Model name: model_name=MEAM_LAMMPS_LeeBaskesKim_2001_Mo__MO_805823015127_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Mo
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=3.1465589553117748
cohesive_energy=6.81053564033844
mass=95.95
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.021275695536082113
Energy: 0.8491931763675646
Energy: 0.021275695536082113
Energy: 0.8491931763668887
Energy: 0.021275695536082113
Energy: 0.8491931763672267
Energy: 0.021275695536420093
Energy: 0.02221673779530288
Energy: 0.6783504603262228
Energy: 0.02221673779098429
Energy: 0.6783504603265608
Energy: 0.022216737790646316
Energy: 0.6783504603262228
Energy: 0.022216737788993985
Energy: 0.9334487447942239
Energy: 0.6848235655731536
Energy: 0.9334487447938858
Energy: 0.6848235655731536
Energy: 0.9334487447942239
Energy: 0.6848235655734917
Energy: 0.9334487447948623
Energy: 0.022216737801574224
Energy: 0.6783504603268987
Energy: 0.022216737788355582
Energy: 0.6783504603252464
Energy: 0.022216737792298644
Energy: 0.6783504603258849
Energy: 0.02221673778767963
Energy: 0.021275695536420093
Energy: 0.8491931763672267
Energy: 0.021275695536420093
Energy: 0.8491931763668887
Energy: 0.021275695536420093
Energy: 0.8491931763672267
Energy: 0.021275695536758073
Energy: 0.022216737790646316
Energy: 0.6783504603258849
Energy: 0.022216737789331958
Energy: 0.6783504603258849
Energy: 0.02221673779594128
Energy: 0.6783504603262228
Energy: 0.02221673778636528

minimum gb energy = 0.021275695536082113 eV
minimum distance =  2.72117024898364 Angstroms
sigma value = 5


