Model name: model_name=Sim_LAMMPS_MEAM_EtesamiAsadi_2018_Cu__SM_316120381362_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620000004768371
cohesive_energy=3.5402784093724726
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.015442659774346022
Energy: 0.32439162014129125
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.32439162014129125
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.3243916201427327
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 1.01583948255937
Energy: 0.015639374347539835
Energy: 0.015639374347539835
Energy: 1.01583948255937
Energy: 0.015639374347539835
Energy: 0.015639374347539835
Energy: 1.01583948255937
Energy: 0.015639374347539835
Energy: 0.015639374347539835
Energy: 1.01583948255937
Energy: 0.3219041068590292
Energy: 0.32187536830756946
Energy: 0.018400054372959145
Energy: 0.3219041068590292
Energy: 0.32187536830756946
Energy: 0.018400054372959145
Energy: 0.3219041068590292
Energy: 0.32187536830756946
Energy: 0.018400054372959145
Energy: 0.3219041068590292
Energy: 0.015442659774346022
Energy: 0.3243916201427327
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.32439162014129125
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.3243916201427327
Energy: 0.32439162014129125
Energy: 0.015442659774346022
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 0.018400054372959145
Energy: 0.32187536830756946
Energy: 0.3219041068590292
Energy: 1.1872449989965097
Energy: 0.015639374347539835
Energy: 0.18676352332404847
Energy: 1.1872449989965097
Energy: 0.015639374347539835
Energy: 0.18676352332404847
Energy: 1.1872449989965097
Energy: 0.015639374347539835
Energy: 0.18676352332404847
Energy: 1.1872449989965097

minimum gb energy = 0.015442659774346022 eV
minimum distance =  2.33017436895156 Angstroms
sigma value = 3


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

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Energy: 1.0558357516824601
Energy: 1.0556418364287454
Energy: 0.7726501621190328
Energy: 1.0558357516845787
Energy: 1.055641836428039
Energy: 0.8505245606163054
Energy: 1.0558357516842576
Energy: 1.0556418364287454
Energy: 0.7726501621190328
Energy: 0.8589350702108771
Energy: 0.8135487979924039
Energy: 1.0371815154846307
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Energy: 1.0371815154832182
Energy: 0.8589350702111981
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Energy: 1.0371815154843096
Energy: 0.8589350702115832
Energy: 0.8970803684653774
Energy: 1.0555585886342953
Energy: 1.0237723118566358
Energy: 0.8869818562573805
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Energy: 0.8970803684643501
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Energy: 1.0237723118580484
Energy: 0.8869818562552618
Energy: 1.031158013136185
Energy: 1.0588757898461634
Energy: 0.7732484087873965
Energy: 1.0311580131372764
Energy: 1.0588757898468695
Energy: 0.7732484087877175
Energy: 1.0311580131368911
Energy: 1.058875789844751
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Energy: 0.9846583122851658
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Energy: 0.7729878635245726
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Energy: 1.0150728520932715
Energy: 0.7729520420498751
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Energy: 0.9705701452367509
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Energy: 0.9765539621570151
Energy: 0.8635555394898089
Energy: 0.8790436291116414
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Energy: 0.7731842808646426
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Energy: 1.0805210683928672
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Energy: 0.872032662949229
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Energy: 1.0453399204946852
Energy: 0.9048763273923581
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Energy: 1.0453399204953915
Energy: 0.9748253181242632
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Energy: 1.0453399204946852
Energy: 0.904876327391652
Energy: 0.7747831127595007
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Energy: 0.737301551521913
Energy: 0.9587173939657908
Energy: 1.0044035203447603
Energy: 0.7373015515212068
Energy: 0.9633341071557711
Energy: 1.003610192724992
Energy: 0.7373015515208858
Energy: 0.9587173939657908
Energy: 1.0044035203436688
Energy: 0.737301551521913
Energy: 1.0113903721995647
Energy: 0.7734188591635809
Energy: 1.0198871047574638
Energy: 1.0113903721984734
Energy: 0.773418859164287
Energy: 1.0198871047567577
Energy: 1.0113903721988584
Energy: 0.7734188591649932
Energy: 1.0198871047581701
Energy: 1.011390372200977
Energy: 0.8300267066118581
Energy: 1.0087078561712637
Energy: 0.9053114248796678
Energy: 0.8300267066128852
Energy: 1.0087078561709428
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Energy: 0.8300267066135913
Energy: 1.0087078561698515
Energy: 0.9053114248817864
Energy: 0.8300267066125643
Energy: 0.8677805157216867
Energy: 0.9917253983113999
Energy: 0.8138169045539428
Energy: 0.8677805157213657
Energy: 0.9917253983131333
Energy: 0.813776817148568
Energy: 0.8677805157216867
Energy: 0.991725398315252
Energy: 0.8138169045525304
Energy: 0.867780515722778
Energy: 0.8256886846367509
Energy: 1.0558357516824601
Energy: 1.0556418364287454
Energy: 0.7726501621187117
Energy: 1.0558357516849637
Energy: 1.0556418364298368
Energy: 0.8256886846328347
Energy: 1.0558357516838723
Energy: 1.0556418364284246
Energy: 0.7726501621190328
Energy: 0.8589350702119043
Energy: 0.8135487979927248
Energy: 1.0371815154846307
Energy: 0.8589350702126105
Energy: 0.8135487979924039
Energy: 1.0371815154836037
Energy: 0.8589350702101709
Energy: 0.8135487979916977
Energy: 1.0371815154846307
Energy: 0.8589350702111981
Energy: 0.8448746091189251
Energy: 1.0555585886342953
Energy: 1.0237723118563151
Energy: 0.8188777282190877
Energy: 1.055558588635708
Energy: 1.0237723118584336
Energy: 0.8448746087701918
Energy: 1.0555585886353227
Energy: 1.0237723118587545
Energy: 0.8188777282392464
Energy: 1.031158013136185
Energy: 1.0588757898458423
Energy: 0.7732484087877175
Energy: 1.0311580131375975
Energy: 1.0588757898461634
Energy: 0.7732484087877175
Energy: 1.0311580131372764
Energy: 1.058875789845457
Energy: 0.7732484087884236
Energy: 1.0311580131368911

minimum gb energy = 0.7373015515208858 eV
minimum distance =  2.28240231028539 Angstroms
sigma value = 75


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

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Energy: 0.8341193616664008
Energy: 0.8333403689823438
Energy: 1.0295368034759065
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minimum gb energy = 0.8296791535742648 eV
minimum distance =  2.26393792015905 Angstroms
sigma value = 105


