: 1.2554950233680486
Energy: 1.2751290259330865
Energy: 1.255495023367264
Energy: 1.2751290259323018
Energy: 1.2554950233680486
Energy: 1.2325489614599492
Energy: 1.1036796593411313
Energy: 1.232548961460734
Energy: 1.1036796593411313
Energy: 1.2325489614599492
Energy: 1.1036796593411313
Energy: 1.2815939996600685
Energy: 1.1289850969866564
Energy: 1.2815939996600685
Energy: 1.1289850969866564
Energy: 1.2815939996600685
Energy: 1.1289850969866564
Energy: 1.0475562672108611
Energy: 1.1907724435337241
Energy: 1.0475562672100767
Energy: 1.1907724435337241
Energy: 1.0475562672108611
Energy: 1.1907724435337241
Energy: 1.2236158491774098
Energy: 1.1756730500803345
Energy: 1.2236158491781945
Energy: 1.1756730500803345
Energy: 1.2236158491774098
Energy: 1.1756730500803345
Energy: 1.290187339702086
Energy: 1.1734229081060743
Energy: 1.290187339702871
Energy: 1.1734229081060743
Energy: 1.290187339702871
Energy: 1.1734229081060743
Energy: 1.1515911127042904
Energy: 1.1290536779185163
Energy: 1.1515911127035057
Energy: 1.1290536779177316
Energy: 1.1515911127035057
Energy: 1.1290536779177316
Energy: 1.3039447442483671
Energy: 1.105112482047817
Energy: 1.3039447442483671
Energy: 1.105112482047817
Energy: 1.3039447442483671
Energy: 1.105112482047817
Energy: 1.3406091167810381
Energy: 1.1096878931055496
Energy: 1.3406091167802534
Energy: 1.1096878931055496
Energy: 1.3406091167802534
Energy: 1.1096878931063343
Energy: 1.301421411159004
Energy: 1.1218847031610912
Energy: 1.3014214111582194
Energy: 1.1218847031610912
Energy: 1.301421411159004
Energy: 1.1218847031610912
Energy: 1.1350237152930052
Energy: 1.1719196689103375
Energy: 1.1350237152945748
Energy: 1.171919668911122
Energy: 1.1350237152953595
Energy: 1.171919668911122
Energy: 1.2282497135937709
Energy: 1.2257151605224499
Energy: 1.2282497135937709
Energy: 1.2257151605224499
Energy: 1.2282497135937709
Energy: 1.2257151605224499
Energy: 1.134811418938529
Energy: 1.172072332438654
Energy: 1.1348114189377443
Energy: 1.1720723324378692
Energy: 1.1348114189400986
Energy: 1.1720723324370848
Energy: 1.301783678027099
Energy: 1.1218714953484235
Energy: 1.301783678027099
Energy: 1.1218714953484235
Energy: 1.3017836780278838
Energy: 1.1218714953484235
Energy: 1.3407261235419312
Energy: 1.1099873615060145
Energy: 1.3407261235419312
Energy: 1.1099873615060145
Energy: 1.3407261235435006
Energy: 1.1099873615060145
Energy: 1.3039269989480877
Energy: 1.2958203677924462
Energy: 1.3039269989480877
Energy: 1.2958203677924462
Energy: 1.3039269989480877
Energy: 1.2958203677924462
Energy: 1.1516750236920676
Energy: 1.1290826244665366
Energy: 1.1516750236928524
Energy: 1.1290826244665366
Energy: 1.1516750236928524
Energy: 1.129082624465752
Energy: 1.2902371977848468
Energy: 1.1734146400207737
Energy: 1.290237197784062
Energy: 1.1734146400207737
Energy: 1.290237197784062
Energy: 1.1734146400207737

minimum gb energy = 1.0475562672100767 eV
minimum distance =  2.30899020760463 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.2242780886988833
Energy: 1.0871451671754775
Energy: 1.2242780886999927
Energy: 1.0871451671754775
Energy: 1.2242780886988833
Energy: 1.0871451671754775
Energy: 1.0948009222198167
Energy: 1.142215873279653
Energy: 1.0948009222209263
Energy: 1.142215873279653
Energy: 1.0948009222209263
Energy: 1.142215873279653
Energy: 1.0999610524906753
Energy: 1.3010957382226362
Energy: 1.0999610524906753
Energy: 1.3010957382226362
Energy: 1.0999610524906753
Energy: 1.3010957382215262
Energy: 1.1400130281380594
Energy: 1.1928210801371284
Energy: 1.1400130281380594
Energy: 1.1928210801382384
Energy: 1.140013028139169
Energy: 1.1928210801371284
Energy: 1.1512658813671794
Energy: 1.1553340846857034
Energy: 1.1512658813671794
Energy: 1.1553340846857034
Energy: 1.1512658813671794
Energy: 1.1553340846857034
Energy: 1.1772076503383122
Energy: 1.147766905087926
Energy: 1.1772076503383122
Energy: 1.1477669050890358
Energy: 1.1772076503383122
Energy: 1.1477669050890358
Energy: 1.0957710079720109
Energy: 1.1564662168018804
Energy: 1.0957710079731207
Energy: 1.1564662168018804
Energy: 1.0957710079720109
Energy: 1.15646621680299
Energy: 1.140029286735134
Energy: 1.182387418996808
Energy: 1.140029286735134
Energy: 1.182387418996808
Energy: 1.1400292867362438
Energy: 1.182387418996808
Energy: 1.0384099011688972
Energy: 1.1389066537674715
Energy: 1.0384099011688972
Energy: 1.1389066537674715
Energy: 1.0384099011700072
Energy: 1.1389066537674715
Energy: 1.1924401557105042
Energy: 1.1055761793552192
Energy: 1.1924401557105042
Energy: 1.1055761793552192
Energy: 1.1924401557105042
Energy: 1.1055761793552192
Energy: 1.1905726573086242
Energy: 1.1077075629686852
Energy: 1.1905726573086242
Energy: 1.1077075629686852
Energy: 1.1905726573086242
Energy: 1.107707562969795
Energy: 1.1710268302602154
Energy: 1.1687815749861217
Energy: 1.1710268302602154
Energy: 1.1687815749861217
Energy: 1.1710268302602154
Energy: 1.1687815749861217
Energy: 1.1150506670301135
Energy: 1.1971885029535345
Energy: 1.1150506670301135
Energy: 1.1971885029535345
Energy: 1.1150506670301135
Energy: 1.1971885029535345
Energy: 1.0935368493468354
Energy: 1.0476687160086222
Energy: 1.0935368493479452
Energy: 1.0476687160075124
Energy: 1.0935368493468354
Energy: 1.0476687160075124
Energy: 1.1220990285689827
Energy: 1.1879806417311638
Energy: 1.122099028567873
Energy: 1.1879806417311638
Energy: 1.1220990285689827
Energy: 1.1879806417311638
Energy: 1.1777277491391613
Energy: 1.3222233537838395
Energy: 1.1777277491402711
Energy: 1.3222233537838395
Energy: 1.1777277491402711
Energy: 1.3222233537838395
Energy: 1.0933700647868239
Energy: 1.0488704814672434
Energy: 1.0933700647868239
Energy: 1.0488704814672434
Energy: 1.0933700647868239
Energy: 1.0488704814661336