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

Energy: 2.292305935341737
Energy: 2.4749282960224845
Energy: 2.2923059353377
Energy: 2.4749282956028273
Energy: 2.292305935341737
Energy: 2.4749282957238723
Energy: 2.2923059353377
Energy: 2.0861830348191863
Energy: 2.0101718405577533
Energy: 2.0861830348191863
Energy: 2.01017183959732
Energy: 2.086183034811112
Energy: 2.0101718420831864
Energy: 2.0861830348030375
Energy: 1.8438138044322203
Energy: 1.9093815406601284
Energy: 1.843813804496817
Energy: 1.9093815406601284
Energy: 1.8438138044725936
Energy: 1.9093815406601284
Energy: 1.8438138044887427
Energy: 1.7901829105280023
Energy: 1.990152153769704
Energy: 1.7901829105320393
Energy: 1.9901521537656666
Energy: 1.7901829105280023
Energy: 1.9901521537656666
Energy: 1.7901829105320393
Energy: 1.8080818368722853
Energy: 2.0461684032426684
Energy: 1.8080818368722853
Energy: 2.0461684032426684
Energy: 1.8080818368763225
Energy: 2.0461684032426684
Energy: 1.8080818368722853
Energy: 2.2620886565748526
Energy: 2.0513036236913846
Energy: 2.2620886565708154
Energy: 2.05130362381243
Energy: 2.262088656595039
Energy: 2.0513036239294378
Energy: 2.2620886565748526
Energy: 2.16179601770389
Energy: 2.1437938771133593
Energy: 2.1617960177079274
Energy: 2.143793877117397
Energy: 2.1617960177079274
Energy: 2.143793877117397
Energy: 2.16179601770389
Energy: 1.9261272805017589
Energy: 2.110354551912635
Energy: 1.9261272805179082
Energy: 2.110354551912635
Energy: 1.9261272804977214
Energy: 2.110354551912635
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Energy: 2.1035198328968288
Energy: 1.976450591208623
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Energy: 1.976450591208623
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Energy: 1.976450591208623
Energy: 1.9242594564385223
Energy: 1.7547858699011245
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Energy: 1.7547858698970873
Energy: 1.9242594564385223
Energy: 1.7547858699011245
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Energy: 1.9915242303678846
Energy: 1.9607330120347144
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Energy: 1.960733012030677
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Energy: 1.9607330120347144
Energy: 1.991524230371922
Energy: 2.134721638829702
Energy: 2.2136498109824414
Energy: 2.134721638829702
Energy: 2.213649810986479
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Energy: 2.213649810986479
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Energy: 2.0410906310969277
Energy: 2.156610692147406
Energy: 2.041090634934697
Energy: 2.1566106921756676
Energy: 2.041090632303562
Energy: 2.156610692163556
Energy: 2.0410906317789346
Energy: 1.9384299088115973
Energy: 2.102370401974647
Energy: 1.9384299087994856
Energy: 2.102370401974647
Energy: 1.9384299087994856
Energy: 2.1023704019786837
Energy: 1.938429908803523
Energy: 1.8044930731121873
Energy: 2.063651291791756
Energy: 1.8044930731162245
Energy: 2.0636512917756065
Energy: 1.8044930731121873
Energy: 2.063651291807832
Energy: 1.8044930731162245
Energy: 1.8008752807111814
Energy: 2.020929354163955
Energy: 1.8008752807394424
Energy: 2.020929354163955
Energy: 1.8008752807152184
Energy: 2.020929354159917
Energy: 1.8008752807192558
Energy: 1.9470557780249251
Energy: 1.9791432696285007
Energy: 1.9470557780249251
Energy: 1.9791432696889864
Energy: 1.9470557780208881
Energy: 1.979143269676948
Energy: 1.9470557780289623
Energy: 1.8987639828849348
Energy: 2.0455263859682846
Energy: 1.8987639828808975
Energy: 2.0455263859723223
Energy: 1.8987639828808975
Energy: 2.0455263859723223
Energy: 1.8987639828728229
Energy: 2.1852500008995155
Energy: 2.239857642696949
Energy: 2.1852500009035527
Energy: 2.239857642700987
Energy: 2.1852500008833666
Energy: 2.239857642696949
Energy: 2.1852500008954783
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Energy: 2.2197938093668412
Energy: 2.1799575137954177
Energy: 2.2197938093668412
Energy: 2.179957513799455
Energy: 2.219793809370879
Energy: 2.1799575137954177
Energy: 1.905489077723051
Energy: 1.772489779644992
Energy: 1.905489077723051
Energy: 1.772489779644992
Energy: 1.905489077723051
Energy: 1.772489779644992
Energy: 1.905489077723051
Energy: 1.911351747286944
Energy: 1.7523522452005402
Energy: 1.911351747286944
Energy: 1.7523522452005402
Energy: 1.9113517472909813
Energy: 1.7523522452005402
Energy: 1.911351747286944
Energy: 1.9944273178760115
Energy: 2.1013212616999626
Energy: 1.9944273178760115
Energy: 2.101321261695926
Energy: 1.9944273178760115
Energy: 2.1013212616999626
Energy: 1.9944273178760115
Energy: 1.9194565850382141
Energy: 2.0770618513493995
Energy: 1.9194565850422514
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Energy: 1.9194565850422514
Energy: 2.0770618513493995
Energy: 1.9194565850180278
Energy: 2.1594519195312483
Energy: 2.098171190797413
Energy: 2.1594519195352855
Energy: 2.098171190797413
Energy: 2.1594519195352855
Energy: 2.098171190797413
Energy: 2.159451919527211
Energy: 2.1230573312242007
Energy: 2.401034055335488
Energy: 2.123057331232275
Energy: 2.401034055339525
Energy: 2.123057331232275
Energy: 2.4010340553314506
Energy: 2.123057331228238
Energy: 1.809246646795641
Energy: 2.0129807121246643
Energy: 1.809246646795641
Energy: 2.0129807121246643
Energy: 1.809246646795641
Energy: 2.0129807121246643
Energy: 1.809246646795641
Energy: 2.121301475639727
Energy: 1.8872498085702212
Energy: 2.121301475647802
Energy: 1.8872498085702212
Energy: 2.12130147563569
Energy: 1.8872498085702212
Energy: 2.1213014756316526
Energy: 1.8027531049239864
Energy: 1.9455324356963377
Energy: 1.8027531009409477
Energy: 1.9455324356963377
Energy: 1.8027531048836134
Energy: 1.9455324356963377
Energy: 1.8027531007795297
Energy: 2.084596357605824
Energy: 2.2321849012341977
Energy: 2.084596358009332
Energy: 2.2321850663181158
Energy: 2.084596357589675
Energy: 2.232184198110205
Energy: 2.084596357605824
Energy: 2.348147878870836
Energy: 2.4509259895663478
Energy: 2.348147878866799
Energy: 2.450925989562384
Energy: 2.348147878870836
Energy: 2.450925989562384
Energy: 2.082065637930733
Energy: 1.9200494196002251
Energy: 1.8384877107299442
Energy: 1.9200494196042626
Energy: 1.8384877107380184
Energy: 1.9200494196002251
Energy: 1.8384877107420559
Energy: 1.9200494196083
Energy: 1.983179896351965
Energy: 1.9202674166481897
Energy: 1.9831798963560021
Energy: 1.9202674166118543
Energy: 1.983179896351965
Energy: 1.920267416623966
Energy: 1.9831798963560021
Energy: 1.7869925311216641
Energy: 1.998683526643058
Energy: 1.7869925311257016
Energy: 1.998683526643058
Energy: 1.7869925311216641
Energy: 1.998683526643058
Energy: 1.7869925311257016
Energy: 1.830713038604031
Energy: 2.0052363123318746
Energy: 1.8307130386645902
Energy: 2.0052363123318746
Energy: 1.8307130385555834
Energy: 2.0052363123318746
Energy: 1.8307130386686274
Energy: 2.1577951656347216
Energy: 2.1427254200762396
Energy: 2.1577951656347216
Energy: 2.1427254200762396
Energy: 2.157795165630684
Energy: 2.1427254200722023
Energy: 2.1577951656347216
Energy: 2.1896922207163416
Energy: 2.054903413837322
Energy: 2.1896922207849014
Energy: 2.0549034120778
Energy: 2.1896922206557816
Energy: 2.054903415015622
Energy: 2.189692220651745
Energy: 1.989006629666372
Energy: 2.0969596723132913
Energy: 1.9890066296704092
Energy: 2.0969596723132913
Energy: 1.9890066296623345
Energy: 2.0969596723132913
Energy: 1.9890066296704092
Energy: 1.944796607512903
Energy: 2.000362152539117
Energy: 1.9447966075088658
Energy: 2.0003621525431545
Energy: 1.944796607496754
Energy: 2.0003621525471185
Energy: 1.9447966075088658
Energy: 1.9304796019581718
Energy: 1.852293489425265
Energy: 1.9304796019823955
Energy: 1.852293489425265
Energy: 1.9304796019177992
Energy: 1.852293489425265
Energy: 1.9304796019864328
Energy: 2.1827699720996545
Energy: 2.1153716835343603
Energy: 2.1827699720996545
Energy: 2.1153716835343603
Energy: 2.1827699720996545
Energy: 2.1153716835343603
Energy: 2.1827699720996545
Energy: 2.1297337871551885
Energy: 2.2135077153011835
Energy: 2.1297337871511512
Energy: 2.2135077153052207
Energy: 2.1297337871551885
Energy: 2.2135077153011835
Energy: 2.1297337871551885
Energy: 2.025580780589418
Energy: 2.1265234961632498
Energy: 2.0255807805934554
Energy: 2.1265234961632498
Energy: 2.0255807805934554
Energy: 2.1265234961632498
Energy: 2.0255807805934554
Energy: 1.9200377716160206
Energy: 2.0600095284343327
Energy: 1.9200377716160206
Energy: 2.0600095284343327
Energy: 1.9200377716160206
Energy: 2.0600095284343327
Energy: 1.9200377716160206
Energy: 1.789040168666771
Energy: 1.9774709366188112
Energy: 1.7890401686708082
Energy: 1.9774709366228487
Energy: 1.789040168666771
Energy: 1.9774709366188112
Energy: 1.789040168666771
Energy: 1.867675624339809
Energy: 2.0303148940406732
Energy: 1.8676756243438464
Energy: 2.0303148940406732
Energy: 1.867675624339809
Energy: 2.0303148940366356
Energy: 1.867675624339809
Energy: 1.9570683944103833
Energy: 2.041277349056352
Energy: 1.9570683944103833
Energy: 2.041277349056352
Energy: 1.9570683944103833
Energy: 2.041277349056352
Energy: 1.9570683944103833

minimum gb energy = 1.7523522452005402 eV
minimum distance =  2.39206406898352 Angstroms
sigma value = 401