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

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Energy: 1.0197675837881237
Energy: 0.9558714936466073
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Energy: 0.9747365728641892
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Energy: 0.9992517045028887
Energy: 1.008872534953996
Energy: 0.9412401552139495
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Energy: 0.9670573095979128
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Energy: 0.9330240615194564
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Energy: 1.006445316502433
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Energy: 1.0064453165022207
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Energy: 0.9330240615194564
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Energy: 0.9395369850825059
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Energy: 0.9600058516492538
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Energy: 0.9688473979943125
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Energy: 0.9600058516492538
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Energy: 1.0064723399321092
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Energy: 1.022825381459974
Energy: 1.0014959811408584
Energy: 0.9877273108690886
Energy: 1.022825381459585
Energy: 1.0014959811406463
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Energy: 1.0228253814597617
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Energy: 1.022825381459585
Energy: 0.998729293280097
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Energy: 1.0104409057096764
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Energy: 1.0104409057096764
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Energy: 0.9761862240816113
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Energy: 0.9818278116211379
Energy: 0.9730881198923185
Energy: 0.9445533225858856
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Energy: 1.0143899800826905
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Energy: 0.9445533225858856
Energy: 1.0143899800825138
Energy: 0.9730881198923185
Energy: 0.949024252407847
Energy: 1.0049489463144456
Energy: 1.0066665840820341
Energy: 0.9490242524076704
Energy: 1.0049489463146577
Energy: 1.0066665840822464
Energy: 0.9490242524076704
Energy: 1.0049489463146577
Energy: 1.0066665840822464
Energy: 0.9490242524076704
Energy: 0.9664852863176595
Energy: 0.9920599128769989
Energy: 0.9769850916958571
Energy: 0.9664852863182603
Energy: 0.9920599128769989
Energy: 0.9769850916950796
Energy: 0.9664852863180483
Energy: 0.9920599128769989
Energy: 0.9769850916946908
Energy: 0.966485286318437
Energy: 0.9941113425326525
Energy: 0.991550928706766
Energy: 0.971275705800301
Energy: 0.9941113425322637
Energy: 0.991550928706766
Energy: 0.9712757057991702
Energy: 0.994111342531663
Energy: 0.9915509287063772
Energy: 0.9712757057997358
Energy: 0.9941113425314865
Energy: 0.9754737750704197
Energy: 0.9746818132602092
Energy: 0.9291259979445681
Energy: 0.9754737750702076
Energy: 0.9746818132605979
Energy: 0.9291259979445681
Energy: 0.9754737750696421
Energy: 0.9746818132605979
Energy: 0.9291259979447447
Energy: 0.9754737750702076
Energy: 0.9854759632935585
Energy: 0.9753687672969461
Energy: 0.9446320177867565
Energy: 0.9854759632931697
Energy: 0.9753687672965927
Energy: 0.9446320177865798
Energy: 0.9854759632935585
Energy: 0.9753687672965927
Energy: 0.9446320177865798
Energy: 0.9854759632933816
Energy: 1.019535960702387
Energy: 0.9512498605382035
Energy: 0.9865558485259698
Energy: 1.0195359607022103
Energy: 0.9512498605384155
Energy: 0.986555848525793
Energy: 1.019535960702387
Energy: 0.9512498605382035
Energy: 0.986555848525793
Energy: 1.019535960702387
Energy: 0.9959272744520151
Energy: 0.9335191907173603
Energy: 1.0262970053335994
Energy: 0.9959272744524037
Energy: 0.9335191907175371
Energy: 1.0262970053332103
Energy: 0.9959272744524037
Energy: 0.9335191907173603
Energy: 1.0262970053328218
Energy: 0.9959272744525804

minimum gb energy = 0.899382584057719 eV
minimum distance =  2.27099162562176 Angstroms
sigma value = 165


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

Energy: 0.8690164389191292
Energy: 0.97186974162521
Energy: 0.9719064451652804
Energy: 0.8690164389191292
Energy: 0.97186974162521
Energy: 0.9719064451652804
Energy: 0.8690164389191292
Energy: 0.97186974162521
Energy: 0.9719064451652804
Energy: 0.8690164389191292
Energy: 0.9730162745420133
Energy: 0.8645111226894399
Energy: 0.9980962667253781
Energy: 0.9730162745413461
Energy: 0.8645111226887725
Energy: 0.9980962667287144
Energy: 0.9730162745413461
Energy: 0.8645111226894399
Energy: 0.99809626672738
Energy: 0.9730162745420133
Energy: 0.9158764305558316
Energy: 0.9455195395159566
Energy: 0.8454690271964419
Energy: 0.9158764305558316
Energy: 0.9455195395159566
Energy: 0.8454690271964419
Energy: 0.9158764305551641
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Energy: 0.8454690271964419
Energy: 0.9158764305558316
Energy: 1.0165802457018658
Energy: 0.9683264710384294
Energy: 0.8777005925966371
Energy: 1.0165802457005313
Energy: 0.9683264710377623
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Energy: 1.0165802457005313
Energy: 0.9683264710410987
Energy: 0.8777005925966371
Energy: 1.0165802457005313
Energy: 0.9052972395707665
Energy: 0.9303424905681855
Energy: 0.9075740611912065
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Energy: 0.9303424905681855
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Energy: 0.8876305245445484
Energy: 1.0651805858683105
Energy: 1.0171010335504382
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Energy: 1.0651805858683105
Energy: 1.017101033599818
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Energy: 1.0651805858683105
Energy: 1.0171010335911432
Energy: 0.8876305245445484
Energy: 0.9227730693523012
Energy: 0.9483511627802639
Energy: 0.9716306095618471
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Energy: 0.9483511627802639
Energy: 0.9716306095625146
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Energy: 0.9483511627795967
Energy: 0.9716306095631817
Energy: 0.9227730693523012
Energy: 0.9693359736470153
Energy: 0.8648578997702234
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Energy: 0.8649749545411436
Energy: 0.9693359736470153
Energy: 0.8648578997702234
Energy: 0.8649749545411436
Energy: 0.9693359736470153
Energy: 0.922539220338546
Energy: 0.9711141868369133
Energy: 0.9483682645747369
Energy: 0.922539220338546
Energy: 0.9711141868369133
Energy: 0.948368264575404
Energy: 0.922539220338546
Energy: 0.9711141868369133
Energy: 0.9483682645747369
Energy: 0.922539220338546
Energy: 0.8876185828967
Energy: 1.017075513811831
Energy: 1.0655127618354927
Energy: 0.8876185828967
Energy: 1.0170755138111636
Energy: 1.0655127618354927
Energy: 0.8876185828960328
Energy: 1.0170755138104963
Energy: 1.0655127618354927
Energy: 0.8876185828960328
Energy: 0.9052911687411361
Energy: 0.9074723117210186
Energy: 0.9302999404372285
Energy: 0.9052911687411361
Energy: 0.9074723117210186
Energy: 0.9302999404378958
Energy: 0.9052911687411361
Energy: 0.9074723117210186
Energy: 0.9302999404372285
Energy: 0.9052911687411361
Energy: 1.0167464632044505
Energy: 0.8777181196870066
Energy: 0.9730503769866516
Energy: 1.0167464632051175
Energy: 0.8777181196870066
Energy: 0.9730503769933245
Energy: 1.0167464632044505
Energy: 0.8777181196870066
Energy: 0.9730503769859843
Energy: 1.0167464632044505
Energy: 0.9157925024235083
Energy: 0.8453998648702182
Energy: 0.94507556310187
Energy: 0.9157925024235083
Energy: 0.8453998648708854
Energy: 0.9450755631025373
Energy: 0.9157925024235083
Energy: 0.8453998648708854
Energy: 0.94507556310187
Energy: 0.9157925024235083
Energy: 0.9730200395048719
Energy: 0.9969525489723363
Energy: 0.8644206692877864
Energy: 0.9730200395075412
Energy: 0.9969525489209546
Energy: 0.8644206692877864
Energy: 0.9730200395048719
Energy: 0.9969525488802801
Energy: 0.8644206692871191
Energy: 0.9730200395028701
Energy: 0.8690164389191292
Energy: 0.9718697416238755
Energy: 0.9719064451652804
Energy: 0.8690164389191292
Energy: 0.9718697416238755
Energy: 0.9719064451652804
Energy: 0.8690164389191292
Energy: 0.971869741623208
Energy: 0.9719064451652804
Energy: 0.8690164389191292