minimum gb energy = 1.0384099011688972 eV
minimum distance =  2.2900317193231 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.1765046776948638
Energy: 0.969512458049397
Energy: 1.1765046776948638
Energy: 0.969512458049397
Energy: 1.1765046776944355
Energy: 0.969512458049397
Energy: 1.0578963305133322
Energy: 1.1078040917988798
Energy: 1.0578963305129037
Energy: 1.1078040918010226
Energy: 1.0578963305124751
Energy: 1.1078040918005942
Energy: 0.981346468789716
Energy: 1.046920626704354
Energy: 0.981346468789716
Energy: 1.046920626704354
Energy: 0.9813464687914303
Energy: 1.046920626704354
Energy: 1.0916255433734836
Energy: 0.9825537487590227
Energy: 1.091625543374769
Energy: 0.9825537487594512
Energy: 1.0916255433734836
Energy: 0.9825537487590227
Energy: 1.0452768213563957
Energy: 1.0443157347834806
Energy: 1.0452768213563957
Energy: 1.0443157347834806
Energy: 1.0452768213572528
Energy: 1.0443157347830518
Energy: 0.9448083632533478
Energy: 0.9529917303857875
Energy: 0.9448083632512051
Energy: 0.952991730385359
Energy: 0.9448083632524907
Energy: 0.952991730385359
Energy: 1.1650674007499502
Energy: 1.0567867210950963
Energy: 1.1650674007482362
Energy: 1.0567867210955249
Energy: 1.1650674007490933
Energy: 1.0567867210955249
Energy: 1.0973319952048284
Energy: 1.138688191095901
Energy: 1.0973319952056855
Energy: 1.138688191095901
Energy: 1.0973319952048284
Energy: 1.138688191095901
Energy: 1.0632371028486316
Energy: 1.2023967567748168
Energy: 1.0632371028486316
Energy: 1.2023967567748168
Energy: 1.063237102848203
Energy: 1.2023967567748168
Energy: 1.060326991878974
Energy: 1.0163180818759687
Energy: 1.060326991878974
Energy: 1.0163180818759687
Energy: 1.0603269918772595
Energy: 1.0163180818759687
Energy: 1.0959023827738013
Energy: 1.121217495964139
Energy: 1.0959023827729444
Energy: 1.121217495964139
Energy: 1.095902382775087
Energy: 1.121217495964139
Energy: 0.9879620723775916
Energy: 1.1484511380162934
Energy: 0.9879620723775916
Energy: 1.1484511380162934
Energy: 0.9879620723797344
Energy: 1.1484511380167217
Energy: 1.1026236040594908
Energy: 1.0679499866889959
Energy: 1.102623604060348
Energy: 1.0679499866889959
Energy: 1.1026236040607764
Energy: 1.0679499866889959
Energy: 1.110161370187007
Energy: 1.0142059633598288
Energy: 1.1101613701861501
Energy: 1.0142059633598288
Energy: 1.1101613701857214
Energy: 1.0142059633598288
Energy: 1.10968177457923
Energy: 1.1283847731645988
Energy: 1.109681774578373
Energy: 1.1283847731654557
Energy: 1.10968177457923
Energy: 1.1283847731650274
Energy: 1.0384594616147105
Energy: 1.1246539478634259
Energy: 1.0384594616142822
Energy: 1.1246539478642832
Energy: 1.0384594616142822
Energy: 1.0770203725306047
Energy: 1.1156209681071603
Energy: 0.9350345717344326
Energy: 1.1156209681088742
Energy: 0.9350345717344326
Energy: 1.115620968108446
Energy: 0.935034571734861
Energy: 1.0697130620479707
Energy: 1.139746400549842
Energy: 1.0697130620471138
Energy: 1.139746400549842
Energy: 1.0697130620462565
Energy: 1.139746400549842
Energy: 1.0760377105179253
Energy: 1.0761433317140634
Energy: 1.0760377105192107
Energy: 1.0761433317140634
Energy: 1.0760377105209251
Energy: 1.076143331714492
Energy: 1.0017434326740393
Energy: 0.9226143266423937
Energy: 1.001743432671468
Energy: 0.9226143266428223
Energy: 1.0017434326731822
Energy: 0.9226143266423937
Energy: 1.075980971155
Energy: 1.0762201801800488
Energy: 1.075980971155857
Energy: 1.0762201801791917
Energy: 1.0759809711554285
Energy: 1.0762201801791917
Energy: 1.0696902841891525
Energy: 1.1397498667860841
Energy: 1.0696902841874383
Energy: 1.1397498667865127
Energy: 1.0696902841882956
Energy: 1.1397498667865127
Energy: 1.1122575989447114
Energy: 0.9350504218378319
Energy: 1.112257598940426
Energy: 0.9350504218374035
Energy: 1.1122575989429972
Energy: 0.9350504218378319
Energy: 1.0386759044412033
Energy: 1.126145154833469
Energy: 1.0386759044399176
Energy: 1.126145154833469
Energy: 1.0386759044407747
Energy: 1.126145154833469
Energy: 1.1119401176644883
Energy: 1.1285632758900996
Energy: 1.1119401176627743
Energy: 1.1285632758900996
Energy: 1.1119401176644883
Energy: 1.1285632758900996
Energy: 1.1104197584382052
Energy: 1.0143074374994825
Energy: 1.1104197584407764
Energy: 1.014307437499054
Energy: 1.1104197584386337
Energy: 1.014307437499054
Energy: 1.1029321729010413
Energy: 1.0678077492816098
Energy: 1.1029321729001842
Energy: 1.0678077492816098
Energy: 1.1029321729006127
Energy: 1.0678077492816098
Energy: 0.9879581143219265
Energy: 1.1481903568419214
Energy: 0.987958114321498
Energy: 1.14819035684235
Energy: 0.9879581143219265
Energy: 1.1481903568419214
Energy: 1.096259546130642
Energy: 1.1212577305941809
Energy: 1.0962595461310702
Energy: 1.1212577305941809
Energy: 1.0962595461302134
Energy: 1.1212577305941809
Energy: 1.0603505714914858
Energy: 0.9636845416843334
Energy: 1.0603505714902002
Energy: 0.9636845416847619
Energy: 1.0603505714906287
Energy: 0.9636845416843334
Energy: 1.0630304034408375
Energy: 1.201524474483872
Energy: 1.063030403442552
Energy: 1.2015244744843003
Energy: 1.063030403441266
Energy: 1.2015244744830145
Energy: 1.0972990620995795
Energy: 1.138612480342558
Energy: 1.0972990620974368
Energy: 1.1386124803421291
Energy: 1.0972990621004364
Energy: 1.1386124803421291
Energy: 1.165576990070227
Energy: 1.0579298362672664
Energy: 1.1655769900715127
Energy: 1.0579298362676948
Energy: 1.1655769900706556
Energy: 1.0579298362676948
Energy: 0.9441952412489543
Energy: 0.9651468056230912
Energy: 0.9441952412519541
Energy: 0.9651468056235197
Energy: 0.9441952412493829
Energy: 0.9651468056235197
Energy: 1.0451094198715543
Energy: 1.039512503524081
Energy: 1.045109419873697
Energy: 1.0395125035245096
Energy: 1.0451094198724113
Energy: 1.0395125035245096
Energy: 1.0918158275435228
Energy: 0.9354205715743267
Energy: 1.0918158275435228
Energy: 0.9354205715743267
Energy: 1.0918158275435228
Energy: 0.9354205715743267
Energy: 0.9814655685692577
Energy: 1.046916814732432
Energy: 0.981465568567115
Energy: 1.0469168147320032
Energy: 0.9814655685675436
Energy: 1.0469168147320032
Energy: 1.0576067581204323
Energy: 1.0540384776622718
Energy: 1.0576067581217177
Energy: 1.0540384776622718
Energy: 1.0576067581200035
Energy: 1.0540384776622718
Energy: 1.1765046776970065
Energy: 0.9695124580515398
Energy: 1.176504677697435
Energy: 0.9695124580515398
Energy: 1.176504677696578
Energy: 0.9695124580515398
Energy: 1.0578963305197213
Energy: 1.0444156823022834
Energy: 1.05789633052015
Energy: 1.0444156823027122
Energy: 1.05789633052015
Energy: 1.0444156823027122
Energy: 0.9813464687918587
Energy: 1.04692062670264
Energy: 0.981346468790573
Energy: 1.0469206267030684
Energy: 0.9813464687914303
Energy: 1.0469206267030684
Energy: 1.091625543374769
Energy: 0.9669924041274397
Energy: 1.0916255433743407
Energy: 0.9669924041274397
Energy: 1.0916255433751978
Energy: 0.9669924041270113
Energy: 1.0452768213572528
Energy: 1.0443157347804806
Energy: 1.0452768213568242
Energy: 1.044315734780909
Energy: 1.0452768213585382
Energy: 1.044315734780052

minimum gb energy = 0.9226143266423937 eV
minimum distance =  2.28741615963019 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.1287768079476659
Energy: 1.0732530421788269
Energy: 1.1287768079455727
Energy: 1.0732530421781292
Energy: 1.1287768079483638
Energy: 1.0732530421788269
Energy: 0.9653415503199193
Energy: 0.9851630079474989
Energy: 0.9653415503227104
Energy: 0.9851630079468011
Energy: 0.9653415503213147
Energy: 0.9851630079474989
Energy: 0.9435950684655285
Energy: 0.984294298757521
Energy: 0.9435950684634352
Energy: 0.984294298757521
Energy: 0.9435950684641331
Energy: 0.984294298757521
Energy: 1.0524981443069856
Energy: 0.884882103034448
Energy: 1.0524981443083812
Energy: 0.884882103034448
Energy: 1.0524981443069856
Energy: 0.884882103034448
Energy: 0.966382105207438
Energy: 0.9563516111416168
Energy: 0.9663821052067402
Energy: 0.9563516111416168
Energy: 0.966382105207438
Energy: 0.9563516111416168
Energy: 0.8795386097085409
Energy: 0.888214707116233
Energy: 0.8795386097099365
Energy: 0.888214707116233
Energy: 0.8795386097085409
Energy: 0.8882147071155351
Energy: 1.0633140737639781
Energy: 0.9880911108457363
Energy: 1.0633140737688624
Energy: 0.9880911108457363
Energy: 1.0633140737626459
Energy: 0.9880911108464341
Energy: 1.0306165655527566
Energy: 1.0502575198759716
Energy: 1.0306165655534543
Energy: 1.0502575198766695
Energy: 1.030616565551361
Energy: 1.0502575198759716
Energy: 0.9461590891041403
Energy: 0.88963695737405
Energy: 0.9461590891069314
Energy: 0.8896369573733521
Energy: 0.9461590891055357
Energy: 0.8896369573733521
Energy: 0.9871762886692208
Energy: 0.9682828994515171
Energy: 0.987176288672012
Energy: 0.9682828994515171
Energy: 0.987176288668523
Energy: 0.9682828994515171
Energy: 1.020971602575302
Energy: 1.0785150982648082
Energy: 1.0209716025718767
Energy: 1.0785150982648082
Energy: 1.0209716025725744
Energy: 1.0785150982648082
Energy: 0.8626099120484664
Energy: 1.0489179311164023
Energy: 0.8626099120491642
Energy: 1.0489179311164023
Energy: 0.8626099120463732
Energy: 1.0489179311157044
Energy: 0.9844247110062709
Energy: 0.9249172880024765
Energy: 0.9844247110062709
Energy: 0.9249172880024765
Energy: 0.9844247110055734
Energy: 0.9249172880017789
Energy: 1.0730560571223757
Energy: 0.9998427839238179
Energy: 1.0730560571223757
Energy: 0.9998427839238179
Energy: 1.0730560571237715
Energy: 0.9998427839238179
Energy: 0.9218500130554228
Energy: 1.1002827126680947
Energy: 0.9218500130561207
Energy: 1.1002827126680947
Energy: 0.9218500130568185
Energy: 1.1002827126687924
Energy: 1.0076373282331503
Energy: 0.9838664311887779
Energy: 1.0076373282345459
Energy: 0.9838664311894757
Energy: 1.0076373282331503
Energy: 0.9838664311894757
Energy: 1.0474214572987584
Energy: 0.9783340205033837
Energy: 1.0474214572966651
Energy: 0.9783340205033837
Energy: 1.0474214572987584
Energy: 0.9783340205033837
Energy: 1.0346109507561556
Energy: 1.0865170244813092
Energy: 1.0346109507561556
Energy: 1.0865170244813092
Energy: 1.0346109507568535
Energy: 1.0865170244806115
Energy: 0.9829731617651024
Energy: 1.0193221577768845
Energy: 0.9829731617658002
Energy: 1.019322157777582
Energy: 0.9829731617651024
Energy: 1.019322157777582
Energy: 0.9846944321130727
Energy: 0.8848961510761193
Energy: 0.984694432112375
Energy: 0.8848961510768172
Energy: 0.984694432115166
Energy: 0.8848961510768172
Energy: 0.9962400252170879
Energy: 1.073541425253423
Energy: 0.9962400252156922
Energy: 1.0735414252541209
Energy: 0.9962400252170879
Energy: 1.0735414252541209
Energy: 0.9693899362282314
Energy: 1.0188361733474214
Energy: 0.9693899362282314
Energy: 1.0188361733481193
Energy: 0.9693899362282314
Energy: 1.0188361733474214
Energy: 0.9310149956938956
Energy: 0.8582912119027009
Energy: 0.9310149956959888
Energy: 0.8582912119027009
Energy: 0.931014995695291
Energy: 0.8582912119027009
Energy: 0.974343296946427
Energy: 1.1191202797502864
Energy: 0.9743432969485203
Energy: 1.1191202797495885
Energy: 0.9743432969478224
Energy: 1.1191202797495885
Energy: 0.9914208084877563
Energy: 1.0631545046592805
Energy: 0.9914208084898496
Energy: 1.0631545046585829
Energy: 0.9914208084877563
Energy: 1.0631545046585829
Energy: 0.9032665884747281
Energy: 0.858427260753886
Energy: 0.9032665884768213
Energy: 0.858427260753886
Energy: 0.9032665884740302
Energy: 0.8584272607545839
Energy: 0.9398622270418642
Energy: 1.0180549171626017
Energy: 0.9398622270432598
Energy: 1.0180549171626017
Energy: 0.9398622270432598
Energy: 1.0180549171632995