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

Energy: 2.267971743792328
Energy: 2.2567235460150714
Energy: 2.1505345998219716
Energy: 2.2567235460128217
Energy: 2.267971743792328
Energy: 2.256723546014655
Energy: 2.150534599821055
Energy: 1.9538301074666113
Energy: 1.9201856470003298
Energy: 1.8295102013030244
Energy: 2.357475038267434
Energy: 1.9538301074675282
Energy: 1.9201864324175562
Energy: 1.8295102012979418
Energy: 1.9356381252192343
Energy: 2.165487887443233
Energy: 1.9341832832032968
Energy: 2.1581429501559084
Energy: 1.9356381252178176
Energy: 2.165487887440483
Energy: 1.9341832832065462
Energy: 1.8578130027643727
Energy: 2.061607819786991
Energy: 1.8578130027643727
Energy: 2.0845993972145203
Energy: 1.8578130027662054
Energy: 2.0616078197856584
Energy: 1.8578130027680386
Energy: 1.8962530945890217
Energy: 2.1229603558329178
Energy: 1.8962530944827025
Energy: 2.1256785750486347
Energy: 1.896253094483619
Energy: 2.122960355834751
Energy: 1.8962530943594686
Energy: 2.1186395136548657
Energy: 2.0159698203071
Energy: 2.118639513653449
Energy: 2.0159698203075167
Energy: 2.1186395136548657
Energy: 2.0159698203102665
Energy: 2.1186395136552822
Energy: 2.090902131725907
Energy: 2.0156017074551813
Energy: 2.0909021317249903
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Energy: 2.0909021317268235
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Energy: 2.101467029555466
Energy: 2.1331400642909655
Energy: 2.1016941706376033
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Energy: 2.1014670295567996
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Energy: 2.092188845613011
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Energy: 2.1007827487001447
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Energy: 1.9966768475737717
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Energy: 2.0085761192342226
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Energy: 1.9170027769630846
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Energy: 2.0149100254582626
Energy: 1.867188211133101
Energy: 2.014910025457346
Energy: 1.867188211133101
Energy: 2.014910025458763
Energy: 1.867188211131768
Energy: 1.8721741936446366
Energy: 2.1743522674453164
Energy: 1.9917599530172931
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Energy: 1.8721741936442196
Energy: 2.174352267450815
Energy: 1.9917599530167933
Energy: 2.150534599821055
Energy: 2.2567235460164885
Energy: 2.2679717437914113
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Energy: 2.256723546015988
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Energy: 1.829510201301608
Energy: 2.3574750382656013
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Energy: 1.9201899818684112
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Energy: 1.9538301074652784
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Energy: 2.158142950156825
Energy: 1.935638125211902
Energy: 2.165487887449232
Energy: 1.9341832832056298
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Energy: 1.9356381252114854
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Energy: 2.0845993972150203
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Energy: 2.084599397213187
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Energy: 2.015969820311183
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Energy: 2.133140064290049
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Energy: 2.090492081384332
Energy: 2.1009334925080534
Energy: 2.0921888456180104
Energy: 2.1007827487010613
Energy: 2.0904920813852486
Energy: 2.10093349250897
Energy: 2.092188845617594
Energy: 2.0085761192378895
Energy: 2.165761066662983
Energy: 1.9966768475706054
Energy: 2.1657610666235714
Energy: 2.0085761192364724
Energy: 2.165761066660733
Energy: 1.9966768475706054
Energy: 1.9170027769635012
Energy: 2.042847555169326
Energy: 1.9206227311925952
Energy: 2.042847555169826
Energy: 1.9170027769621683
Energy: 2.042847555167993
Energy: 1.9206227311920951
Energy: 1.8671882111326847
Energy: 2.0149100254578465
Energy: 1.867188211133101
Energy: 2.014910025458763
Energy: 1.8671882111336011
Energy: 2.0149100254578465
Energy: 1.8671882111321845
Energy: 1.9917599530182097
Energy: 2.1743522674467326
Energy: 1.87217419364372
Energy: 2.1743522674480658
Energy: 1.991759953016377
Energy: 2.1743522674513156
Energy: 1.8721741936446366
Energy: 2.267971743794661
Energy: 2.2567235460128217
Energy: 2.1505345998201384
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Energy: 2.2679717437932445
Energy: 2.2567235460132387
Energy: 2.1505345998214715
Energy: 1.9538301074680278
Energy: 1.9201842961694295
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Energy: 2.3574750382665175
Energy: 1.9538301074684445
Energy: 1.9201842710236072
Energy: 1.8295102012988584
Energy: 1.935638125213735
Energy: 2.165487887456981
Energy: 1.9341832832042134
Energy: 2.1581429501559084
Energy: 1.935638125210985
Energy: 2.165487887454731
Energy: 1.9341832832042134
Energy: 1.8578130027643727
Energy: 2.0616078197874916
Energy: 1.8578130027638726
Energy: 2.084599397209521
Energy: 1.8578130027662054
Energy: 2.061607819786575
Energy: 1.8578130027666222
Energy: 1.8962530950149667
Energy: 2.1229603558338344
Energy: 1.89625309485882
Energy: 2.125678575048135
Energy: 1.8962530949000649
Energy: 2.122960355835251
Energy: 1.8962530948661525
Energy: 2.1186395136530325
Energy: 2.0159698203089333
Energy: 2.1186395136548657
Energy: 2.0159698203084337
Energy: 2.118639513656199
Energy: 2.0159698203102665
Energy: 2.1186395136548657
Energy: 2.0909021317249903
Energy: 2.0156017074551813
Energy: 2.090902131724074
Energy: 2.0156017074547647
Energy: 2.090902131723158
Energy: 2.0156017074542656
Energy: 2.090902131725907
Energy: 2.132735996416052
Energy: 2.1014670295563826
Energy: 2.1331400642904654
Energy: 2.101694170639436
Energy: 2.132735996416052
Energy: 2.10146702955455
Energy: 2.1331400642909655
Energy: 2.092188845617094
Energy: 2.1007827487010613
Energy: 2.0904920813911643
Energy: 2.1009334925062197
Energy: 2.09218884561851
Energy: 2.1007827487010613
Energy: 2.0904920813911643
Energy: 1.996676847571022
Energy: 2.165761066692812
Energy: 2.008576119237389
Energy: 2.165761066671732
Energy: 1.9966768475737717
Energy: 2.1657610666643996
Energy: 2.0085761192346396
Energy: 1.9206227311930115
Energy: 2.042847555169826
Energy: 1.9170027769616682
Energy: 2.04284755516841
Energy: 1.9206227311930115
Energy: 2.042847555169326
Energy: 1.9170027769644178
Energy: 1.867188211131768
Energy: 2.014910025463762
Energy: 1.8671882111326847
Energy: 2.014910025462429
Energy: 1.8671882111336011
Energy: 2.0149100254628456
Energy: 1.867188211131268
Energy: 1.8721741936442196
Energy: 2.1743522674480658
Energy: 1.991759953016377
Energy: 2.1743522674480658
Energy: 1.8721741936446366
Energy: 2.174352267450399
Energy: 1.9917599530177097
Energy: 2.1505345998214715
Energy: 2.2567235460119055
Energy: 2.2679717437919114
Energy: 2.2567235460132387
Energy: 2.1505345998205554
Energy: 2.256723546012322
Energy: 2.2679717437919114
Energy: 1.8295102013021078
Energy: 2.357475038267018
Energy: 1.9538301074698612
Energy: 1.920185507926949
Energy: 1.8295102013030244
Energy: 2.3574750382683507
Energy: 1.953830107471194

minimum gb energy = 1.8295102012979418 eV
minimum distance =  2.41702572220538 Angstroms
sigma value = 311