minimum gb energy = 0.8453998648702182 eV
minimum distance =  2.34386576840185 Angstroms
sigma value = 41


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

Energy: 0.8905264500538362
Energy: 0.8510224963867903
Energy: 0.8155513227454264
Energy: 0.863761863187462
Energy: 0.8510224963842011
Energy: 0.8155513227428375
Energy: 0.8905264500564254
Energy: 0.8510224963842011
Energy: 0.8155513227454264
Energy: 0.863761863187462
Energy: 0.8280113747794682
Energy: 0.7399056045546066
Energy: 0.8271060151529319
Energy: 0.8280113747794682
Energy: 0.7399056045571485
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Energy: 0.8271060151529319
Energy: 0.8280113747820101
Energy: 0.8377853120424936
Energy: 0.7427162734041824
Energy: 0.7731228950384589
Energy: 0.8370509127305024
Energy: 0.7427162734015934
Energy: 0.7728870159332945
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Energy: 0.7427162734015934
Energy: 0.7731228950384589
Energy: 0.8370509127305024
Energy: 0.7717365981273501
Energy: 0.7718995002469521
Energy: 0.7663614889037638
Energy: 0.7717365981248081
Energy: 0.7718995002495411
Energy: 0.7664729269785618
Energy: 0.7717365981248081
Energy: 0.7718995002495411
Energy: 0.7663614889037638
Energy: 0.7717365981248081
Energy: 0.8012754995928157
Energy: 0.9314565551948794
Energy: 0.7677678142047669
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Energy: 0.9314565551948794
Energy: 0.7675384826665649
Energy: 0.8012754995902267
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Energy: 0.7567961009327594
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Energy: 0.7819751004740892
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Energy: 0.7819129578835943
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Energy: 0.8411413164275553
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Energy: 0.8493259595309763
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Energy: 0.751909852779257
Energy: 0.8416263623356601
Energy: 0.796461537181913
Energy: 0.7519494268739836
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Energy: 0.751909852776668
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Energy: 0.7519494268713945
Energy: 0.9114046737903584
Energy: 0.7522296341476609
Energy: 0.8580705923945579
Energy: 0.9114046737929473
Energy: 0.75222963415025
Energy: 0.8580705923919687
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Energy: 0.9114046737903584
Energy: 0.7941418545098169
Energy: 0.9192555321661109
Energy: 0.7434701738668499
Energy: 0.788374158856421
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Energy: 0.7434701738668499
Energy: 0.7941418545098169
Energy: 0.9192555321687002
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Energy: 0.788374158856421
Energy: 0.7692506808913102
Energy: 0.7688649499160445
Energy: 0.7546699535626118
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Energy: 0.7688649499160445
Energy: 0.7546699535626118
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Energy: 0.7546699535626118
Energy: 0.7692506808938993
Energy: 0.8153332343181887
Energy: 0.9278332521168988
Energy: 0.7643890140617726
Energy: 0.8153332343207778
Energy: 0.9278332521168988
Energy: 0.7643890140617726
Energy: 0.8153332343207778
Energy: 0.9278332521143096
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Energy: 0.8153332343181887
Energy: 0.896020983713397
Energy: 0.8639105934567188
Energy: 0.802996292844424
Energy: 0.8688093041309517
Energy: 0.8639105934567188
Energy: 0.802996292844424
Energy: 0.896020983715986
Energy: 0.8639105934541297
Energy: 0.8029962928418348
Energy: 0.8688093041283627
Energy: 0.8661648610280613
Energy: 0.7426769295702073
Energy: 0.8260296525939254
Energy: 0.8661648610280613
Energy: 0.7426769295702073
Energy: 0.8260296525913363
Energy: 0.8661648610254723
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Energy: 0.8156064183971123
Energy: 0.8864628917284074
Energy: 0.8872170883733866
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Energy: 0.8864628917309965
Energy: 0.8872170883707975
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Energy: 0.8864628917309965
Energy: 0.8872170883682086
Energy: 0.7594639784936261
Energy: 0.8864628917284074
Energy: 0.7731263312875316
Energy: 0.9724112200880893
Energy: 0.8005863640363841
Energy: 0.7731263312849428
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Energy: 0.8005863640363841
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Energy: 0.9724112200880893
Energy: 0.8005863640389731
Energy: 0.7731263312901208
Energy: 0.7521053534530185
Energy: 0.7738333608569679
Energy: 0.7738485973777451
Energy: 0.7521053534530185
Energy: 0.7738333608595569
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Energy: 0.7666046936790252
Energy: 0.7900452953321087
Energy: 0.8132502910917496
Energy: 0.7666046936816142
Energy: 0.7900452953295195
Energy: 0.8132502910917496
Energy: 0.7666046936790252
Energy: 0.790045295301087
Energy: 0.8132502910917496
Energy: 0.7666046936764362
Energy: 0.8734585406808171
Energy: 0.7415524561051794
Energy: 0.8155364992789415
Energy: 0.8734585406808171
Energy: 0.7415524561051794
Energy: 0.8155364992763524
Energy: 0.8734585406782279
Energy: 0.7415524561051794
Energy: 0.8155364992763524
Energy: 0.8734585406808171
Energy: 0.8382689451414251
Energy: 0.7979391400324601
Energy: 0.8642229384819297
Energy: 0.8382689451414251
Energy: 0.7979391400350491
Energy: 0.8642229384819297
Energy: 0.8382689451440142
Energy: 0.7979391400324601
Energy: 0.8642229384845188
Energy: 0.8382689451414251
Energy: 0.7406451489587327
Energy: 0.8801335465213306
Energy: 0.8040325448187264
Energy: 0.7406451489613218
Energy: 0.8794193233302533
Energy: 0.8040325448187264
Energy: 0.7406451489587327
Energy: 0.8801335465213306
Energy: 0.8040325448161375
Energy: 0.7406451489561435
Energy: 0.7415650509622678
Energy: 0.7681319433069702
Energy: 0.7692642823318676
Energy: 0.7415650509622678
Energy: 0.7681778211757597
Energy: 0.7691907023713435
Energy: 0.7415650509622678
Energy: 0.7681319433069702
Energy: 0.7692642823292786
Energy: 0.7415650509622678
Energy: 0.7567211258497362
Energy: 0.7712258861500374
Energy: 0.7715499977816691
Energy: 0.7567211258497362
Energy: 0.7711926665004121
Energy: 0.7715499977842581
Energy: 0.7567211258497362
Energy: 0.7712258861500374
Energy: 0.7715499977842581
Energy: 0.7567211258497362
Energy: 0.9412596613681211
Energy: 0.7721561292547929
Energy: 0.8046713023407942
Energy: 0.94125966137071
Energy: 0.7721529395132588
Energy: 0.8046713023407942
Energy: 0.94125966137071
Energy: 0.772156129257382
Energy: 0.8046713023407942
Energy: 0.94125966137071
Energy: 0.851438911661463
Energy: 0.8398608430900212
Energy: 0.7543403767674445
Energy: 0.851438911661463
Energy: 0.8398608430874321
Energy: 0.7543403767700335
Energy: 0.851438911658874
Energy: 0.8398608430874321
Energy: 0.7543403767700335
Energy: 0.851438911658874