minimum gb energy = 0.8582912119027009 eV
minimum distance =  2.25312593338448 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 1.071906983079055
Energy: 0.9512870275699253
Energy: 1.0719069830795633
Energy: 0.9512870275699253
Energy: 1.071906983079055
Energy: 0.9512870275699253
Energy: 0.8623894756996574
Energy: 0.9165624520351937
Energy: 0.8623894756976238
Energy: 0.9165624520346853
Energy: 0.8623894757001658
Energy: 0.9165624520346853
Energy: 0.8343951464474598
Energy: 0.9157994183388776
Energy: 0.8343951464459346
Energy: 0.9157994183393859
Energy: 0.8343951464484766
Energy: 0.9157994183393859
Energy: 1.0158060873544228
Energy: 0.7834222955108151
Energy: 1.0158060873544228
Energy: 0.7834222955108151
Energy: 1.0158060873549313
Energy: 0.7834222955113236
Energy: 0.8532475267345686
Energy: 0.9468104300127667
Energy: 0.8532475267375728
Energy: 0.9468104300127667
Energy: 0.8532475267375728
Energy: 0.9468104300127667
Energy: 0.7664595029808524
Energy: 0.8867257496465614
Energy: 0.7664595029823777
Energy: 0.8867257496465614
Energy: 0.7664595029808524
Energy: 0.8867257496465614
Energy: 0.9592797600843221
Energy: 0.8435421999259543
Energy: 0.9592797600848306
Energy: 0.8435421999264627
Energy: 0.9592797600848306
Energy: 0.8435421999264627
Energy: 0.8550149073009226
Energy: 0.9370558134256624
Energy: 0.8550149073024478
Energy: 0.9370558134256624
Energy: 0.8550149073019393
Energy: 0.9370558134256624
Energy: 0.7317881024368634
Energy: 0.8612533152325516
Energy: 0.7317881024358466
Energy: 0.8612533152325516
Energy: 0.7317881024373718
Energy: 0.8612533152325516
Energy: 0.9961795587214747
Energy: 0.8196237328281032
Energy: 0.9961795587214747
Energy: 0.8196237328281032
Energy: 0.9961795587214747
Energy: 0.8196237328281032
Energy: 0.9265782645315774
Energy: 0.9290793091358258
Energy: 0.9265782645331027
Energy: 0.9290793091358258
Energy: 0.9265782645331027
Energy: 0.9290793091358258
Energy: 0.8008207640829322
Energy: 0.8605143230033137
Energy: 0.8008207640829322
Energy: 0.8605143230028053
Energy: 0.8008207640834406
Energy: 0.8605143230028053
Energy: 0.8739523414031283
Energy: 0.7930137829347988
Energy: 0.8739523414036366
Energy: 0.7930137829353073
Energy: 0.8739523414031283
Energy: 0.7930137829347988
Energy: 0.9256519217254412
Energy: 0.9408308978791255
Energy: 0.9256519217244243
Energy: 0.9408308978791255
Energy: 0.9256519217244243
Energy: 0.9408308978791255
Energy: 0.810047538276623
Energy: 0.9998422107022916
Energy: 0.8100475382750978
Energy: 0.9998422107022916
Energy: 0.8100475382756063
Energy: 0.9998422107022916
Energy: 0.9006810617113838
Energy: 0.7592901756332384
Energy: 0.9006810617118922
Energy: 0.7592901756332384
Energy: 0.9006810617113838
Energy: 0.7592901756332384
Energy: 0.964603358510897
Energy: 0.926885079942029
Energy: 0.9646033585098801
Energy: 0.9268850799415206
Energy: 0.9646033585119137
Energy: 0.9268850799415206
Energy: 0.7483916189797499
Energy: 0.9756596754992781
Energy: 0.7483916189807668
Energy: 0.9756596754992781
Energy: 0.7483916189787332
Energy: 0.9756596754992781
Energy: 0.8859622175012655
Energy: 0.8185253218370422
Energy: 0.8859622175007571
Energy: 0.8185253218375507
Energy: 0.8859622175012655
Energy: 0.8185253218375507
Energy: 1.0032930168403014
Energy: 0.8444691789819074
Energy: 1.0032930168397929
Energy: 0.8444691789813991
Energy: 1.0032930168392844
Energy: 0.8444691789813991
Energy: 0.8088890736837705
Energy: 1.0447047262415379
Energy: 0.8088890736837705
Energy: 1.0447047262415379
Energy: 0.8088890736847872
Energy: 1.0447047262410294
Energy: 0.9251453310378537
Energy: 0.8633633688329528
Energy: 0.9251453310378537
Energy: 0.8633633688329528
Energy: 0.9251453310393788
Energy: 0.8633633688329528
Energy: 0.9455776952641354
Energy: 0.8495609379820658
Energy: 0.9455776952656605
Energy: 0.8495609379820658
Energy: 0.9455776952651521
Energy: 0.8495609379820658
Energy: 0.8963147091500552
Energy: 1.029609581027467
Energy: 0.8963147091490383
Energy: 1.029609581027467
Energy: 0.8963147091490383
Energy: 1.0296095810269588
Energy: 0.8680946526697625
Energy: 0.8459248643648987
Energy: 0.8680946526707792
Energy: 0.8459248643648987
Energy: 0.8680946526702709
Energy: 0.8459248643648987
Energy: 0.8666280486988914
Energy: 0.7806958073562673
Energy: 0.8666280486999082
Energy: 0.7806958073567757
Energy: 0.8666280486988914
Energy: 0.7806958073562673
Energy: 0.7838795475296607
Energy: 0.9616458120233615
Energy: 0.7838795475291523
Energy: 0.9616458120233615
Energy: 0.7838795475296607
Energy: 0.9616458120233615
Energy: 0.8319788131584335
Energy: 0.8273552037065591
Energy: 0.8319788131574166
Energy: 0.8273552037070675
Energy: 0.8319788131579251
Energy: 0.8273552037070675
Energy: 0.8712247219046241
Energy: 0.7356511520671124
Energy: 0.8712247219030989
Energy: 0.7356511520666039
Energy: 0.8712247219051324
Energy: 0.7356511520666039
Energy: 0.7992266150681044
Energy: 0.9162020763272963
Energy: 0.7992266150691212
Energy: 0.916202076326788
Energy: 0.799226615067596
Energy: 0.916202076326788
Energy: 0.8170158651627882
Energy: 0.9764380596081309
Energy: 0.8170158651607546
Energy: 0.9764380596086394
Energy: 0.8170158651617714
Energy: 0.9764380596081309
Energy: 0.787313901404855
Energy: 0.7217199758793181
Energy: 0.7873139014058718
Energy: 0.7217199758798265
Energy: 0.7873139014043466
Energy: 0.7217199758798265
Energy: 0.7990281818019334
Energy: 0.9658533324895501
Energy: 0.7990281818024417
Energy: 0.9658533324895501
Energy: 0.7990281818009165
Energy: 0.9658533324890417
Energy: 0.9305825400485738
Energy: 0.9502432415085569
Energy: 0.9305825400490821
Energy: 0.9502432415085569
Energy: 0.9305825400495906
Energy: 0.9502432415085569
Energy: 0.7891816422226476
Energy: 0.7863527215443307
Energy: 0.7891816422216309
Energy: 0.7863527215443307
Energy: 0.7891816422221393
Energy: 0.7863527215438223
Energy: 0.7753262156877807
Energy: 0.8442316648969026
Energy: 0.7753262156903228
Energy: 0.8442316648969026
Energy: 0.7753262156872723
Energy: 0.8442316648969026

minimum gb energy = 0.7217199758793181 eV
minimum distance =  2.23324946715034 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.07945701902765051
Energy: 0.13166807727102087
Energy: 0.07945701902578253
Energy: 0.13166807727102087
Energy: 0.07945701902765051
Energy: 0.13166807727102087
Energy: 0.41622395550593
Energy: 0.08132926363219464
Energy: 0.41622395550593
Energy: 0.08132926362845869
Energy: 0.41622395550593
Energy: 0.08132926362845869
Energy: 0.4162164086698407
Energy: 0.08137326771094984
Energy: 0.4162164086698407
Energy: 0.08137326772028974
Energy: 0.4162164086698407
Energy: 0.0813732677146858
Energy: 0.07945701902765051
Energy: 0.13166807727102087
Energy: 0.07945701902578253
Energy: 0.13166807727102087
Energy: 0.07945701902765051
Energy: 0.1316680772691529
Energy: 0.41622395550593
Energy: 0.08132926362845869
Energy: 0.41622395550593
Energy: 0.08132926363032666
Energy: 0.41622395550593
Energy: 0.08132926363219464
Energy: 0.41621640866610476
Energy: 0.08137326771281782
Energy: 0.41621640866797266
Energy: 0.08137326770908185
Energy: 0.4162164086698407
Energy: 0.08137326770908185
Energy: 0.07945701902578253
Energy: 0.13166807727102087
Energy: 0.07945701902765051
Energy: 0.13166807727102087
Energy: 0.07945701902765051
Energy: 0.13166807727102087
Energy: 0.41622395550593
Energy: 0.08132926362659071
Energy: 0.41622395550593
Energy: 0.08132926363032666
Energy: 0.41622395550593
Energy: 0.08132926362289719
Energy: 0.41621640866797266
Energy: 0.08137326769974193
Energy: 0.4162164086698407
Energy: 0.08137326769787395
Energy: 0.4162164086698407
Energy: 0.08137326769787395
Energy: 0.07945701902765051
Energy: 0.1316680772691529
Energy: 0.07945701902765051
Energy: 0.1316680772691529
Energy: 0.07945701902765051
Energy: 0.13166807727102087