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

Energy: 2.062463185991889
Energy: 1.9740864874114565
Energy: 2.0624631859929474
Energy: 1.9740864874103985
Energy: 2.062463185991889
Energy: 1.9740864874109276
Energy: 2.06246318599136
Energy: 1.8153634981016156
Energy: 1.8338663049604176
Energy: 1.8153634981005575
Energy: 1.8338663049604176
Energy: 1.8153634981005575
Energy: 1.8338663049598884
Energy: 1.8153634981005575
Energy: 1.7667649772455463
Energy: 2.007859570563373
Energy: 1.7667649772439586
Energy: 2.0078595705797775
Energy: 1.7667649772455463
Energy: 2.0078595705718394
Energy: 1.766764977245017
Energy: 2.0277578293639915
Energy: 2.120761259462259
Energy: 2.0277578293645213
Energy: 2.120761259462259
Energy: 2.0277578293639915
Energy: 2.1207612594612004
Energy: 2.0277578293639915
Energy: 2.079502147116616
Energy: 2.140051645311039
Energy: 2.0795021471039155
Energy: 2.1400516448963627
Energy: 2.079502147044649
Energy: 2.140051645236955
Energy: 2.0795021472165804
Energy: 1.9123217478758725
Energy: 2.0857579455412223
Energy: 1.9123217466963545
Energy: 2.0857579455417516
Energy: 1.9123217462435782
Energy: 2.0857579455412223
Energy: 1.9123217442463496
Energy: 1.9469304713601012
Energy: 2.1309763876370242
Energy: 1.9469304713373468
Energy: 2.1309763876370242
Energy: 1.9469304713585136
Energy: 2.1309763876370242
Energy: 1.9469304713108884
Energy: 1.9717281883480882
Energy: 2.0975886965674095
Energy: 1.9717281883480882
Energy: 2.09758869656688
Energy: 1.971728188347559
Energy: 2.0975886965679384
Energy: 1.9717281883480882
Energy: 2.158001456962124
Energy: 2.0284156396185518
Energy: 2.1580014569615953
Energy: 2.0284156395868016
Energy: 2.158001456961066
Energy: 2.0284156396069095
Energy: 2.158001456961066
Energy: 1.8062975649892798
Energy: 1.9630481772250292
Energy: 1.8062975649892798
Energy: 1.9630481772250292
Energy: 1.8062975649892798
Energy: 1.9630481772250292
Energy: 1.8062975649892798
Energy: 1.8017885872877957
Energy: 1.9228401022875004
Energy: 1.8017885872872663
Energy: 1.9228401022869712
Energy: 1.801788587285679
Energy: 1.9228401022864419
Energy: 1.801788587285679
Energy: 2.0654466598884813
Energy: 1.991778708265251
Energy: 2.06544665988266
Energy: 1.9917787082546676
Energy: 2.0654466598789565
Energy: 1.9917787082266214
Energy: 2.0654466598768395
Energy: 2.0951099052608186
Energy: 2.2456936350751047
Energy: 2.095109905101058
Energy: 2.245693635069813
Energy: 2.095109904765709
Energy: 2.245693635073517
Energy: 2.095109905545368
Energy: 1.9155578036730159
Energy: 2.013407519758068
Energy: 1.9155578036724867
Energy: 2.013407519761243
Energy: 1.9155578036724867
Energy: 2.0134075197596553
Energy: 1.9155578036724867
Energy: 1.9845706268628538
Energy: 2.1069993639112132
Energy: 1.9845706268623244
Energy: 2.106999363912801
Energy: 1.984570626863912
Energy: 2.106999363911743
Energy: 1.984570626863383
Energy: 1.9222253108241
Energy: 2.057568231161465
Energy: 1.9222253108235712
Energy: 2.057568230624599
Energy: 1.9222253108246292
Energy: 2.0575682308160617
Energy: 1.9222253108230418
Energy: 1.8790411736263548
Energy: 1.9517219732407303
Energy: 1.8790411736263548
Energy: 1.9517219732417885
Energy: 1.8790411736274133
Energy: 1.9517219732423179
Energy: 1.8790411736263548
Energy: 1.8218783334362632
Energy: 1.9656457402900678
Energy: 1.8218783334362632
Energy: 1.9656457402900678
Energy: 1.8218783334373219
Energy: 1.965645740290597
Energy: 1.8218783334373219
Energy: 1.9637101114558515
Energy: 2.112130628602231
Energy: 1.9637101114701394
Energy: 2.112130628602761
Energy: 1.963710111453735
Energy: 2.112130628602761
Energy: 1.9637101114844269
Energy: 2.0409414663514305
Energy: 2.0893050308108494
Energy: 2.0409414117162097
Energy: 2.0893050308108494
Energy: 2.0409413762416744
Energy: 2.0893050308108494
Energy: 2.040941255494421
Energy: 1.9531054903611158
Energy: 1.9647713897568315
Energy: 1.9531054903605867
Energy: 1.96477138975789
Energy: 1.9531054903621743
Energy: 1.9647713897573607
Energy: 1.9531054903605867
Energy: 1.961082478363241
Energy: 2.1786505788391137
Energy: 1.961082478363241
Energy: 2.1786505788391137
Energy: 1.961082478363241
Energy: 2.178650578837526
Energy: 1.9610824783627117
Energy: 2.1004715967773713
Energy: 1.964101504571
Energy: 2.1004715967773713
Energy: 1.964101504571
Energy: 2.100471596776842
Energy: 1.964101504570471
Energy: 2.1004715967773713
Energy: 2.0222625995615466
Energy: 2.0421502512351997
Energy: 2.022262599559959
Energy: 2.0421502512336605
Energy: 2.0222625995615466
Energy: 2.0421502512341894
Energy: 2.0222625995604884
Energy: 1.7918890500563405
Energy: 1.9104878940096373
Energy: 1.7918890500568698
Energy: 1.9104878926809898
Energy: 1.7918890500563405
Energy: 1.9104878922107509
Energy: 1.7918890500558113
Energy: 1.9971661104224632
Energy: 1.9520873598148618
Energy: 1.9971661104235219
Energy: 1.9520873597170136
Energy: 1.9971661104229925
Energy: 1.9520873597186013
Energy: 1.9971661104229925
Energy: 2.034000624927907
Energy: 2.0149357608578424
Energy: 2.0340006249294946
Energy: 2.0149357608583713
Energy: 2.0340006249353157
Energy: 2.0149357608578424
Energy: 2.034000624936374
Energy: 2.096150212788249
Energy: 2.0903530809219784
Energy: 2.096150213039508
Energy: 2.090353080923566
Energy: 2.096150213071739
Energy: 2.0903530809225077
Energy: 2.0961502132695524
Energy: 1.9347567651967408
Energy: 1.9958472158299303
Energy: 1.9347567651872157
Energy: 1.9958472158299303
Energy: 1.9347567651766804
Energy: 1.9958472158299303
Energy: 1.9347567651766804
Energy: 2.0396031885109918
Energy: 2.0819006704865495
Energy: 2.039603188593013
Energy: 2.081900670487608
Energy: 2.0396031886077814
Energy: 2.0819006704860206
Energy: 2.039603188670753
Energy: 1.974505835129466
Energy: 2.0471091683148157
Energy: 1.9745058359440018
Energy: 2.0471091683142864
Energy: 1.974505836726306
Energy: 2.0471091683142864
Energy: 1.9745058382718645
Energy: 1.8044618189234685
Energy: 1.9598359769937916
Energy: 1.8044618189234685
Energy: 1.9598359769932627
Energy: 1.8044618189234685
Energy: 1.9598359769932627
Energy: 1.8044618189234685
Energy: 1.80448864215024
Energy: 1.807703118393768
Energy: 1.804488642149182
Energy: 1.8077031183932386
Energy: 1.8044886421497108
Energy: 1.8077031183932386
Energy: 1.80448864215024
Energy: 2.032215730493291
Energy: 2.0744534463378344
Energy: 2.0322157331522694
Energy: 2.074453446339951
Energy: 2.0322157310481486
Energy: 2.0744534463388926
Energy: 2.032215732145165
Energy: 1.9906028414078
Energy: 2.131073526031081
Energy: 1.9906028414062127
Energy: 2.1310735260316105
Energy: 1.9906028414062127
Energy: 2.131073526031081
Energy: 1.9906028414067418
Energy: 1.9050590785522492
Energy: 2.0018180807611663
Energy: 1.9050590785517199
Energy: 2.0018180807616957
Energy: 1.905059078551191
Energy: 2.0018180807611663
Energy: 1.9050590785506616