minimum gb energy = 0.7399056045546066 eV
minimum distance =  2.34026512783304 Angstroms
sigma value = 185


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

Energy: 0.7372840691979461
Energy: 0.38963569561302175
Energy: 0.389116468712258
Energy: 0.4530579655807686
Energy: 0.3896356956139438
Energy: 0.3891164687116434
Energy: 0.7372840691976388
Energy: 0.3896356956136365
Energy: 0.3891164687125654
Energy: 0.4530579655807686
Energy: 0.6942512902303499
Energy: 0.38291632751515714
Energy: 0.5447572303903948
Energy: 0.6150111484496823
Energy: 0.3829163275139278
Energy: 0.6857716306615256
Energy: 0.6942512902300425
Energy: 0.3829163275148498
Energy: 0.5447572303919315
Energy: 0.6150111484496823
Energy: 0.48916429383664917
Energy: 0.3902059168231912
Energy: 0.5683257703971881
Energy: 0.5627214456327665
Energy: 0.3902059168219619
Energy: 0.4905293297498856
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Energy: 0.5683257703968808
Energy: 0.5627214456336884
Energy: 0.7316306338860648
Energy: 0.39026574410923326
Energy: 0.627757843602972
Energy: 0.7316306338869869
Energy: 0.3902657441104626
Energy: 0.5769376051098456
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Energy: 0.390265744111692
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Energy: 0.7316306338863722
Energy: 0.39100254483291363
Energy: 0.40634686707082324
Energy: 0.5265001550777707
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Energy: 0.40634686707051587
Energy: 0.41730608118325296
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Energy: 0.40634686707051587
Energy: 0.5265001550793074
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Energy: 0.6551393194600436
Energy: 0.667399626615318
Energy: 0.5983178414187628
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Energy: 0.4940973836277609
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Energy: 0.6673996266147032
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Energy: 0.3894247824358533
Energy: 0.5991810712319082
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Energy: 0.6320841592594804
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Energy: 0.3894247824358533
Energy: 0.5991810712343669
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Energy: 0.38942478243554596
Energy: 0.6494087424881578
Energy: 0.6041073497199821
Energy: 0.3827426689238562
Energy: 0.6494087424875431
Energy: 0.5259116052529431
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Energy: 0.6494087424866212
Energy: 0.6041073497215188
Energy: 0.3827426689235489
Energy: 0.6494087424866212
Energy: 0.3963448176346399
Energy: 0.6639309252055232
Energy: 0.3894848518635525
Energy: 0.4912637639160217
Energy: 0.6076547914144396
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Energy: 0.39634481763310325
Energy: 0.6639309252058304
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Energy: 0.49126376391878773
Energy: 0.5624991719522335
Energy: 0.5658464795908711
Energy: 0.38312899312396353
Energy: 0.4890586639785137
Energy: 0.49040299230239376
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Energy: 0.5624991719534629
Energy: 0.5658464795893343
Energy: 0.3831289931227342
Energy: 0.4890586639775917
Energy: 0.6148454587941604
Energy: 0.7397658787860772
Energy: 0.4067562961924424
Energy: 0.6476126782614497
Energy: 0.7397658787863846
Energy: 0.40675629619182774
Energy: 0.6148454587963117
Energy: 0.7397658787857698
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Energy: 0.6476126782617571
Energy: 0.4503523416603727
Energy: 0.3896356956133291
Energy: 0.389116468712258
Energy: 0.5279216034395654
Energy: 0.3896356956136365
Energy: 0.38911646871195066
Energy: 0.4503523416591434
Energy: 0.38963569561302175
Energy: 0.3891164687125654
Energy: 0.5279216034392581
Energy: 0.639422239451343
Energy: 0.38291632751515714
Energy: 0.5029354906897565
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Energy: 0.51187505366526
Energy: 0.6394222394525725
Energy: 0.38291632751515714
Energy: 0.5029354906885272
Energy: 0.5795131193928694
Energy: 0.5625943477637229
Energy: 0.3902059168231912
Energy: 0.4901268351690552
Energy: 0.48911600032860764
Energy: 0.3902059168219619
Energy: 0.5679440307054064
Energy: 0.5625943477628009
Energy: 0.39020591682134714
Energy: 0.4901268351665965
Energy: 0.4891160003304516
Energy: 0.7316306338860648
Energy: 0.39026574410923326
Energy: 0.5992595887679442
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Energy: 0.3902657441104626
Energy: 0.6325776807054291
Energy: 0.7316306338866795
Energy: 0.390265744111692
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Energy: 0.7316306338863722
Energy: 0.39100254483260627
Energy: 0.40634686707051587
Energy: 0.5260092509770876
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Energy: 0.40634686707020856
Energy: 0.6043873110156293
Energy: 0.3910025448322989
Energy: 0.40634686707082324
Energy: 0.5260092509795463
Energy: 0.39100254483199165
Energy: 0.6551393194603509
Energy: 0.5088174877288076
Energy: 0.6621987905670497
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Energy: 0.6337698357537854
Energy: 0.5994329957697193
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Energy: 0.5088174877328029
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Energy: 0.6551393194600436
Energy: 0.38942478243616063
Energy: 0.5720914806420844
Energy: 0.7393830925610979
Energy: 0.389424782436468
Energy: 0.6286082360924998
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Energy: 0.3894247824358533
Energy: 0.572091480640855
Energy: 0.7393830925607906
Energy: 0.38942478243523865
Energy: 0.6494087424875431
Energy: 0.41737619925313
Energy: 0.3827426689241636
Energy: 0.6494087424875431
Energy: 0.5265558644989672
Energy: 0.3827426689244709
Energy: 0.6494087424869285
Energy: 0.41737619925282265
Energy: 0.3827426689241636
Energy: 0.6494087424866212
Energy: 0.5420153223636293
Energy: 0.5851382532917616
Energy: 0.38948485186385984
Energy: 0.484282087545522
Energy: 0.6086257401275877
Energy: 0.3894848518641672
Energy: 0.5420153223636293
Energy: 0.5851382532923763
Energy: 0.3894848518641672
Energy: 0.48428208754705865
Energy: 0.4891127147426304
Energy: 0.49484402327739946
Energy: 0.38312899312365617
Energy: 0.5626053980668911
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Energy: 0.48911271474201573
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Energy: 0.5626053980693498
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Energy: 0.7397658787857698
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Energy: 0.6927706948075977
Energy: 0.7397658787857698
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Energy: 0.6088192952412885
Energy: 0.7372840691979461
Energy: 0.3896356956133291
Energy: 0.3891164687125654
Energy: 0.45305796558046124
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Energy: 0.389116468712258
Energy: 0.7372840691976388
Energy: 0.3896356956133291
Energy: 0.3891164687128727
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Energy: 0.6942512902306572
Energy: 0.38291632751515714
Energy: 0.5447572303928535
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Energy: 0.6857716306612182
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Energy: 0.5447572303916242
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Energy: 0.7316306338860648
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Energy: 0.627757843602972
Energy: 0.7316306338869869
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Energy: 0.390265744111692
Energy: 0.6277578436026647
Energy: 0.7316306338863722
Energy: 0.3910025448322989
Energy: 0.4063468670711306
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Energy: 0.41730608118325296
Energy: 0.3910025448316843
Energy: 0.40634686707051587
Energy: 0.5265001550786927
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Energy: 0.6551393194609656
Energy: 0.6673996266147032
Energy: 0.5983178414190702
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Energy: 0.49409738351133753
Energy: 0.6022338995064458
Energy: 0.6551393194597362
Energy: 0.6673996266143959
Energy: 0.5983178414181481
Energy: 0.6551393194612728
Energy: 0.38942478243616063
Energy: 0.5991810712322156
Energy: 0.7393830925610979
Energy: 0.389424782436468
Energy: 0.6320841592594804
Energy: 0.7393830925614052
Energy: 0.38942478243616063
Energy: 0.5991810712343669
Energy: 0.7393830925610979
Energy: 0.38942478243554596
Energy: 0.6494087424878504
Energy: 0.6041073497199821
Energy: 0.3827426689241636
Energy: 0.6494087424875431
Energy: 0.5259116052523285
Energy: 0.3827426689241636
Energy: 0.6494087424866212
Energy: 0.6041073497209042
Energy: 0.3827426689238562
Energy: 0.6494087424869285
Energy: 0.3963448176337179
Energy: 0.6639309252055232
Energy: 0.38948485186385984
Energy: 0.49126376391632903
Energy: 0.6076547914141321
Energy: 0.38948485186385984
Energy: 0.39634481763310325
Energy: 0.6639309252061378
Energy: 0.3894848518641672
Energy: 0.49126376391878773
Energy: 0.5624991719522335
Energy: 0.5658464795908711
Energy: 0.38312899312427084
Energy: 0.4890586639785137
Energy: 0.49040299230270107
Energy: 0.38312899312427084
Energy: 0.5624991719537703
Energy: 0.5658464795890271
Energy: 0.3831289931227342
Energy: 0.48905866397789904
Energy: 0.6148454587938531
Energy: 0.7397658787863846
Energy: 0.40675629619213516
Energy: 0.6476126782614497
Energy: 0.7397658787866919
Energy: 0.40675629619182774
Energy: 0.6148454587960044
Energy: 0.7397658787863846
Energy: 0.40675629619182774
Energy: 0.6476126782617571