minimum gb energy = 0.07945701902578253 eV
minimum distance =  2.46265987558258 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 1.0067156125041516
Energy: 0.8275576365405921
Energy: 1.0067156125047108
Energy: 0.8275576365405921
Energy: 1.0067156125035928
Energy: 0.8275576365411511
Energy: 0.8599332108182778
Energy: 0.9354868828785524
Energy: 0.8599332108177188
Energy: 0.9354868828785524
Energy: 0.8599332108182778
Energy: 0.9354868828785524
Energy: 0.9269512442591883
Energy: 0.9148511119892109
Energy: 0.9269512442608652
Energy: 0.9148511119886519
Energy: 0.8959530318706194
Energy: 0.9148511119886519
Energy: 0.9253305106949108
Energy: 0.8215137021318057
Energy: 0.9253305106926748
Energy: 0.8215137021318057
Energy: 0.9253305106937926
Energy: 0.8215137021318057
Energy: 0.8025570657277905
Energy: 0.8606646482208725
Energy: 0.8025570657272315
Energy: 0.8606646482219907
Energy: 0.8025570657261136
Energy: 0.8606646482208725
Energy: 0.9001425216289469
Energy: 0.9319649912397567
Energy: 0.9001425216278288
Energy: 0.9319649912397567
Energy: 0.9001425216295059
Energy: 0.9319649912397567
Energy: 0.8821055107693528
Energy: 0.840147783213187
Energy: 0.8821055107682346
Energy: 0.840147783213187
Energy: 0.8821055107687938
Energy: 0.840147783213187
Energy: 0.7825148023275782
Energy: 0.8607679193190099
Energy: 0.7825148023275782
Energy: 0.8607679193184508
Energy: 0.7825148023281372
Energy: 0.8607679193190099
Energy: 0.9563911336686498
Energy: 0.9103053651180194
Energy: 0.9563911336697679
Energy: 0.9103053651180194
Energy: 0.9563911336692087
Energy: 0.9103053651180194
Energy: 0.7865800147602688
Energy: 0.7758831656089276
Energy: 0.7865800147591508
Energy: 0.7758831656094866
Energy: 0.7865800147597098
Energy: 0.7758831656094866
Energy: 0.8071720976910394
Energy: 0.8431503709728287
Energy: 0.8071720976910394
Energy: 0.8431503709728287
Energy: 0.8071720976915984
Energy: 0.8431503709728287
Energy: 0.9235058499260725
Energy: 0.9489002548855644
Energy: 0.9235058499271905
Energy: 0.9489002548861233
Energy: 0.9235058499266315
Energy: 0.9489002548861233
Energy: 0.9891182446810964
Energy: 0.7740425754642831
Energy: 0.9891182446799784
Energy: 0.7740425754642831
Energy: 0.9891182446805374
Energy: 0.7740425754642831
Energy: 0.8083187419451024
Energy: 0.8509875792327788
Energy: 0.8083187419467793
Energy: 0.8509875792327788
Energy: 0.8083187419456614
Energy: 0.8509875792327788
Energy: 0.9080158373335712
Energy: 0.9408498051063785
Energy: 0.9080158373341302
Energy: 0.9408498051063785
Energy: 0.9080158373335712
Energy: 0.9408498051063785
Energy: 0.9718219999705929
Energy: 0.8016877282351716
Energy: 0.9718219999711518
Energy: 0.8016877282351716
Energy: 0.971821999971711
Energy: 0.8016877282351716
Energy: 0.8649256542427094
Energy: 0.8907059879805022
Energy: 0.8649256542432685
Energy: 0.8907059879805022
Energy: 0.8649256542427094
Energy: 0.8907059879805022
Energy: 0.9363923376479711
Energy: 0.9220777986609673
Energy: 0.9363923376496484
Energy: 0.9220777986609673
Energy: 0.9363923376496484
Energy: 0.9220777986609673
Energy: 0.939262314020267
Energy: 0.7969167568607136
Energy: 0.939262314020267
Energy: 0.7969167568607136
Energy: 0.9392623140197081
Energy: 0.7969167568607136
Energy: 0.9139269615432295
Energy: 0.9612151882425374
Energy: 0.9139269615426704
Energy: 0.9612151882425374
Energy: 0.9139269615426704
Energy: 0.9612151882425374
Energy: 0.9090290940017496
Energy: 0.8584527605596021
Energy: 0.9090290940011906
Energy: 0.858452760559043
Energy: 0.9090290940028674
Energy: 0.8584527605596021
Energy: 1.0328161428930047
Energy: 0.8751629800283991
Energy: 1.032816142894123
Energy: 0.8751629800283991
Energy: 1.0328161428930047
Energy: 0.8751629800278401
Energy: 0.8596314167379712
Energy: 0.9621128285665261
Energy: 0.8596314167385302
Energy: 0.9621128285670851
Energy: 0.8596314167379712
Energy: 0.9621128285670851
Energy: 0.921505687414626
Energy: 0.8321961343221923
Energy: 0.921505687414067
Energy: 0.8321961343221923
Energy: 0.921505687414626
Energy: 0.8321961343216333
Energy: 0.9624730459471891
Energy: 0.9032157105308084
Energy: 0.9624730459466303
Energy: 0.9032157105308084
Energy: 0.9624730459471891
Energy: 0.9032157105308084
Energy: 0.7817547491142339
Energy: 0.9544212371113815
Energy: 0.7817547491153519
Energy: 0.9544212371119405
Energy: 0.7817547491147929
Energy: 0.9544212371119405
Energy: 0.9342603877150671
Energy: 0.814227844664769
Energy: 0.9342603877161849
Energy: 0.8142278446653279
Energy: 0.9342603877156261
Energy: 0.8142278446653279
Energy: 0.8706679360139568
Energy: 0.870804431066112
Energy: 0.8706679360145158
Energy: 0.870804431065553
Energy: 0.8706679360139568
Energy: 0.870804431066112
Energy: 0.7474222003848516
Energy: 0.947361577807036
Energy: 0.7474222003837336
Energy: 0.947361577807036
Energy: 0.7474222003842926
Energy: 0.947361577807036
Energy: 0.9613353007969705
Energy: 0.8399476945954798
Energy: 0.9613353007969705
Energy: 0.8399476945954798
Energy: 0.9613353007980884
Energy: 0.8399476945954798
Energy: 0.8620087744029228
Energy: 0.873337380608443
Energy: 0.8620087744023639
Energy: 0.873337380608443
Energy: 0.8620087744029228
Energy: 0.873337380608443
Energy: 0.7795234042092954
Energy: 0.9000782716074486
Energy: 0.7795234042109724
Energy: 0.9000782716074486
Energy: 0.7795234042104136
Energy: 0.9000782716068896
Energy: 0.8837019060962009
Energy: 0.8669487665832148
Energy: 0.8837019060967599
Energy: 0.8669487665837741
Energy: 0.8837019060962009
Energy: 0.8669487665832148

minimum gb energy = 0.7474222003837336 eV
minimum distance =  2.31161474105543 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.120115191452458
Energy: 0.9943750746474914
Energy: 1.1201151914516616
Energy: 0.9943750746474914
Energy: 1.120115191452458
Energy: 0.9943750746474914
Energy: 0.9810286937294063
Energy: 1.0661325486137456
Energy: 0.9810286937286098
Energy: 1.0661325486145423
Energy: 0.9810286937286098
Energy: 1.0661325486137456
Energy: 1.1248197825992927
Energy: 1.0854445213849107
Energy: 1.1248197825992927
Energy: 1.0854445213841142
Energy: 1.1850350830774798
Energy: 1.0854445213841142
Energy: 1.0516883978287832
Energy: 0.9414001091903865
Energy: 1.0516883978287832
Energy: 0.9414001091903865
Energy: 1.0516883978287832
Energy: 0.9414001091903865
Energy: 0.9545878048830824
Energy: 0.9485239466371935
Energy: 0.9545878048830824
Energy: 0.94852394663799
Energy: 0.9545878048814893
Energy: 0.9485239466387865
Energy: 1.0249809165359152
Energy: 1.043994764574756
Energy: 1.0249809165367116
Energy: 1.0439947645739593
Energy: 1.0249809165359152
Energy: 1.043994764574756
Energy: 0.9706866536717357
Energy: 0.9624026355817462
Energy: 0.9706866536717357
Energy: 0.9624026355817462
Energy: 0.9706866536717357
Energy: 0.9624026355817462
Energy: 1.0119636999425585
Energy: 0.9446493626116998
Energy: 1.0119636999441517
Energy: 0.9446493626116998
Energy: 1.011963699941762
Energy: 0.9446493626116998
Energy: 1.0597317659948313
Energy: 1.0923474204520236
Energy: 1.0597317659940348
Energy: 1.0923474204520236
Energy: 1.0597317659948313
Energy: 1.0923474204520236
Energy: 1.0574189323365448
Energy: 0.9632065199014708
Energy: 1.0574189323349517
Energy: 0.9632065199022671
Energy: 1.0574189323357484
Energy: 0.9632065199014708
Energy: 1.0214407056868637
Energy: 1.0194018725747935
Energy: 1.0214407056876604
Energy: 1.0194018725747935
Energy: 1.021440705688457
Energy: 1.0194018725747935
Energy: 1.0112701668893511
Energy: 1.0331495512552524
Energy: 1.0112701668885546
Energy: 1.0331495512552524
Energy: 1.0112701668901478
Energy: 1.0331495512552524
Energy: 1.0052715871107982
Energy: 0.9316663112602777
Energy: 1.0052715871092055
Energy: 0.9316663112602777
Energy: 1.005271587110002
Energy: 0.9316663112610744
Energy: 1.0246683716026939
Energy: 1.0728267776026355
Energy: 1.0246683716011007
Energy: 1.0728267776026355
Energy: 1.0246683716026939
Energy: 1.0728267776026355
Energy: 0.9725550887876414
Energy: 0.9817608235283432
Energy: 0.9725550887900308
Energy: 0.9817608235283432
Energy: 0.9725550887892342
Energy: 0.9817608235275466
Energy: 1.084758190115466
Energy: 1.025258955220306
Energy: 1.0847581901146695
Energy: 1.025258955220306
Energy: 1.0847581901162624
Energy: 1.025258955220306
Energy: 0.9789129297443943
Energy: 1.0967122026343816
Energy: 0.9789129297428011
Energy: 1.0967122026343816
Energy: 0.9789129297435977
Energy: 1.0967122026343816
Energy: 1.0282833068733104
Energy: 0.9415380263762806
Energy: 1.0282833068733104
Energy: 0.9415380263754839
Energy: 1.0282833068733104
Energy: 0.9415380263762806
Energy: 1.0161121557352688
Energy: 1.0676393829306392
Energy: 1.0161121557359927
Energy: 1.0676393829306392
Energy: 1.0161121557367894
Energy: 1.0676393829306392
Energy: 0.9822702257586473
Energy: 1.1082686027238626
Energy: 0.9822702257578506
Energy: 1.1082686027238626
Energy: 0.9822702257578506
Energy: 1.1082686027238626
Energy: 1.1121495405268045
Energy: 0.938317393295987
Energy: 1.1121495405268045
Energy: 0.938317393295987
Energy: 1.112149540526008
Energy: 0.938317393295987
Energy: 1.062370108948489
Energy: 1.0969316437279208
Energy: 1.0623701089500819
Energy: 1.0969316437279208
Energy: 1.0623701089492854
Energy: 1.0969316437279208
Energy: 0.9523791501797509
Energy: 1.14465552527784
Energy: 0.952379150182937
Energy: 1.14465552527784
Energy: 0.884971951922868
Energy: 1.14465552527784