minimum gb energy = 1.7667649772439586 eV
minimum distance =  2.35343923509091 Angstroms
sigma value = 39


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

Energy: 2.0604152840437653
Energy: 2.1257708548048155
Energy: 2.0604152840443897
Energy: 2.1257708548048155
Energy: 2.0604152840450145
Energy: 2.1257708548048155
Energy: 2.0604152840437653
Energy: 1.8832191505681204
Energy: 1.830257607651379
Energy: 1.8832191505681204
Energy: 1.830257607651379
Energy: 1.8832191505662468
Energy: 1.8302576076507546
Energy: 1.8832191505668712
Energy: 2.266271574657177
Energy: 1.7757824421836155
Energy: 2.266271574658426
Energy: 1.775782441151735
Energy: 2.266271574659675
Energy: 1.7757824436380705
Energy: 2.2662715746590503
Energy: 2.0237138207926675
Energy: 1.7322405882758745
Energy: 2.023713820793292
Energy: 1.7322405882752496
Energy: 2.0237138207926675
Energy: 1.7322405882752496
Energy: 2.0237138207939163
Energy: 1.8780531034463006
Energy: 1.7715914978432619
Energy: 1.8780531034456762
Energy: 1.7715914978445109
Energy: 1.8780531034456762
Energy: 1.771591497845135
Energy: 1.8780531034463006
Energy: 1.9819487674960743
Energy: 1.9371542410853615
Energy: 1.9819487674960743
Energy: 1.9371542410878595
Energy: 1.98194876749545
Energy: 1.937154241087235
Energy: 1.9819487674966991
Energy: 2.024471823732001
Energy: 1.8565376932756545
Energy: 2.0244718237313766
Energy: 1.8565376932512982
Energy: 2.024471823730752
Energy: 1.85653769327503
Energy: 2.024471823730752
Energy: 2.3451099620828386
Energy: 1.8512435039272614
Energy: 2.345109962083463
Energy: 1.851243503927886
Energy: 2.3451099620828386
Energy: 1.851243503927886
Energy: 2.3451099620828386
Energy: 2.0159343453172838
Energy: 1.8543430702609032
Energy: 2.0159343453160345
Energy: 1.8543430702615276
Energy: 2.0159343453166594
Energy: 1.8543430702609032
Energy: 2.015934345317908
Energy: 1.844950520172885
Energy: 2.1616554694575525
Energy: 1.84495052017351
Energy: 2.1616554694556793
Energy: 1.8449505201722607
Energy: 2.1616554694556793
Energy: 1.844950520171636
Energy: 2.0638438388047513
Energy: 1.8559869915564247
Energy: 2.06384383885846
Energy: 1.8559869915576732
Energy: 2.0638438388628315
Energy: 1.8559869915557998
Energy: 2.241197974847993
Energy: 2.080574644778734
Energy: 1.7406187868190302
Energy: 2.0805746447793587
Energy: 1.7406187868196543
Energy: 2.0805746447781095
Energy: 1.7406187868184058
Energy: 2.0805746447812323
Energy: 2.078582426669557
Energy: 1.786032443319525
Energy: 2.0785824266708057
Energy: 1.7860324433189003
Energy: 2.078582426669557
Energy: 1.786032443319525
Energy: 2.078582426670182
Energy: 2.194902814932584
Energy: 1.7323293927796881
Energy: 2.1949028149332084
Energy: 1.7323293927784393
Energy: 2.194902814932584
Energy: 1.7323293927796881
Energy: 2.1949028149332084
Energy: 1.9038408612023532
Energy: 1.8890771010165386
Energy: 1.9038408612036022
Energy: 1.8890771010165386
Energy: 1.9038408612048514
Energy: 1.889077101017163
Energy: 1.903840861204227
Energy: 2.187937383238717
Energy: 1.8032101655918504
Energy: 2.187937383236219
Energy: 1.803210165591226
Energy: 2.187937383235595
Energy: 1.8032101655918504
Energy: 2.187937383235595
Energy: 1.9907098891067003
Energy: 1.8651405154191376
Energy: 1.9907098891067003
Energy: 1.8651405154191376
Energy: 1.9907098891060757
Energy: 1.8651405154203864
Energy: 1.9907098891060757
Energy: 2.1571936736629955
Energy: 1.849037038942765
Energy: 2.15719367366362
Energy: 1.8490370389446389
Energy: 2.1571936736623716
Energy: 1.8490370389421409
Energy: 2.1571936736642443
Energy: 1.9161591262764666
Energy: 1.8459598134879265
Energy: 1.9161591262752176
Energy: 1.8459598134879265
Energy: 1.9161591262802138
Energy: 1.8459598134885509
Energy: 1.916159126281463
Energy: 1.9527128875171298
Energy: 2.191776381135897
Energy: 1.9527128875158808
Energy: 2.1917763811365214
Energy: 1.9527128875158808
Energy: 2.191776381135897
Energy: 1.9527128875158808
Energy: 1.8922191077160628
Energy: 1.7404769037924093
Energy: 1.8922191077154384
Energy: 1.7404769037924093
Energy: 1.8922191077160628
Energy: 1.7404769037924093
Energy: 1.8922191077166877
Energy: 2.332304609113169
Energy: 1.7344846565302685
Energy: 2.3323046091119197
Energy: 1.7344846565302685
Energy: 2.3323046091106705
Energy: 1.7344846565290193
Energy: 2.332304609111295
Energy: 2.3516102415259263
Energy: 1.796240867826323
Energy: 2.3516102415259263
Energy: 1.7962408678244495
Energy: 2.3516102415271756
Energy: 1.7962408678256987
Energy: 2.3516102415271756
Energy: 1.898885904303437
Energy: 1.8755340829700289
Energy: 1.8988859043046862
Energy: 1.8755340829931362
Energy: 1.8988859043040618
Energy: 1.8755340829700289
Energy: 1.8988859043040618
Energy: 1.956221501687336
Energy: 1.8748705221752853
Energy: 1.956221501687336
Energy: 1.8748705221752853
Energy: 1.9562215016867117
Energy: 1.8748705221740365
Energy: 1.956221501686087
Energy: 1.9842297451471216
Energy: 1.8619273330207222
Energy: 1.984229745120892
Energy: 1.8619273330194732
Energy: 1.9842297451583633
Energy: 1.8619273330194732
Energy: 1.9842297451308843
Energy: 2.2029560648723114
Energy: 1.8873913387254744
Energy: 2.2029560648741855
Energy: 1.8873913387260988
Energy: 2.2029560648766835
Energy: 1.88739133872485
Energy: 2.2029560648723114
Energy: 1.8833521235154442
Energy: 1.896930559640415
Energy: 1.8833521235166928
Energy: 1.896930559641039
Energy: 1.8833521235160684
Energy: 1.896930559640415
Energy: 1.883352123514195
Energy: 2.060415284045582
Energy: 2.1257708548048155
Energy: 2.0604152840443897
Energy: 2.1257708548048155
Energy: 2.0604152840431404
Energy: 2.1257708548048155
Energy: 2.0604152840437653
Energy: 1.8832191505681204
Energy: 1.8302576076507546
Energy: 1.883219150567496
Energy: 1.830257607651379
Energy: 1.8832191505662468
Energy: 1.8302576076507546
Energy: 1.883219150567496