minimum gb energy = 0.3827426689235489 eV
minimum distance =  2.38797229793908 Angstroms
sigma value = 33


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

Energy: 0.75866380291486
Energy: 0.7595950187754691
Energy: 0.7700464141154376
Energy: 0.75866380291486
Energy: 0.7595950187754691
Energy: 0.7700464141154376
Energy: 0.75866380291486
Energy: 0.7595950187754691
Energy: 0.7700464141154376
Energy: 0.7586638029165471
Energy: 0.7822352753889027
Energy: 0.7094173515772295
Energy: 0.767967816518183
Energy: 0.7822352753889027
Energy: 0.7094173515772295
Energy: 0.767967816518183
Energy: 0.7822352753889027
Energy: 0.7094173515772295
Energy: 0.767967816518183
Energy: 0.7822352753889027
Energy: 0.7464585165574986
Energy: 0.7050911414249966
Energy: 0.7313223855204771
Energy: 0.7464585165574986
Energy: 0.7050911414249966
Energy: 0.7313223855204771
Energy: 0.7464585165574986
Energy: 0.7050911414249966
Energy: 0.7313223855204771
Energy: 0.7464585165574986
Energy: 0.8291416336803552
Energy: 0.7044996009387205
Energy: 0.7762932812688477
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Energy: 0.7044996009404078
Energy: 0.7762932812671606
Energy: 0.8291416336803552
Energy: 0.7044996009387205
Energy: 0.7762932812671606
Energy: 0.8291416336803552
Energy: 0.8261671901290306
Energy: 0.748503748657347
Energy: 0.7281924914669536
Energy: 0.8261671901307178
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Energy: 0.7281924914669536
Energy: 0.8261671901307178
Energy: 0.748503748657347
Energy: 0.7281924914669536
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Energy: 0.7449856985913986
Energy: 0.7875617167305218
Energy: 0.8136672017319666
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Energy: 0.696224169884178
Energy: 0.7631067895997041
Energy: 0.8184874121833272
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Energy: 0.7631067896013912
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Energy: 0.730516929666173
Energy: 0.7086746412914966
Energy: 0.7108096630005425
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Energy: 0.7086746412914966
Energy: 0.7108096630005425
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Energy: 0.7108096630005425
Energy: 0.7305169296678601
Energy: 0.7655066286437611
Energy: 0.669007275794527
Energy: 0.8223128699774516
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Energy: 0.7655066286437611
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Energy: 0.8223128699774516
Energy: 0.7655066286437611
Energy: 0.7679013914739957
Energy: 0.7097253825445118
Energy: 0.794484291260928
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Energy: 0.794484291260928
Energy: 0.7679013914739957
Energy: 0.7717111574910843
Energy: 0.8107031486791679
Energy: 0.7245693989700691
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Energy: 0.7717111574910843
Energy: 0.8107031486791679
Energy: 0.7245693989700691
Energy: 0.7717111574910843
Energy: 0.7089090042394672
Energy: 0.7458990696990607
Energy: 0.7726067644525861
Energy: 0.7089090042411544
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Energy: 0.7726067644525861
Energy: 0.7089090042394672
Energy: 0.7458990696990607
Energy: 0.7726067644525861
Energy: 0.7089090042394672
Energy: 0.7055108753808182
Energy: 0.7477644953951129
Energy: 0.7478716665387097
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Energy: 0.7477644953934257
Energy: 0.7478716665387097
Energy: 0.7055108753808182
Energy: 0.7477644953934257
Energy: 0.7478716665387097
Energy: 0.7055108753808182
Energy: 0.7097565272437192
Energy: 0.7814526394096448
Energy: 0.73504596639097
Energy: 0.7097565272437192
Energy: 0.7814526394096448
Energy: 0.73504596639097
Energy: 0.7097565272437192
Energy: 0.7814526394096448
Energy: 0.73504596639097
Energy: 0.7097565272437192
Energy: 0.790142655602086
Energy: 0.7282789340973075
Energy: 0.7834158416968316
Energy: 0.790142655602086
Energy: 0.7282789340973075
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Energy: 0.7852877822557356
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Energy: 0.7852877822557356
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Energy: 0.794398683054097
Energy: 0.7812016368818113
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Energy: 0.7943986830524098
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Energy: 0.7226573903301139
Energy: 0.7700617526098041
Energy: 0.6930552901323997