minimum gb energy = 0.884971951922868 eV
minimum distance =  2.28845745001884 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.1747686560032031
Energy: 1.02190946981808
Energy: 1.1747686560016872
Energy: 1.02190946981808
Energy: 1.1747686560032031
Energy: 1.0219094698185855
Energy: 1.061708031259577
Energy: 1.1335048188802592
Energy: 1.0617080312590719
Energy: 1.1335048188807644
Energy: 1.0617080312590719
Energy: 1.1335048188802592
Energy: 1.1432058204163569
Energy: 1.1641481768893358
Energy: 1.1432058204143358
Energy: 1.1641481768893358
Energy: 1.1432058204148412
Energy: 1.1641481768893358
Energy: 1.1321851243587626
Energy: 1.0339203337419847
Energy: 1.1321851243592678
Energy: 1.0339203337414793
Energy: 1.1321851243587626
Energy: 1.0339203337414793
Energy: 1.0868346797019683
Energy: 1.0653215772696842
Energy: 1.0868346797019683
Energy: 1.0653215772691789
Energy: 1.0868346797019683
Energy: 1.0653215772691789
Energy: 1.2131774097522023
Energy: 1.1670519092000742
Energy: 1.2131774097537185
Energy: 1.1582201568585864
Energy: 1.213177409753213
Energy: 1.1582201568580812
Energy: 1.0697456519285888
Energy: 1.0859474281355634
Energy: 1.069745651927119
Energy: 1.0859474281355634
Energy: 1.06974565193061
Energy: 1.0859474281355634
Energy: 1.1007687634947751
Energy: 1.0922128957225181
Energy: 1.100768763493259
Energy: 1.0922128957225181
Energy: 1.1007687634952803
Energy: 1.0922128957225181
Energy: 1.0879848558424503
Energy: 1.1381902743444807
Energy: 1.0879848558444711
Energy: 1.1381902743439756
Energy: 1.0879848558429557
Energy: 1.1381902743439756
Energy: 1.2466870403989911
Energy: 1.0786548767091877
Energy: 1.2466870403979806
Energy: 1.0786548767036295
Energy: 1.2466870403984858
Energy: 1.0394418134740475
Energy: 1.124286182702118
Energy: 1.1173514443872277
Energy: 1.124286182702118
Energy: 1.1173514443872277
Energy: 1.1242861827016126
Energy: 1.1173514443872277
Energy: 1.0503017160053054
Energy: 1.051866029443918
Energy: 1.0503017160037897
Energy: 1.051866029443918
Energy: 1.050301716004295
Energy: 1.051866029443918
Energy: 1.204556939779195
Energy: 1.1045089790650644
Energy: 1.2045569397781843
Energy: 1.1045089790650644
Energy: 1.2045569397797002
Energy: 1.1045089790650644
Energy: 1.0714040042402482
Energy: 1.1162687496887438
Energy: 1.0714040042407535
Energy: 1.116268749689249
Energy: 1.0714040042402482
Energy: 1.116268749689249
Energy: 1.1104102576659431
Energy: 1.0644185649125573
Energy: 1.1104102576664483
Energy: 1.0644185649130626
Energy: 1.1104102576664483
Energy: 1.0644185649130626
Energy: 1.1320927788851292
Energy: 1.1812452072372095
Energy: 1.1320927788841189
Energy: 1.1812452072372095
Energy: 1.1320927788851292
Energy: 1.1812452072372095
Energy: 1.0742113953033778
Energy: 1.1980140841453426
Energy: 1.074211395306915
Energy: 1.1980140841448372
Energy: 1.0742113953038834
Energy: 1.1980140841453426
Energy: 1.2054002011519989
Energy: 1.180615581142573
Energy: 1.2054002011519989
Energy: 1.180615581142573
Energy: 1.205400201150483
Energy: 1.180615581142573
Energy: 1.0421088057456893
Energy: 1.1847734236629655
Energy: 1.0421088057466998
Energy: 1.1847734236629655
Energy: 1.0421088057456893
Energy: 1.1847734236629655
Energy: 1.08591689885729
Energy: 1.124223376632748
Energy: 1.0859168988557744
Energy: 1.124223376632243
Energy: 1.08591689885729
Energy: 1.124223376632748
Energy: 1.1328984414703616
Energy: 1.164407842099017
Energy: 1.1328984414718775
Energy: 1.164407842099522
Energy: 1.132898441471372
Energy: 1.164407842099522
Energy: 1.1300565891188463
Energy: 1.0187945993375491
Energy: 1.1300565891208674
Energy: 1.0187945993375491
Energy: 1.1300565891203622
Energy: 1.0187945993375491
Energy: 1.0618555945984542
Energy: 1.1172541138871628
Energy: 1.0618555945974435
Energy: 1.1172541138871628
Energy: 1.0618555945984542
Energy: 1.1172541138871628
Energy: 1.2194683114565699
Energy: 1.0666592683705078
Energy: 1.2194683114585911
Energy: 1.0666592683705078
Energy: 1.2194683114540432
Energy: 1.0666592683705078
Energy: 1.0484453777130458
Energy: 1.0524014475087249
Energy: 1.048445377714056
Energy: 1.0524014475087249
Energy: 1.048445377713551
Energy: 1.0524014475087249
Energy: 1.0780693771706555
Energy: 1.1147411930563307
Energy: 1.0780693771726764
Energy: 1.1147411930558255
Energy: 1.0780693771711607
Energy: 1.1147411930563307
Energy: 1.0691694156818183
Energy: 1.017381330073659
Energy: 1.0691694156803024
Energy: 1.017381330073659
Energy: 1.0691694156808078
Energy: 1.0173813300731538
Energy: 1.1322500155537285
Energy: 1.2040199940633884
Energy: 1.132250015552718
Energy: 1.2040199940633884
Energy: 1.1322500155522128
Energy: 1.2040199940633884
Energy: 1.0870460605172303
Energy: 1.0665955839980528
Energy: 1.0870460605162195
Energy: 1.066595583998558
Energy: 1.087046060515209
Energy: 1.066595583998558
Energy: 1.0671944088169827
Energy: 1.0874166859188323
Energy: 1.0671944088169827
Energy: 1.0874166859188323
Energy: 1.0671944088154666
Energy: 1.0874166859193377
Energy: 1.2125558920315092
Energy: 1.1770704521173754
Energy: 1.2125558920325197
Energy: 1.1770704521163649
Energy: 1.2125558920320143
Energy: 1.1770704521173754
Energy: 1.0874444297222243
Energy: 1.0631935968284831
Energy: 1.0874444297237402
Energy: 1.0631935968289885
Energy: 1.0874444297212138
Energy: 1.0631935968289885
Energy: 1.1146292982746135
Energy: 1.169787092767056
Energy: 1.114629298275119
Energy: 1.1697870927675613
Energy: 1.114629298275624
Energy: 1.1697870927680667
Energy: 1.1077503133289304
Energy: 1.1323685774239474
Energy: 1.1077503133294355
Energy: 1.1323685774239474
Energy: 1.107750313329941
Energy: 1.1323685774239474
Energy: 1.068706443675788
Energy: 1.1637871969475546
Energy: 1.0687064436767988
Energy: 1.1637871969475546
Energy: 1.068706443677304
Energy: 1.1637871969475546
Energy: 1.1996324361942414
Energy: 1.0841755003891427
Energy: 1.1996324361942414
Energy: 1.0841755003886375
Energy: 1.199632436193736
Energy: 1.0841755003891427
Energy: 1.048295729555192
Energy: 1.0806619865149683
Energy: 1.0482957295577184
Energy: 1.0806619865144629
Energy: 1.0482957295562025
Energy: 1.0806619865144629

minimum gb energy = 1.0173813300731538 eV
minimum distance =  2.26006439912853 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2171493727082063
Energy: 1.1679008965527709
Energy: 1.2171493727082063
Energy: 1.1679008965527709
Energy: 1.2171493727082063
Energy: 1.1679008965527709
Energy: 1.1774595638187995
Energy: 1.188667444324874
Energy: 1.1774595638187995
Energy: 1.188667444324874
Energy: 1.17745956381742
Energy: 1.188667444324874
Energy: 1.330593137033679
Energy: 1.1817916268390545
Energy: 1.4043668552175155
Energy: 1.1817916268376751
Energy: 1.2965025348566375
Energy: 1.1817916268390545
Energy: 1.2528285129612402
Energy: 1.2677301341256082
Energy: 1.2528285129612402
Energy: 1.2677301341269878
Energy: 1.25282851296262
Energy: 1.2677301341269878
Energy: 1.2352128760465197
Energy: 1.1913400542644321
Energy: 1.2352128760451402
Energy: 1.1913400542644321
Energy: 1.2352128760465197
Energy: 1.1913400542644321
Energy: 1.3345071702379798
Energy: 1.2629053846389322
Energy: 1.3345071702393596
Energy: 1.2629053846389322
Energy: 1.3345071702393596
Energy: 1.2629053846389322
Energy: 1.254309285226174
Energy: 1.1412845780133052
Energy: 1.254309285222035
Energy: 1.1412845780133052
Energy: 1.254309285223415
Energy: 1.1412845780133052
Energy: 1.2750382430485312
Energy: 1.1817207236544125
Energy: 1.2750382430485312
Energy: 1.1817207236544125
Energy: 1.2750382430485312
Energy: 1.1817207236544125
Energy: 1.1646051444974233
Energy: 1.14242933903573
Energy: 1.1646051444974233
Energy: 1.1424293390371096
Energy: 1.1646051444974233
Energy: 1.1424293390371096
Energy: 1.21699578198469
Energy: 1.1822371010270456
Energy: 1.2169957819860697
Energy: 1.1822371010270456
Energy: 1.2169957819860697
Energy: 1.1822371010270456
Energy: 1.1766445469019986
Energy: 1.1951928548090118
Energy: 1.1766445469019986
Energy: 1.1951928548090118
Energy: 1.1766445469006193
Energy: 1.1951928548090118
Energy: 1.2501719081490386
Energy: 1.1888199495542502
Energy: 1.2501719081504183
Energy: 1.1888199495542502
Energy: 1.2501719081490386
Energy: 1.1888199495542502
Energy: 1.2538749108805733
Energy: 1.2627460247885434
Energy: 1.253874910881953
Energy: 1.2627460247899231
Energy: 1.2538749108805733
Energy: 1.2627460247885434
Energy: 1.2962716244745036
Energy: 1.1939685497581174
Energy: 1.2962716244758834
Energy: 1.193968549756738
Energy: 1.2962716244745036
Energy: 1.1939685497581174