minimum gb energy = 1.7322405882752496 eV
minimum distance =  2.3899517839556 Angstroms
sigma value = 21


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

Energy: 1.9760690794998026
Energy: 2.034019702424334
Energy: 1.9760690794982863
Energy: 2.034019702427367
Energy: 1.9760690794990443
Energy: 2.0340197024281252
Energy: 1.9760690795005609
Energy: 1.9056284190278554
Energy: 1.8200493387330778
Energy: 1.9056284190270971
Energy: 1.8200493387323196
Energy: 1.9056284190278554
Energy: 1.8200493387315615
Energy: 1.905628419028613
Energy: 1.9623265465900235
Energy: 1.7287508355161527
Energy: 1.9623265465953306
Energy: 1.7287505204142382
Energy: 1.9623265466021538
Energy: 1.7287504423043127
Energy: 1.9623265465991215
Energy: 1.8791414506293012
Energy: 1.9179009896441663
Energy: 1.8791414506293012
Energy: 1.9179009896479569
Energy: 1.8791414506293012
Energy: 1.9179009896441663
Energy: 1.879141450628543
Energy: 1.6201833758642201
Energy: 1.8402287551163636
Energy: 1.6201833758642201
Energy: 1.8402287551209124
Energy: 1.6201833758642201
Energy: 1.8402287551140892
Energy: 1.6201833758642201
Energy: 1.620329466632662
Energy: 1.8368851390983298
Energy: 1.6203294666364527
Energy: 1.8368851390990881
Energy: 1.620329466637969
Energy: 1.8368851390975716
Energy: 1.6203294666410015
Energy: 1.5520771586409585
Energy: 2.32100305314337
Energy: 1.5520771586492983
Energy: 2.321003053142612
Energy: 1.5520771586568793
Energy: 2.32100305314337
Energy: 1.552077158650056
Energy: 1.6454896800911134
Energy: 1.8298199283812866
Energy: 1.6454896800903551
Energy: 1.8298199283812866
Energy: 1.6454896800911134
Energy: 1.8298199283820449
Energy: 1.6454896800903551
Energy: 1.7924561544588233
Energy: 1.7969672188207744
Energy: 1.7924561544588233
Energy: 1.7969672188200163
Energy: 1.7924561544588233
Energy: 1.7969672188207744
Energy: 1.7924561544633721
Energy: 1.6371071284367706
Energy: 2.252666622896306
Energy: 1.637107128437529
Energy: 2.252666622896306
Energy: 1.6371071284405612
Energy: 2.252666622896306
Energy: 1.6371071284466263
Energy: 1.5482433983628547
Energy: 1.8197848197134463
Energy: 1.5482433983598223
Energy: 1.8197848197142041
Energy: 1.5482433983605801
Energy: 1.8197848197134463
Energy: 1.548243398363613
Energy: 1.6516698660995561
Energy: 1.93953532375854
Energy: 1.6516698660995561
Energy: 1.9395353237600566
Energy: 1.6516698660987978
Energy: 1.9395353237592983
Energy: 1.6516698660987978
Energy: 1.7226444101783436
Energy: 1.7479258425296198
Energy: 1.7226444101783436
Energy: 1.7479258425296198
Energy: 1.7226444101798597
Energy: 1.747925842530378
Energy: 1.7226444101775855
Energy: 1.9165409956053592
Energy: 2.060016733564506
Energy: 1.9165409956182131
Energy: 2.0600167335614734
Energy: 1.9165409956166968
Energy: 2.0600167335516177
Energy: 1.9165409956326174
Energy: 1.7900799650100165
Energy: 1.909613351256976
Energy: 1.7900799649888233
Energy: 1.909613351257734
Energy: 1.7900799650160817
Energy: 1.909613351256976
Energy: 1.7900799650191146
Energy: 2.0326290626992076
Energy: 1.9913402518692513
Energy: 2.0326290626992076
Energy: 1.9913402518692513
Energy: 2.0326290626992076
Energy: 1.9913402518692513
Energy: 2.032629062699966
Energy: 1.9421631671370514
Energy: 1.7267800537597586
Energy: 1.9421631671370514
Energy: 1.7267800537612747
Energy: 1.9421631671370514
Energy: 1.7267800537605167
Energy: 1.9421631671378095
Energy: 1.9781991931560965
Energy: 2.058079696985213
Energy: 1.9781991929605995
Energy: 2.058078878469285
Energy: 1.9781991942867605
Energy: 2.0580771205221726
Energy: 1.9781991944269477
Energy: 1.7717498307038466
Energy: 1.9098287129551055
Energy: 1.771749830704605
Energy: 1.9098287129551055
Energy: 1.7717498307038466
Energy: 1.9098287129551055
Energy: 1.7717498307038466
Energy: 1.6510446637648581
Energy: 1.708334360706794
Energy: 1.6510446637648581
Energy: 1.7083343607090686
Energy: 1.6510446637633416
Energy: 1.7083343607083106
Energy: 1.6510446637648581
Energy: 1.6415311570414926
Energy: 1.7994238533986568
Energy: 1.6415311570414926
Energy: 1.7994238533963824
Energy: 1.6415311570414926
Energy: 1.7994238533971407
Energy: 1.6415311570414926
Energy: 1.5658522363927592
Energy: 2.0609053704765006
Energy: 1.5658522371914951
Energy: 2.060905369529996
Energy: 1.5658522368898582
Energy: 2.060905368704002
Energy: 1.5658522377772623
Energy: 1.7494909888345986
Energy: 1.79481910383433
Energy: 1.7494909888345986
Energy: 1.7948191038381205
Energy: 1.7494909888345986
Energy: 1.7948191038366041
Energy: 1.7494909888353567
Energy: 1.7352034058138945
Energy: 1.8564336095711205
Energy: 1.7352034058146528
Energy: 1.8564336095733949
Energy: 1.7352034058138945
Energy: 1.8564336095718788
Energy: 1.7352034058146528
Energy: 1.6452634743634251
Energy: 1.80405739605621
Energy: 1.6452634743634251
Energy: 1.80405739605621
Energy: 1.6452634743634251
Energy: 1.80405739605621
Energy: 1.6452634743634251

minimum gb energy = 1.5482433983598223 eV
minimum distance =  2.47828234792429 Angstroms
sigma value = 113