minimum gb energy = 0.6684954194542903 eV
minimum distance =  2.29544713305971 Angstroms
sigma value = 219


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

Energy: 0.843451950539655
Energy: 1.0197838416880474
Energy: 1.019621122909506
Energy: 0.843451950539655
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Energy: 0.8319940043241205
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Energy: 0.8401908530893696
Energy: 1.0249521132032422
Energy: 1.0159398108402082
Energy: 0.8401908530893696
Energy: 1.0249521132032422
Energy: 1.0159398108402082
Energy: 0.8401908530893696
Energy: 1.0249521132032422
Energy: 1.0159398108402082
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Energy: 0.9980037606612618
Energy: 0.9918795005355153
Energy: 0.9498241019487648
Energy: 0.9980037606612618
Energy: 0.9918795005355153

minimum gb energy = 0.8319940043230039 eV
minimum distance =  2.33466332424569 Angstroms
sigma value = 15


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

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Energy: 1.0231685402374258
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Energy: 1.0113806982701705
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Energy: 1.0127569459971582
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Energy: 0.9712480946652262
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minimum gb energy = 0.9629340007419435 eV
minimum distance =  2.26180777635439 Angstroms
sigma value = 293


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

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Energy: 0.9715858589273408
Energy: 0.9800274684844059
Energy: 1.038329996570005
Energy: 1.0357810203700408
Energy: 1.0492167891227042
Energy: 1.0383299965705095
Energy: 1.035781020370293
Energy: 1.0492167891227042
Energy: 1.0383299965705095
Energy: 1.035781020370293
Energy: 1.0492167891227042
Energy: 1.0383299965717707
Energy: 1.117102314620623
Energy: 0.9682943342622171
Energy: 0.9792288378400267
Energy: 1.1171023146201187
Energy: 0.9682943342629509
Energy: 0.9792288378397745
Energy: 1.1171023146198664
Energy: 0.9682943342632259
Energy: 0.9792288378397745
Energy: 1.117102314620371
Energy: 1.0256687617190972
Energy: 0.972308568966663
Energy: 0.9740617192064105
Energy: 1.0256687617188676
Energy: 0.972308568966663
Energy: 0.9740617192059059
Energy: 1.0256687617196016
Energy: 0.9723085689641637
Energy: 0.9740617192061584
Energy: 1.0256687617185927
Energy: 0.9695335842701497
Energy: 0.9675507254831414
Energy: 0.9782969978801515
Energy: 0.9695335842699203
Energy: 0.967550725482866
Energy: 0.9782969978798993
Energy: 0.9695335842699203
Energy: 0.9675507254831414
Energy: 0.9782969978801515
Energy: 0.9695335842701497
Energy: 1.0209912495426723
Energy: 1.0028538126752093
Energy: 0.9799730510096192
Energy: 1.020991249550468
Energy: 1.0028538126742006
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Energy: 1.0028538126792448
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Energy: 1.0209912495404025
Energy: 1.001476049293585
Energy: 1.074141143948142
Energy: 1.0744233301020447
Energy: 1.001476049293585
Energy: 1.074141143948142
Energy: 1.0744233301020447
Energy: 1.0014760492938373
Energy: 1.0741411439486468
Energy: 1.074423330102297
Energy: 1.001476049293585
Energy: 1.020833941877402
Energy: 0.9800390168600688
Energy: 1.003229627495585
Energy: 1.020833941877402
Energy: 0.9800390168603212
Energy: 1.003229627544996
Energy: 1.0208339418768975
Energy: 0.9800390168600688
Energy: 1.0032296275374293
Energy: 1.020833941877402
Energy: 0.9695699399293413
Energy: 0.9783483051933369
Energy: 0.9675354966435079
Energy: 0.969569939929112
Energy: 0.9783483051930848
Energy: 0.9675354966432328
Energy: 0.969569939929112
Energy: 0.9783483051933369
Energy: 0.9675354966435079
Energy: 0.9695699399293413
Energy: 1.0257289589669494
Energy: 0.9737944214927827
Energy: 0.972695049668924
Energy: 1.0257289589666743
Energy: 0.9737944214925304
Energy: 0.972695049670185
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Energy: 0.9737944214927827
Energy: 0.972695049670185
Energy: 1.0257289589666743
Energy: 1.1172962022854345
Energy: 0.9792062165257233
Energy: 0.9684524619946127
Energy: 1.117296202282912
Energy: 0.9792062165259755
Energy: 0.9684524619946127
Energy: 1.1172962022856865
Energy: 0.9792062165259755
Energy: 0.9684524619938788
Energy: 1.117296202285939
Energy: 1.0383126686393955
Energy: 1.049211090887656
Energy: 1.0357287024538802
Energy: 1.038312668638891
Energy: 1.0492110908874037
Energy: 1.0357287024541324
Energy: 1.038312668639143
Energy: 1.0492110908874037
Energy: 1.035728702453628
Energy: 1.0383126686393955
Energy: 0.980089620961216
Energy: 0.9718465792027954
Energy: 0.992637699891523
Energy: 0.9800896209609636
Energy: 0.9718465792027954
Energy: 0.9926376998905141
Energy: 0.9800896209607114
Energy: 0.9718465792030477
Energy: 0.9926376998912706
Energy: 0.9800896209607114
Energy: 1.0566645740048564
Energy: 0.9725958564661565
Energy: 0.9723097038292556
Energy: 1.0566645740048564
Energy: 0.9725958564661565
Energy: 0.9723097038297599
Energy: 1.0566645740048564
Energy: 0.972595856466409
Energy: 0.9723097038295078
Energy: 1.0566645740048564
Energy: 0.9800274684844059
Energy: 0.992662524494898
Energy: 0.971585858926584
Energy: 0.9800274684844059
Energy: 0.9926625244959068
Energy: 0.9715858589270885
Energy: 0.9800274684846583
Energy: 0.9926625244956544
Energy: 0.9715858589268361
Energy: 0.9800274684844059
Energy: 1.0383299965705095
Energy: 1.035781020370293
Energy: 1.0492167891227042
Energy: 1.0383299965705095
Energy: 1.0357810203705455
Energy: 1.0492167891227042
Energy: 1.0383299965705095
Energy: 1.035781020370293
Energy: 1.0492167891227042
Energy: 1.038329996570005
Energy: 1.117102314620371
Energy: 0.9682943342627216
Energy: 0.9792288378397745
Energy: 1.1171023146201187
Energy: 0.9682943342629509
Energy: 0.9792288378395224
Energy: 1.1171023146198664
Energy: 0.9682943342629509
Energy: 0.9792288378397745
Energy: 1.1171023146198664
Energy: 1.0256687617193723
Energy: 0.9723085689639116
Energy: 0.9740617192059059
Energy: 1.0256687617198768
Energy: 0.9723085689626505
Energy: 0.9740617192056538
Energy: 1.0256687617188676
Energy: 0.9723085689656542
Energy: 0.9740617192056538
Energy: 1.0256687617190972