minimum gb energy = 1.1412845780133052 eV
minimum distance =  2.24508460971759 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.3437288191296555
Energy: 1.3168039904004119
Energy: 1.3437288191290493
Energy: 1.3168039904004119
Energy: 1.3437288191302337
Energy: 1.3168039904004119
Energy: 1.3217060806730865
Energy: 1.2880054087988442
Energy: 1.3217060806724803
Energy: 1.2880054087988442
Energy: 1.3217060806730865
Energy: 1.2880054087988442
Energy: 1.316606980521619
Energy: 1.3190187914654272
Energy: 1.316606980521619
Energy: 1.3190187914654272
Energy: 1.316606980521619
Energy: 1.3190187914654272
Energy: 1.3615248616869118
Energy: 1.2570287233049164
Energy: 1.3615248616869118
Energy: 1.2570287233049164
Energy: 1.3615248616863058
Energy: 1.2570287233049164
Energy: 1.351021865745204
Energy: 1.3044871012994979
Energy: 1.3510218657445978
Energy: 1.3044871012994979
Energy: 1.351021865745204
Energy: 1.3044871012994979
Energy: 1.2754862242306053
Energy: 1.3531938379807276
Energy: 1.2754862242293934
Energy: 1.3531938379807276
Energy: 1.2754862242299991
Energy: 1.3531938379807276
Energy: 1.2938988183050888
Energy: 1.2923516043340013
Energy: 1.2938988183056948
Energy: 1.2923516043340013
Energy: 1.2938988183063007
Energy: 1.2923516043340013
Energy: 1.3124487844446755
Energy: 1.3244767999068199
Energy: 1.3124487844446755
Energy: 1.3244767999074258
Energy: 1.3124487844446755
Energy: 1.3244767999074258
Energy: 1.3430802207160943
Energy: 1.298748102216078
Energy: 1.3430802207160943
Energy: 1.298748102216078
Energy: 1.3430802207167005
Energy: 1.298748102216078
Energy: 1.2767042389249734
Energy: 1.3296495981115544
Energy: 1.2767042389261853
Energy: 1.3296495981115544
Energy: 1.2767042389255792
Energy: 1.3296495981115544
Energy: 1.32435835264193
Energy: 1.3097589896597184
Energy: 1.3243583526413238
Energy: 1.3097589896597184
Energy: 1.3243583526413238
Energy: 1.3097589896597184
Energy: 1.3383727982083098
Energy: 1.346411420520903
Energy: 1.3383727982089157
Energy: 1.346411420520903
Energy: 1.3383727982083098
Energy: 1.346411420520903
Energy: 1.348134917609521
Energy: 1.2893704830752768
Energy: 1.348134917609521
Energy: 1.2893704830752768
Energy: 1.3481349176089152
Energy: 1.2893704830752768
Energy: 1.2919266981466808
Energy: 1.3470939325618787
Energy: 1.2919266981466808
Energy: 1.3470939325618787
Energy: 1.2919266981478927
Energy: 1.3470939325618787
Energy: 1.290873861243488
Energy: 1.3057694144378538
Energy: 1.2908738612428818
Energy: 1.3057694144378538
Energy: 1.2908738612440938
Energy: 1.3057694144378538
Energy: 1.2942131901285787
Energy: 1.2929553535893683
Energy: 1.294213190129185
Energy: 1.2929553535887626
Energy: 1.2942131901285787
Energy: 1.2929553535893683
Energy: 1.2506579771887485
Energy: 1.3017961476336795
Energy: 1.2506579771881423
Energy: 1.3017961476336795
Energy: 1.2506579771887485
Energy: 1.3017961476336795
Energy: 1.3366426637233524
Energy: 1.3414363023135225
Energy: 1.3366426637245645
Energy: 1.3414363023135225
Energy: 1.3366426637233524
Energy: 1.3414363023135225
Energy: 1.304872960140194
Energy: 1.2475597625771027
Energy: 1.304872960138982
Energy: 1.2475597625771027
Energy: 1.3048729601408
Energy: 1.2475597625777088
Energy: 1.329249277050534
Energy: 1.2771001797597503
Energy: 1.32924927705114
Energy: 1.2771001797591444
Energy: 1.32924927705114
Energy: 1.2771001797597503
Energy: 1.3192785706251375
Energy: 1.2994786856005371
Energy: 1.3192785706245316
Energy: 1.2994786856005371
Energy: 1.3192785706257435
Energy: 1.2994786856005371
Energy: 1.3814163609986247
Energy: 1.3274316868109237
Energy: 1.3814163609992312
Energy: 1.3274316868109237
Energy: 1.3814163609986247
Energy: 1.3274316868109237
Energy: 1.2995913595314421
Energy: 1.320772260324553
Energy: 1.2995913595308362
Energy: 1.320772260324553
Energy: 1.2995913595308362
Energy: 1.320772260324553
Energy: 1.3937880541599832
Energy: 1.3255646428613899
Energy: 1.3937880541605894
Energy: 1.3255646428613899
Energy: 1.3937880541593775
Energy: 1.3255646428613899
Energy: 1.2932295825506295
Energy: 1.3144857623064687
Energy: 1.2932295825506295
Energy: 1.3144857623064687
Energy: 1.2932295825506295
Energy: 1.3144857623064687
Energy: 1.2728627796694947
Energy: 1.2957378081384556
Energy: 1.2728627796694947
Energy: 1.2957378081384556
Energy: 1.2728627796701009
Energy: 1.2957378081384556
Energy: 1.2759322347747237
Energy: 1.315750424817089
Energy: 1.2759322347741175
Energy: 1.315750424817089
Energy: 1.2759322347735114
Energy: 1.315750424817089
Energy: 1.3322717381886025
Energy: 1.2974867933352512
Energy: 1.3322717381892086
Energy: 1.2974867933352512
Energy: 1.3322717381892086
Energy: 1.2974867933352512
Energy: 1.287044262042743
Energy: 1.3322329647104938
Energy: 1.287044262042743
Energy: 1.3322329647104938
Energy: 1.287044262043349
Energy: 1.3322329647104938
Energy: 1.2926405910833954
Energy: 1.2980518477242733
Energy: 1.2926405910827892
Energy: 1.2980518477242733
Energy: 1.2926405910827892
Energy: 1.2980518477242733
Energy: 1.277812003537976
Energy: 1.3532255140940865
Energy: 1.27781200353737
Energy: 1.3532255140940865
Energy: 1.277812003537976
Energy: 1.3532255140940865

minimum gb energy = 1.2475597625771027 eV
minimum distance =  2.23308556597698 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2518680871366876
Energy: 1.4738986592381609
Energy: 1.2518680871366876
Energy: 1.4738986592381609
Energy: 1.2518680871366876
Energy: 1.4738986592370824
Energy: 1.2947806302456817
Energy: 1.2904466227005578
Energy: 1.2947806302446032
Energy: 1.2904466227005578
Energy: 1.2947806302456817
Energy: 1.2904466227005578
Energy: 1.256301521716002
Energy: 1.5600265175229344
Energy: 1.256301521716002
Energy: 1.4097538637131346
Energy: 1.2563015217149236
Energy: 1.307502604997025
Energy: 1.2947747374561256
Energy: 1.290434179482815
Energy: 1.2947747374572043
Energy: 1.290434179482815
Energy: 1.2947747374572043
Energy: 1.290434179482815
Energy: 1.2527403625050422
Energy: 1.2112387165035172
Energy: 1.2527403625050422
Energy: 1.2112387165035172
Energy: 1.2527403625061206
Energy: 1.2112387165035172
Energy: 1.2020233258775792
Energy: 1.2045393539163487
Energy: 1.202023325876501
Energy: 1.2045393539163487
Energy: 1.202023325876501
Energy: 1.2045393539163487
Energy: 1.2518680871356092
Energy: 1.4738986592392394
Energy: 1.2518680871356092
Energy: 1.4738986592392394
Energy: 1.2518680871356092
Energy: 1.4738986592381609
Energy: 1.2947806302499956
Energy: 1.2904466227005578
Energy: 1.2947806302489173
Energy: 1.2904466227016362
Energy: 1.2947806302499956
Energy: 1.2904466227016362
Energy: 1.2563015217213944
Energy: 1.4541271401900175
Energy: 1.2563015217192375
Energy: 1.3599598307704064
Energy: 1.2563015217213944
Energy: 1.4541271401910958
Energy: 1.2947747374561256
Energy: 1.290434179482815
Energy: 1.2947747374550473
Energy: 1.290434179482815
Energy: 1.2947747374561256
Energy: 1.290434179482815
Energy: 1.2527403625050422
Energy: 1.2112387165013603
Energy: 1.2527403625039637
Energy: 1.2112387165013603
Energy: 1.2527403625039637
Energy: 1.2112387165013603
Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2020233258732655
Energy: 1.2045393539141915
Energy: 1.2518680871366876
Energy: 1.4738986592392394
Energy: 1.2518680871366876
Energy: 1.4738986592392394
Energy: 1.2518680871366876
Energy: 1.4738986592381609
Energy: 1.2947806302446032
Energy: 1.2904466227005578
Energy: 1.2947806302446032
Energy: 1.2904466227005578
Energy: 1.2947806302446032
Energy: 1.2904466227005578
Energy: 1.256301521716002
Energy: 1.4541271401900175
Energy: 1.2563015217149236
Energy: 1.2898485475214838
Energy: 1.2563015217170805
Energy: 1.4541271401900175
Energy: 1.2947747374561256
Energy: 1.290434179482815
Energy: 1.2947747374561256
Energy: 1.290434179482815
Energy: 1.2947747374572043
Energy: 1.290434179482815