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

Energy: 1.7206061085783146
Energy: 1.7577684753568206
Energy: 1.7206061085736992
Energy: 1.7577684949798964
Energy: 1.7206061085783146
Energy: 1.757768481092613
Energy: 1.7206061085779303
Energy: 1.671891290032966
Energy: 1.6943529264899093
Energy: 1.6718912900317353
Energy: 1.6943529264958326
Energy: 1.6718912900317353
Energy: 1.6943529264971404
Energy: 1.671891290033428
Energy: 1.9362935712327778
Energy: 1.7667489225268065
Energy: 1.9362935712310851
Energy: 1.766748922533961
Energy: 1.936293571258165
Energy: 1.7667489225310375
Energy: 1.9362935712510105
Energy: 1.5016866666163011
Energy: 1.8037429641085556
Energy: 1.5016866666171473
Energy: 1.8037429641085556
Energy: 1.5016866666133006
Energy: 1.8037429641077092
Energy: 1.5016866666433806
Energy: 1.603541480435253
Energy: 1.8436574508355574
Energy: 1.6035414804335604
Energy: 1.8436574512576758
Energy: 1.603541480433099
Energy: 1.84365745084402
Energy: 1.6035414804327144
Energy: 1.500019402574729
Energy: 1.5316040324302056
Energy: 1.50001940257596
Energy: 1.5316040324302056
Energy: 1.5000194025789604
Energy: 1.5316040324310518
Energy: 1.5000194025755753
Energy: 1.7533232542493855
Energy: 1.6311575876453452
Energy: 1.753323254246847
Energy: 1.6311575846192026
Energy: 1.7533232542456163
Energy: 1.6311575849339257
Energy: 1.753323254248155
Energy: 1.5069582954776124
Energy: 1.500490117003701
Energy: 1.5069582954788434
Energy: 1.5004901170074705
Energy: 1.5069582954796896
Energy: 1.500490117003701
Energy: 1.5069582954801513
Energy: 1.67922061075357
Energy: 1.490385405304437
Energy: 1.6792206107514933
Energy: 1.4903854052905126
Energy: 1.6792206107523395
Energy: 1.4903854053035908
Energy: 1.6792206107531855
Energy: 1.5185731962489186
Energy: 1.471951779134728
Energy: 1.5185731962489186
Energy: 1.471951779134728
Energy: 1.5185731962502265
Energy: 1.471951779134728
Energy: 1.5185731962510727
Energy: 1.6007048401411055
Energy: 1.5200897576739987
Energy: 1.6007048401402593
Energy: 1.5200897577310815
Energy: 1.6007048401397976
Energy: 1.5200897577619303
Energy: 1.6007048401406436
Energy: 1.462709306571831
Energy: 1.5351737815132238
Energy: 1.4627093065735235
Energy: 1.5351737815132238
Energy: 1.4627093065726775
Energy: 1.5351737815162239
Energy: 1.4627093065722157
Energy: 1.3843643656951423
Energy: 1.8615503469709669
Energy: 1.3843643656929883
Energy: 1.8615503469726593
Energy: 1.3843643656929883
Energy: 1.861550346971813
Energy: 1.3843643656900648
Energy: 1.5886227008156084
Energy: 1.4903024806951697
Energy: 1.5886227008177622
Energy: 1.4903024806980931
Energy: 1.5886227008156084
Energy: 1.4903024806943235
Energy: 1.5886227008169163
Energy: 1.648299093124117
Energy: 1.5000844860849423
Energy: 1.6482990931064228
Energy: 1.5000844860874811
Energy: 1.6482990931224246
Energy: 1.5000844860866347
Energy: 1.6482990931224246
Energy: 1.4614312061742267
Energy: 1.8554864456802878
Energy: 1.4614312061737649
Energy: 1.8554864456819806
Energy: 1.4614312061750727
Energy: 1.8554864456819806
Energy: 1.4614312061737649
Energy: 1.3847675562870168
Energy: 1.5505542604212406
Energy: 1.384767556278093
Energy: 1.5505542604203941
Energy: 1.38476755622478
Energy: 1.5505542604199323
Energy: 1.3847675562489363
Energy: 1.5354115480892143
Energy: 1.6400714402539518
Energy: 1.5354115480900605
Energy: 1.6400714402522591
Energy: 1.5354115480892143
Energy: 1.6400714402543364
Energy: 1.5354115480909067
Energy: 1.642364244466553
Energy: 1.4776651528659666
Energy: 1.6423642444660913
Energy: 1.4776651528697362
Energy: 1.6423642444648607
Energy: 1.4776651528701978
Energy: 1.6423642444631679
Energy: 1.4997400494746682
Energy: 1.840353647419146
Energy: 1.4997400494742066
Energy: 1.8403536525433402
Energy: 1.4997400494822841
Energy: 1.8403536516717163
Energy: 1.4997400494839768
Energy: 1.879095840544116
Energy: 1.5417281063569843
Energy: 1.879095840544116
Energy: 1.5417281063629078
Energy: 1.879095840541962
Energy: 1.5417281063726012
Energy: 1.8790958405461933
Energy: 1.6680091865196096
Energy: 1.571472655063674
Energy: 1.6680091865242257
Energy: 1.571472655237537
Energy: 1.668009186525918
Energy: 1.5714726551559137
Energy: 1.6680091865246873
Energy: 1.617692542593075
Energy: 1.4299489353391408
Energy: 1.6176925425960755
Energy: 1.4299489353412178
Energy: 1.617692542597306
Energy: 1.4299489353539114
Energy: 1.6176925425977677
Energy: 1.5141331297913212
Energy: 1.9393419949186268
Energy: 1.5141331297879363
Energy: 1.9393419949169346
Energy: 1.5141331297891671
Energy: 1.9393419949003945
Energy: 1.5141331297883212
Energy: 1.630444189839305
Energy: 1.7231640637888361
Energy: 1.6304441898033015
Energy: 1.7231640637866819
Energy: 1.63044418936095
Energy: 1.723164063790067
Energy: 1.6304441886381873
Energy: 1.6503981342628566
Energy: 1.7100213303214702
Energy: 1.6504723815169184
Energy: 1.7100213303231626
Energy: 1.6504829400850867
Energy: 1.710021330322778
Energy: 1.6505166698775653
Energy: 1.6790647487491617
Energy: 1.814573524619783
Energy: 1.6790647487613937
Energy: 1.8145735246113204
Energy: 1.679064748779626
Energy: 1.8145735246075512
Energy: 1.6790647487669328
Energy: 1.67734450812675
Energy: 1.863607015810359
Energy: 1.677344508146598
Energy: 1.8636070129864672
Energy: 1.6773445081406744
Energy: 1.863607026469865
Energy: 1.677344508149137
Energy: 1.82655234472545
Energy: 1.6214613796993969
Energy: 1.8265523447799936
Energy: 1.6214613792892025
Energy: 1.826552344839692
Energy: 1.62146137956623
Energy: 1.8265523447246035
Energy: 1.7790700751205653
Energy: 1.7130916233404128
Energy: 1.7790700751180268
Energy: 1.7130916233361815
Energy: 1.7790700751227193
Energy: 1.7130916233454903
Energy: 1.779070075121873
Energy: 1.5563839730227789
Energy: 1.8604017818382141
Energy: 1.556383973342887
Energy: 1.8604017818314442
Energy: 1.55638397357891
Energy: 1.8604017818297518
Energy: 1.5563839738525522
Energy: 1.5629493373644314
Energy: 1.932987829806378
Energy: 1.562949337339429
Energy: 1.932987829806378
Energy: 1.5629493373568153
Energy: 1.9329878298033778
Energy: 1.5629493373588925
Energy: 1.8718138191467848
Energy: 1.5261115782195813
Energy: 1.871813819147631
Energy: 1.5261115778195422
Energy: 1.871813819147631
Energy: 1.5261115778368515
Energy: 1.8718138191489389
Energy: 1.6548101038116572
Energy: 1.6392280116312885
Energy: 1.6548101038141956
Energy: 1.6392280116321345
Energy: 1.6548101038120415
Energy: 1.6392280116321345
Energy: 1.6548101038137342
Energy: 1.6248154347403452
Energy: 1.794741044819846
Energy: 1.6248154347424992
Energy: 1.7947410448600036
Energy: 1.6248154347408068
Energy: 1.7947410448532337
Energy: 1.624815434741653
Energy: 1.5836158203601662
Energy: 1.8025080713662012
Energy: 1.5836158202150752
Energy: 1.8025080713641237
Energy: 1.5836158202413082
Energy: 1.8025080713658166
Energy: 1.5836158201698398
Energy: 1.833467048778651
Energy: 1.4690055195061726
Energy: 1.8334670487764972
Energy: 1.4690055195070189
Energy: 1.83346704878119
Energy: 1.4690055195061726
Energy: 1.8334670487756508
Energy: 1.5261532886122464
Energy: 1.4612244269583154
Energy: 1.5261532886118618
Energy: 1.461224426952392
Energy: 1.5261532886135543
Energy: 1.4612244269536998
Energy: 1.5261532886114006
Energy: 1.455400538648131
Energy: 1.4704215155000115
Energy: 1.4554005386489774
Energy: 1.470421515480548
Energy: 1.455400538648131
Energy: 1.4704215154966265
Energy: 1.4554005386476696
Energy: 1.38951018060027
Energy: 1.745147554803608
Energy: 1.3895101805786525
Energy: 1.7451475570003616
Energy: 1.3895101805537269
Energy: 1.7451475564750796
Energy: 1.3895101805498804
Energy: 1.5472038971053694
Energy: 1.4866985702030102
Energy: 1.5472038971062159
Energy: 1.486698570202164
Energy: 1.5472038971066004
Energy: 1.4866985702030102
Energy: 1.5472038971087545
Energy: 1.5601470879858292
Energy: 1.451085584053792
Energy: 1.5601470879799053
Energy: 1.4510855840461756
Energy: 1.5601470879828288
Energy: 1.4510855840534072
Energy: 1.5601470879709816
Energy: 1.5684778407217226
Energy: 1.8071415137235043
Energy: 1.568477840722184
Energy: 1.807141513722658
Energy: 1.568477840722184
Energy: 1.8071415137248121
Energy: 1.5684778407217226
Energy: 1.4697497899048966
Energy: 1.4661900354291895
Energy: 1.4697497899045118
Energy: 1.466190035423266
Energy: 1.469749789905358
Energy: 1.4661900354274973
Energy: 1.4697497899032042
Energy: 1.5269934015288953
Energy: 1.5377527850871144
Energy: 1.5269934015280493
Energy: 1.5377527850862682
Energy: 1.5269934015259718
Energy: 1.537752785078729
Energy: 1.5269934015268183