minimum gb energy = 0.9675354966432328 eV
minimum distance =  2.26576378198211 Angstroms
sigma value = 293


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

Energy: 0.9303032539870634
Energy: 0.9312613264238321
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264238321
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264247436
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9288253627558705
Energy: 0.9307875445881589
Energy: 0.9311698581345962
Energy: 0.9288253627563261
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627563261
Energy: 0.9289670720711266
Energy: 0.9287403468625619
Energy: 0.8926086203092932
Energy: 0.9289670720711266
Energy: 0.9287403468630175
Energy: 0.8926086184051716
Energy: 0.9289670720711266
Energy: 0.9287403468630175
Energy: 0.8926086200422902
Energy: 0.9289670720702149
Energy: 0.893258080733313
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.8932580807328572
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.8932580807351365
Energy: 0.9285605585221364
Energy: 0.9281778812478018
Energy: 0.8932580807369599
Energy: 0.9310520218555041
Energy: 0.9307242399223258
Energy: 0.9291035389680022
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.929103538968458
Energy: 0.9310520218550481
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Energy: 0.929103538968458
Energy: 0.9310520218550481
Energy: 0.9312613264256553
Energy: 0.9307603020835024
Energy: 0.9303032539870634
Energy: 0.9312613264251995
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Energy: 0.9303032539870634
Energy: 0.9312613264251995
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264256553
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627563261
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627563261
Energy: 0.9307875445886148
Energy: 0.9287403468630175
Energy: 0.8926086256617864
Energy: 0.9289670720706705
Energy: 0.9287403468630175
Energy: 0.8926086276843875
Energy: 0.9289670720706705
Energy: 0.9287403468625619
Energy: 0.8926086258599979
Energy: 0.9289670720702149
Energy: 0.9287403468625619
Energy: 0.9285605585225924
Energy: 0.9281778812478018
Energy: 0.8932580807264753
Energy: 0.9285605585225924
Energy: 0.9281778812473459
Energy: 0.8932580807237402
Energy: 0.9285605585221364
Energy: 0.9281778812478018
Energy: 0.8932580807278429
Energy: 0.9285605585225924
Energy: 0.9307242399227817
Energy: 0.929103538968458
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.929103538968458
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.9291035389680022
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264256553
Energy: 0.9307603020835024
Energy: 0.9303032539870634
Energy: 0.9312613264247436
Energy: 0.9307603020830467
Energy: 0.9303032539870634
Energy: 0.9312613264247436
Energy: 0.9307603020830467
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.8926086251997631
Energy: 0.9289670720702149
Energy: 0.9287403468625619
Energy: 0.8926086241558695
Energy: 0.9289670720702149
Energy: 0.9287403468630175
Energy: 0.8926086246826234
Energy: 0.9289670720702149
Energy: 0.9287403468625619
Energy: 0.8926086229670988
Energy: 0.9281778812478018
Energy: 0.8932580807187258
Energy: 0.9285605585221364
Energy: 0.9281778812478018
Energy: 0.8932580807200935
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.8932580807182701
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.9291035389675463
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.9291035389680022
Energy: 0.9310520218555041
Energy: 0.9307242399223258
Energy: 0.929103538968458
Energy: 0.9310520218550481
Energy: 0.9307242399227817
Energy: 0.9291035389680022
Energy: 0.9303032539870634
Energy: 0.931261326423376
Energy: 0.9307603020835024
Energy: 0.9303032539870634
Energy: 0.931261326423376
Energy: 0.9307603020830467
Energy: 0.9303032539870634
Energy: 0.9312613264238321
Energy: 0.9307603020830467
Energy: 0.9303032539870634
Energy: 0.9288253627563261
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445881589
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627558705
Energy: 0.9289670720702149
Energy: 0.9287403468625619
Energy: 0.8926086244721041
Energy: 0.9289670720706705
Energy: 0.9287403468625619
Energy: 0.8926086238378528
Energy: 0.9289670720702149
Energy: 0.9287403468630175
Energy: 0.8926086224239757
Energy: 0.9289670720702149
Energy: 0.8932580807114323
Energy: 0.9285605585221364
Energy: 0.9281778812478018
Energy: 0.8932580807118881
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.8932580807114323
Energy: 0.9285605585221364
Energy: 0.9281778812473459
Energy: 0.8932580807114323
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.9291035389680022
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.929103538968458
Energy: 0.9310520218555041
Energy: 0.9307242399227817
Energy: 0.9291035389680022
Energy: 0.9310520218550481
Energy: 0.9312613264247436
Energy: 0.9307603020835024
Energy: 0.9303032539870634
Energy: 0.9312613264251995
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264251995
Energy: 0.9307603020839584
Energy: 0.9303032539870634
Energy: 0.9312613264256553
Energy: 0.9307875445881589
Energy: 0.9311698581341404
Energy: 0.9288253627563261
Energy: 0.9307875445881589
Energy: 0.9311698581345962
Energy: 0.9288253627567822
Energy: 0.9307875445886148
Energy: 0.9311698581345962
Energy: 0.9288253627563261
Energy: 0.9307875445886148

minimum gb energy = 0.8926086184051716 eV
minimum distance =  2.32764024444203 Angstroms
sigma value = 15