minimum gb energy = 1.2020233258732655 eV
minimum distance =  2.26169710587455 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.2975799980403384
Energy: 1.3207715208572908
Energy: 1.2975799980403384
Energy: 1.3207715208581714
Energy: 1.2975799980403384
Energy: 1.3207715208572908
Energy: 1.3335567440576308
Energy: 1.3695855450017342
Energy: 1.3335567440567504
Energy: 1.3695855450017342
Energy: 1.3335567440567504
Energy: 1.3695855450008536
Energy: 1.3495518944585119
Energy: 1.3157134811471942
Energy: 1.3495518944585119
Energy: 1.3157134811480748
Energy: 1.3495518944576315
Energy: 1.3157134811480748
Energy: 1.2899180438111015
Energy: 1.388522111189238
Energy: 1.2899180438102207
Energy: 1.3885221111883574
Energy: 1.2899180438102207
Energy: 1.3885221111883574
Energy: 1.5052821086722874
Energy: 1.3139294223283395
Energy: 1.5052821086740484
Energy: 1.3139294223283395
Energy: 1.505282108673168
Energy: 1.3139294223283395
Energy: 1.3882063983010584
Energy: 1.3805222883853363
Energy: 1.388206398300178
Energy: 1.380522288384456
Energy: 1.388206398300178
Energy: 1.3805222883853363
Energy: 1.2560670953331636
Energy: 1.310931807618978
Energy: 1.2560670953331636
Energy: 1.3109318076180971
Energy: 1.2560670953340443
Energy: 1.3109318076180971
Energy: 1.3652528169603395
Energy: 1.3688060747653408
Energy: 1.3652528169603395
Energy: 1.3688060747653408
Energy: 1.3652528169603395
Energy: 1.3688060747653408
Energy: 1.430693789453261
Energy: 1.3412836336194347
Energy: 1.430693789453261
Energy: 1.3412836336194347
Energy: 1.430693789453261
Energy: 1.3412836336194347
Energy: 1.2579605769945
Energy: 1.2955068265928973
Energy: 1.2579605769945
Energy: 1.2955068265920169
Energy: 1.2579605769953806
Energy: 1.2955068265928973
Energy: 1.3333860014529884
Energy: 1.3341905932616311
Energy: 1.333386001452108
Energy: 1.3341905932625118
Energy: 1.333386001452108
Energy: 1.3341905932616311
Energy: 1.3246114024764317
Energy: 1.2817878770333646
Energy: 1.3246114024764317
Energy: 1.2817878770333646
Energy: 1.3246114024755908
Energy: 1.2817878770333646
Energy: 1.2876041446732345
Energy: 1.4354194467441175
Energy: 1.2876041446732345
Energy: 1.4354194467441175
Energy: 1.2876041446741149
Energy: 1.4354194467441175
Energy: 1.398980684242747
Energy: 1.345777128637508
Energy: 1.398980684242747
Energy: 1.345777128637508
Energy: 1.398980684242747
Energy: 1.345777128637508
Energy: 1.422704796105912
Energy: 1.3141412973500537
Energy: 1.4227047961050316
Energy: 1.3141412973500537
Energy: 1.4227047961050316
Energy: 1.3141412973500537
Energy: 1.3657977925878941
Energy: 1.3100354469555784
Energy: 1.3657977925878941
Energy: 1.3100354469555784
Energy: 1.3657977925887748
Energy: 1.3100354469555784
Energy: 1.3566169967027157
Energy: 1.309922630941716
Energy: 1.3566169967027157
Energy: 1.3099226309425966
Energy: 1.3566169967027157
Energy: 1.3099226309425966
Energy: 1.4296289524992545
Energy: 1.3118015472041133
Energy: 1.429628952498374
Energy: 1.3118015472041133
Energy: 1.4296289524992545
Energy: 1.311801547204994
Energy: 1.3078949922619056
Energy: 1.345806861939627
Energy: 1.3078949922610255
Energy: 1.345806861939627
Energy: 1.3078949922610255
Energy: 1.345806861939627
Energy: 1.3689759155763221
Energy: 1.314538502753478
Energy: 1.3689759155745609
Energy: 1.314538502753478
Energy: 1.3689759155763221
Energy: 1.314538502753478
Energy: 1.3250089665247033
Energy: 1.280433674530503
Energy: 1.3250089665255838
Energy: 1.280433674530503
Energy: 1.3250089665247033
Energy: 1.280433674530503

minimum gb energy = 1.2560670953331636 eV
minimum distance =  2.23446369257805 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.2675348693733415
Energy: 1.2766651664899182
Energy: 1.4354565306200755
Energy: 1.2766651664899182
Energy: 1.2675348693733415
Energy: 1.2766651664884336
Energy: 1.2319318149078609
Energy: 1.2291113795817354
Energy: 1.2319318149115719
Energy: 1.229111379580993
Energy: 1.2319318149078609
Energy: 1.2291113795832198
Energy: 1.3430708653866965
Energy: 1.2202876407443837
Energy: 1.3430708653859542
Energy: 1.2202876407443837
Energy: 1.3430708653859542
Energy: 1.2202876407458683
Energy: 1.3142514238071878
Energy: 1.413756422912626
Energy: 1.3142514238094145
Energy: 1.413756422912626
Energy: 1.3142514238071878
Energy: 1.4137564229163375
Energy: 1.2219462651862574
Energy: 1.2070660492244543
Energy: 1.2219462651847728
Energy: 1.2070660492244543
Energy: 1.2219462651862574
Energy: 1.2070660492251963
Energy: 1.277777801602011
Energy: 1.3091861336782327
Energy: 1.2777778015982997
Energy: 1.3091861336789747
Energy: 1.2777778016012689
Energy: 1.309186133681944
Energy: 1.2263375944265338
Energy: 1.229939611561198
Energy: 1.2263375944280184
Energy: 1.2299396115604555
Energy: 1.226337594427276
Energy: 1.22993961156194
Energy: 1.3206191212880487
Energy: 1.3437710872879551
Energy: 1.320619121284371
Energy: 1.3437710872879551
Energy: 1.3206191212873064
Energy: 1.3437710872916664
Energy: 1.152734429688575
Energy: 1.308672579721079
Energy: 1.1527344296870905
Energy: 1.308672579721079
Energy: 1.152734429688575
Energy: 1.30867257971811
Energy: 1.3136842558070492
Energy: 1.1513272371164387
Energy: 1.3136842558107606
Energy: 1.1513272371164387
Energy: 1.3136842558070492
Energy: 1.1513272371179233
Energy: 1.3137668378741756
Energy: 1.226162779158827
Energy: 1.3137668378726912
Energy: 1.226162779158827
Energy: 1.3137668378741756
Energy: 1.2261627791595693
Energy: 1.2398220565178817
Energy: 1.3318654884741215
Energy: 1.2398220565178817
Energy: 1.3318654884741215
Energy: 1.2398220565178817
Energy: 1.331865488475606
Energy: 1.244084663102737
Energy: 1.4166721313790283
Energy: 1.244084663102737
Energy: 1.4166721313790283
Energy: 1.244084663102737
Energy: 1.416672131376093
Energy: 1.2200074462794033
Energy: 1.1512812556794612
Energy: 1.2200074462801456
Energy: 1.1512812556794612
Energy: 1.2200074462794033
Energy: 1.1512812556824301
Energy: 1.2778186617231972
Energy: 1.309195420313963
Energy: 1.2778186617239395
Energy: 1.309195420313963
Energy: 1.2778186617231972
Energy: 1.3091954203147054
Energy: 1.2287398580960895
Energy: 1.2125350105889239
Energy: 1.2287398580968316
Energy: 1.2125350105889239
Energy: 1.2287398580960895
Energy: 1.212535010594862
Energy: 1.3237484445965297
Energy: 1.3420500036304872
Energy: 1.3237484445965297
Energy: 1.3420500036297447
Energy: 1.3237484445965297
Energy: 1.3420500036252911
Energy: 1.4143597013713753
Energy: 1.2200070060404722
Energy: 1.4143597013713753
Energy: 1.2200070060404722
Energy: 1.4143597013721174
Energy: 1.2200070060412145
Energy: 1.2310000018794993
Energy: 1.223270327949564
Energy: 1.1521630196290837
Energy: 1.223270327949564
Energy: 1.2310000018802416
Energy: 1.2232703279480794
Energy: 1.2675348693747923
Energy: 1.2766651664906603
Energy: 1.4354565306200755
Energy: 1.2766651664906603
Energy: 1.2675348693747923
Energy: 1.2766651664876913
Energy: 1.231931814905634
Energy: 1.2291113795817354
Energy: 1.2319318149100875
Energy: 1.2291113795817354
Energy: 1.231931814905634
Energy: 1.2291113795832198
Energy: 1.3430708653866965
Energy: 1.2202876407436416
Energy: 1.3430708653859542
Energy: 1.2202876407436416
Energy: 1.3430708653866965
Energy: 1.2202876407451262
Energy: 1.3142514238034764
Energy: 1.413756422914853
Energy: 1.3142514238071878
Energy: 1.413756422914853
Energy: 1.3142514238034764
Energy: 1.4137564229185642
Energy: 1.2219462651840307
Energy: 1.2070660492289078
Energy: 1.2219462651832882
Energy: 1.2070660492281655
Energy: 1.2219462651840307
Energy: 1.2070660492274234
Energy: 1.277777801599042
Energy: 1.3091861336826862
Energy: 1.2777778015953307
Energy: 1.3091861336826862
Energy: 1.2777778015997843
Energy: 1.3091861336834285

minimum gb energy = 1.1512812556794612 eV
minimum distance =  2.25409498550855 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.2844158740448979
Energy: 1.3589847695142163
Energy: 1.2844158740442573
Energy: 1.3589847695154977
Energy: 1.2844158740448979
Energy: 1.3589847695148571
Energy: 1.3398953025174816
Energy: 1.1990974531199807
Energy: 1.3398953025174816
Energy: 1.1990974531206215
Energy: 1.3398953025168407
Energy: 1.1990974531206215
Energy: 1.3121048385698475
Energy: 1.2057912385793963
Energy: 1.3121048385698475
Energy: 1.2057912385793963
Energy: 1.3121048385698475
Energy: 1.2057912385793963
Energy: 1.200909312937308
Energy: 1.302853258479437
Energy: 1.200909312937308
Energy: 1.302853258479437
Energy: 1.200909312937308
Energy: 1.302853258479437
Energy: 1.2665571627760992
Energy: 1.3012153669181343
Energy: 1.2665571627760992
Energy: 1.3012153669181343
Energy: 1.2665571627760992
Energy: 1.3012153669181343
Energy: 1.2596161524797111
Energy: 1.2194381868529944
Energy: 1.259616152480352
Energy: 1.2194381868529944
Energy: 1.2596161524797111
Energy: 1.2194381868529944
Energy: 1.2169973589289627
Energy: 1.3177841866973905
Energy: 1.2169973589289627
Energy: 1.317784186698031
Energy: 1.2169973589296035
Energy: 1.3177841866973905
Energy: 1.212909566284188
Energy: 1.3273384924667275
Energy: 1.2129095662829066
Energy: 1.3273384924667275
Energy: 1.212909566284188
Energy: 1.327338492466116
Energy: 1.2810620615909742
Energy: 1.1851032137955777
Energy: 1.281062061589693
Energy: 1.1851032137955777
Energy: 1.2810620615903336
Energy: 1.1851032137955777
Energy: 1.289828290571735
Energy: 1.262065840927512
Energy: 1.289828290571735
Energy: 1.262065840927512
Energy: 1.2898282905710945
Energy: 1.262065840927512
Energy: 1.1665308486957289
Energy: 1.3576409461890033
Energy: 1.1665308486970103
Energy: 1.3576409461883627
Energy: 1.1665308486970103
Energy: 1.3576409461890033
Energy: 1.3735545270438747
Energy: 1.2001485467691662
Energy: 1.3735545270445155
Energy: 1.2001485467691662
Energy: 1.3735545270445155
Energy: 1.2001485467691662
Energy: 1.3001627917189063
Energy: 1.3173947112710542
Energy: 1.3001627917189063
Energy: 1.3173947112710542
Energy: 1.3001627917189063
Energy: 1.3173947112710542
Energy: 1.214651371890619
Energy: 1.2566705804064986
Energy: 1.2146513718899783
Energy: 1.2566705804058578
Energy: 1.214651371890619
Energy: 1.2566705804064986
Energy: 1.3571897506927464
Energy: 1.1763679113745003
Energy: 1.3571897506927464
Energy: 1.176367911375141
Energy: 1.3571897506927464
Energy: 1.1763679113738594
Energy: 1.2794466184357638
Energy: 1.1754552523422488
Energy: 1.2794466184370452
Energy: 1.1754552523428896
Energy: 1.2794466184364044
Energy: 1.1754552523422488
Energy: 1.2165540358822409
Energy: 1.3389560378237515
Energy: 1.2165540358816003
Energy: 1.3389560378237515
Energy: 1.2165540358816003
Energy: 1.3389560378237515
Energy: 1.3601067938676086
Energy: 1.3735414636336247
Energy: 1.3601067938676086
Energy: 1.3735414636336247
Energy: 1.3601067938682494
Energy: 1.3735414636336247
Energy: 1.2082046860332365
Energy: 1.2193251936529894
Energy: 1.2082046860332365
Energy: 1.2193251936529894
Energy: 1.3182462460173787
Energy: 1.21932519365363
Energy: 1.1914719148276156
Energy: 1.3238227394120332
Energy: 1.1914719148269748
Energy: 1.323822739412674
Energy: 1.1914719148276156
Energy: 1.3238227394120332
Energy: 1.1521103827199228
Energy: 1.3020312849265534
Energy: 1.1521103827199228
Energy: 1.3020312849271942
Energy: 1.1521103827199228
Energy: 1.3020312849271942
Energy: 1.3386879449766218
Energy: 1.2037220643659385
Energy: 1.3386879449766218
Energy: 1.2037220643659385
Energy: 1.3386879449766218
Energy: 1.2037220643659385
Energy: 1.3202086606311405
Energy: 1.3632939075246366
Energy: 1.3202086606292187
Energy: 1.3632939075246366
Energy: 1.3202086606298593
Energy: 1.3632939075246366
Energy: 1.2358270688181499
Energy: 1.355216868305338
Energy: 1.2358270688187905
Energy: 1.3552168683046975
Energy: 1.2358270688181499
Energy: 1.355216868305338
Energy: 1.3234281956119456
Energy: 1.2042305740274935
Energy: 1.3234281956119456
Energy: 1.2042305740274935
Energy: 1.3234281956119456
Energy: 1.2042305740274935
Energy: 1.3662939322885097
Energy: 1.2965983239255132
Energy: 1.3662939322878689
Energy: 1.2965983239255132
Energy: 1.3662939322878689
Energy: 1.296598323926154
Energy: 1.1569292188357732
Energy: 1.2462354538913438
Energy: 1.1569292188364138
Energy: 1.2462354538913438
Energy: 1.1569292188364138
Energy: 1.2462354538913438
Energy: 1.3173907291111597
Energy: 1.2720095158626787
Energy: 1.3173907291111597
Energy: 1.2720095158626787
Energy: 1.3173907291105191
Energy: 1.2720095158626787
Energy: 1.3444002739445318
Energy: 1.219268675475995
Energy: 1.3444002739445318
Energy: 1.2192686754766355
Energy: 1.3444002739445318
Energy: 1.2192686754766355