minimum gb energy = 1.3843643656900648 eV
minimum distance =  2.46610069020454 Angstroms
sigma value = 365


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

Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 3.8430002259794023
Energy: 1.9162008510903183
Energy: 3.8430002259803557
Energy: 1.916200851091272
Energy: 3.8430002259794023
Energy: 1.9162008510903183
Energy: 3.7668238832067558
Energy: 0.5601137309169402
Energy: 0.618787417613708
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417613708
Energy: 0.5601137309159862
Energy: 3.8430002259803557
Energy: 1.9162008510903183
Energy: 3.8430002259803557
Energy: 1.916200851091272
Energy: 3.8430002259794023
Energy: 1.9162008510903183
Energy: 3.8430002259794023
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 3.0870653958453578
Energy: 1.916200851091272
Energy: 3.0870653958444043
Energy: 1.9162008510903183
Energy: 3.0870653958453578
Energy: 1.916200851091272
Energy: 2.9780887085871486
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 3.0870653958453578
Energy: 1.9162008510903183
Energy: 2.9780887085900103
Energy: 1.916200851091272
Energy: 2.978088708593826
Energy: 1.916200851091272
Energy: 2.978088708593826
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.6187874176156161
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 3.0870653958444043
Energy: 1.916200851091272
Energy: 3.0870653958444043
Energy: 1.916200851091272
Energy: 3.0870653958444043
Energy: 1.916200851091272
Energy: 3.0870653958453578
Energy: 0.5601137309169402
Energy: 0.6187874176156161
Energy: 0.5601137309159862
Energy: 0.618787417613708
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 2.962556477489508
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.9162008510903183
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.9162008510903183
Energy: 2.9625564774904625
Energy: 0.5601137309169402
Energy: 0.618787417613708
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 2.9625564774914164
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.9162008510903183
Energy: 2.9625564774904625
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 0.5601137309159862
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 0.618787417614662
Energy: 0.5601137309169402
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625
Energy: 1.916200851091272
Energy: 2.9625564774904625

minimum gb energy = 0.5601137309159862 eV
minimum distance =  2.47502879235106 Angstroms
sigma value = 23