minimum gb energy = 1.1521103827199228 eV
minimum distance =  2.23188298179772 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.199553369411601
Energy: 1.2599092746624287
Energy: 1.1995533694104747
Energy: 1.2599092746624287
Energy: 1.1995533694110379
Energy: 1.2599092746624287
Energy: 1.1844317856262414
Energy: 1.176137249114959
Energy: 1.184431785625115
Energy: 1.176137249114959
Energy: 1.184431785630184
Energy: 1.1412040253354259
Energy: 1.3344836128205249
Energy: 1.1728374522676406
Energy: 1.334483612821088
Energy: 1.1728374522670773
Energy: 1.3344836128199618
Energy: 1.1728374522670773
Energy: 1.1065051811759619
Energy: 1.3074610499714656
Energy: 1.1065051811770885
Energy: 1.4051502304032937
Energy: 1.1065051811753988
Energy: 1.3149160788938785
Energy: 1.1286850416417358
Energy: 1.2522463045658272
Energy: 1.128685041642862
Energy: 1.2522463045658272
Energy: 1.1286850416417358
Energy: 1.2522463045658272
Energy: 1.2487445371715988
Energy: 1.1794858641775916
Energy: 1.2487445371721622
Energy: 1.1794858641781547
Energy: 1.2487445371715988
Energy: 1.1794858641781547
Energy: 1.141015714529029
Energy: 1.2676562032833307
Energy: 1.1410157145279027
Energy: 1.2676562032827674
Energy: 1.141015714529029
Energy: 1.2676562032827674
Energy: 1.1247790848908146
Energy: 1.2682229072334337
Energy: 1.1247790848896881
Energy: 1.3922668973290369
Energy: 1.1247790848902515
Energy: 1.3402335411156723
Energy: 1.249949148572193
Energy: 1.1577535748195096
Energy: 1.2499491485716294
Energy: 1.1577535748195096
Energy: 1.2499491485716294
Energy: 1.1577535748189465
Energy: 1.129721365983187
Energy: 1.1408965323539815
Energy: 1.1297213659809344
Energy: 1.4260403406070714
Energy: 1.129721365983187
Energy: 1.2676146662611494
Energy: 1.1056131440065156
Energy: 1.3139272784892173
Energy: 1.1056131440070789
Energy: 1.313927278488654
Energy: 1.1056131440065156
Energy: 1.313927278488654
Energy: 1.3421195498165648
Energy: 1.157554114413531
Energy: 1.3421195498148752
Energy: 1.1575541144129677
Energy: 1.3421195498165648
Energy: 1.1575541144140942
Energy: 1.3076359510361097
Energy: 1.1730121288780009
Energy: 1.307635951037236
Energy: 1.1730121288780009
Energy: 1.307635951037236
Energy: 1.1730121288780009
Energy: 1.184139489370002
Energy: 1.2223285293004285
Energy: 1.184139489370002
Energy: 1.2450147925027228
Energy: 1.184139489370565
Energy: 1.2246202783879692
Energy: 1.1841096269430278
Energy: 1.2432362626135927
Energy: 1.1841096269435907
Energy: 1.2432362626135927
Energy: 1.184109626944154
Energy: 1.2432362626135927
Energy: 1.3350969372750559
Energy: 1.1737461765513288
Energy: 1.3350969372750559
Energy: 1.1737461765507657
Energy: 1.3350969372756187
Energy: 1.173746176551892
Energy: 1.1060423208146115
Energy: 1.2892777052666329
Energy: 1.1060423208146115
Energy: 1.2892777052666329
Energy: 1.1060423208146115
Energy: 1.2892777052666329
Energy: 1.1056661030060793
Energy: 1.2517753741884823
Energy: 1.1056661030066426
Energy: 1.2517753741884823
Energy: 1.1056661030066426
Energy: 1.2517753741884823
Energy: 1.2483638821009875
Energy: 1.1577383218036787
Energy: 1.2483638821015508
Energy: 1.1577383218036787
Energy: 1.2483638821015508
Energy: 1.1577383218036787
Energy: 1.1414901660772634
Energy: 1.1300360785850792
Energy: 1.1414901660783898
Energy: 1.1300360785850792
Energy: 1.1414901660767003
Energy: 1.130036078584516
Energy: 1.1247916906071325
Energy: 1.4082572019161617
Energy: 1.124791690605443
Energy: 1.4082572019161617
Energy: 1.124791690606006
Energy: 1.4082572019161617
Energy: 1.3813113126144718
Energy: 1.1592545740223212
Energy: 1.3813113126150351
Energy: 1.1592545740228843
Energy: 1.3813113126155985
Energy: 1.1592545740228843
Energy: 1.2998883494428202
Energy: 1.1557078070291564
Energy: 1.2998883494433833
Energy: 1.1557078070285935
Energy: 1.2998883494433833
Energy: 1.1557078070291564
Energy: 1.1067579643509298
Energy: 1.2353606478246881
Energy: 1.1067579643498033
Energy: 1.2353606478246881
Energy: 1.1067579643503667
Energy: 1.2353606478252515
Energy: 1.3431690304729085
Energy: 1.2287226604638144
Energy: 1.3431690304712187
Energy: 1.2287226604632513
Energy: 1.3431690304723451
Energy: 1.2287226604632513
Energy: 1.308852015864923
Energy: 1.1737082296850752
Energy: 1.3088520158632335
Energy: 1.1737082296850752
Energy: 1.3088520158637966
Energy: 1.173708229684512
Energy: 1.1844668657977233
Energy: 1.2803616265840911
Energy: 1.18446686579716
Energy: 1.2803616265840911
Energy: 1.1844668657977233
Energy: 1.2803616265840911
Energy: 1.182537129075422
Energy: 1.2908879625231315
Energy: 1.182537129075422
Energy: 1.2908879625231315
Energy: 1.182537129074859
Energy: 1.2908879625231315
Energy: 1.2327101387614487
Energy: 1.1924544852910992
Energy: 1.2327101387620119
Energy: 1.1924544852910992
Energy: 1.2327101387614487
Energy: 1.1924544852910992
Energy: 1.1055396579087793
Energy: 1.3456263540965658
Energy: 1.105539657908216
Energy: 1.3456263540965658
Energy: 1.1055396579076529
Energy: 1.3456263540965658
Energy: 1.1065514218760577
Energy: 1.2804962808223646
Energy: 1.1065514218754946
Energy: 1.2804962808229279
Energy: 1.1065514218766208
Energy: 1.2804962808229279
Energy: 1.3108676945881708
Energy: 1.1585613816973828
Energy: 1.310867694588734
Energy: 1.1585613816973828
Energy: 1.3108676945876077
Energy: 1.1585613816973828
Energy: 1.381735454839024
Energy: 1.1582343970854785
Energy: 1.3817354548395873
Energy: 1.1582343970860418
Energy: 1.3817354548401506
Energy: 1.1582343970854785

minimum gb energy = 1.1055396579076529 eV
minimum distance =  2.24482537622592 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020555020420830836
Energy: 1.1065009409329216
Energy: 0.020555020420830836
Energy: 1.1065009409329216
Energy: 0.020555020420830836
Energy: 1.10650094092975
Energy: 0.023725919798918065
Energy: 0.45944257412586165
Energy: 0.023725919799334028
Energy: 0.45944257412539374
Energy: 0.023725919798918065
Energy: 0.45944257412586165
Energy: 1.1068647776733664
Energy: 0.45945256521643246
Energy: 1.106680795526711
Energy: 0.4594525652159645
Energy: 1.1066795074228735
Energy: 0.4594525652159645
Energy: 0.023725919798450103
Energy: 0.45944257412627765
Energy: 0.023725919797982144
Energy: 0.45944257412627765
Energy: 0.023725919797982144
Energy: 0.4594425741267456

minimum gb energy = 0.020555020420830836 eV
minimum distance =  2.48205959563466 Angstroms
sigma value = 1