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

Energy: 0.9739834586872707
Energy: 0.9639947220935935
Energy: 0.9869550254076248
Energy: 0.9614360376746606
Energy: 0.9639947220935935
Energy: 0.986955025353937
Energy: 0.9739834586893368
Energy: 0.9639947220935935
Energy: 0.9869550253952265
Energy: 0.9614360376767269
Energy: 1.068825173262626
Energy: 0.965982967674462
Energy: 0.9510909794181093
Energy: 1.068825173262626
Energy: 0.9659829676723957
Energy: 0.9510909794181093
Energy: 1.068825173262626
Energy: 0.9659829676723957
Energy: 0.9510909794160429
Energy: 1.068825173262626
Energy: 1.0464880926801883
Energy: 0.9614099492910079
Energy: 1.1231777942317092
Energy: 1.0464880926801883
Energy: 0.9614099492889415
Energy: 1.1231777942317092
Energy: 1.0464880926801883
Energy: 0.9614099492910079
Energy: 1.1231777942337753
Energy: 1.0464880926781217
Energy: 0.9432568579966774
Energy: 0.9609281716004429
Energy: 0.9424888392433202
Energy: 0.9432568579946112
Energy: 0.9609281715983764
Energy: 0.9424888392433202
Energy: 0.9432568579925448
Energy: 0.96092817159631
Energy: 0.9424888392433202
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Energy: 1.0214394829084297
Energy: 0.9657381228797209
Energy: 1.0321513846542685
Energy: 1.0214394829084297
Energy: 0.9657381228797209
Energy: 1.0321513846542685
Energy: 1.0214394829104958
Energy: 0.9657381228776546
Energy: 1.0321513846542685
Energy: 1.0214394829104958
Energy: 0.9902809482213311
Energy: 1.0435090357748427
Energy: 0.9346841904970496
Energy: 0.9902809482233974
Energy: 1.0435090357934398
Energy: 0.9346841904949832
Energy: 0.9902809482254638
Energy: 1.0435090357810417
Energy: 0.9346841904970496
Energy: 0.9902809482233974
Energy: 0.9631914467500833
Energy: 1.0441432288984716
Energy: 0.9686477799661375
Energy: 0.962835525064443
Energy: 1.0441432289005381
Energy: 0.9686477799661375
Energy: 0.9631914467480168
Energy: 1.0441432288984716
Energy: 0.9686477799640711
Energy: 0.962835525064443
Energy: 0.9665830544673931
Energy: 1.0664432485792417
Energy: 1.0462010978069676
Energy: 0.9665830544673931
Energy: 1.0664432485792417
Energy: 1.0462010978049012
Energy: 0.9665830544673931
Energy: 1.0664432485792417
Energy: 1.0462010978069676
Energy: 0.9665830544673931
Energy: 1.1324738936692265
Energy: 0.9608532942703647
Energy: 0.9587863074603723
Energy: 1.1324738936671601
Energy: 0.9608532942682982
Energy: 0.958786307458306
Energy: 1.1324738936671601
Energy: 0.9608532942703647
Energy: 0.958786307458306
Energy: 1.1324738936692265
Energy: 0.9646708558375052
Energy: 1.1753030303009937
Energy: 1.0467010928332463
Energy: 0.9650431821408104
Energy: 1.1753030303051264
Energy: 1.0467010928332463
Energy: 0.964670855835439
Energy: 1.1753030303051264
Energy: 1.0467010928353127
Energy: 0.9650431821408104
Energy: 0.9743342569531745
Energy: 0.9301540281348591
Energy: 1.0210515698876217
Energy: 0.9743342569511081
Energy: 0.9301540281369255
Energy: 1.0210515698876217
Energy: 0.9743342569511081
Energy: 0.9301540281389921
Energy: 1.0210515698855556
Energy: 0.9743342569511081
Energy: 1.015095254398382
Energy: 0.935301160309972
Energy: 1.0732112287710902
Energy: 1.0150952544004483
Energy: 0.935286486425873
Energy: 1.0732112287710902
Energy: 1.0150952544004483
Energy: 0.9353011603058394
Energy: 1.0732112287710902
Energy: 1.015095254398382
Energy: 1.0983862104231508
Energy: 0.9416560999353502
Energy: 1.0510917957727357
Energy: 1.0983862104231508
Energy: 0.9416560999394827
Energy: 1.0510917957727357
Energy: 1.0983862104231508
Energy: 0.9416560999353502
Energy: 1.0510917957706694
Energy: 1.0983862104231508
Energy: 0.9366770036878215
Energy: 0.936329573002398
Energy: 1.1165190462394339
Energy: 0.9366770036898879
Energy: 0.936329573002398
Energy: 1.1165190462373675
Energy: 0.9366770036898879
Energy: 0.9363295730044645
Energy: 1.1165190462373675
Energy: 0.9366770036898879
Energy: 1.0208947268091098
Energy: 1.0757728113839105
Energy: 0.9463024294210459
Energy: 1.0208947268132422
Energy: 1.0757728113859768
Energy: 0.9463023251308977
Energy: 1.0208947268132422
Energy: 1.0757728113859768
Energy: 0.9463024294231124
Energy: 1.0208947268091098
Energy: 0.9531941520022386
Energy: 1.0999047170143128
Energy: 1.0569052830578656
Energy: 0.9531941520022386
Energy: 1.0999047170143128
Energy: 1.056905283053733
Energy: 0.9531941520043047
Energy: 1.0999047170143128
Energy: 1.0569052830557994
Energy: 0.9531941520022386
Energy: 0.9602487206841464
Energy: 1.0078374612202188
Energy: 1.068874563250347
Energy: 0.9602487206841464
Energy: 1.007837461228484
Energy: 1.068874563252413
Energy: 0.9602487206841464
Energy: 1.007837461230513
Energy: 1.068874563250347
Energy: 0.9602487206841464
Energy: 1.087930921604702
Energy: 0.9516081260265337
Energy: 0.9491841793365376
Energy: 1.0879309216067685
Energy: 0.9516081260244672
Energy: 0.9491841793365376
Energy: 1.0879309216088349
Energy: 0.9516081260244672
Energy: 0.9491841793365376
Energy: 1.0879309216088349
Energy: 0.9509829973672161
Energy: 1.0512084474319607
Energy: 1.0046544410444929
Energy: 0.9509829973672161
Energy: 1.0512084474216292
Energy: 1.004654441046559
Energy: 0.9509829973672161
Energy: 1.0512084474298944
Energy: 1.0046544410444929
Energy: 0.9509829973672161
Energy: 1.0531803375914368
Energy: 0.9467055408905416
Energy: 0.9929333460698035
Energy: 1.0531803375914368
Energy: 0.9467055408905416
Energy: 0.9929333460677372
Energy: 1.0531803375914368
Energy: 0.9467055408905416
Energy: 0.9929333460698035
Energy: 1.0531803375914368
Energy: 1.002603832197724
Energy: 0.9670438409934841
Energy: 1.0638789917697944
Energy: 1.00260383219979
Energy: 0.9670438409955505
Energy: 1.0638789917697944
Energy: 1.0026038322018564
Energy: 0.9670438409934841
Energy: 1.0638789917718605
Energy: 1.00260383219979
Energy: 0.9710433163143469
Energy: 1.035514641103242
Energy: 0.9350788063665841
Energy: 0.971043316316413
Energy: 1.035514641103242
Energy: 0.9350788063665841
Energy: 0.9710433163143469
Energy: 1.035514641103242
Energy: 0.9350788063665841
Energy: 0.971043316316413
Energy: 0.961041167815923
Energy: 0.9621281774530038
Energy: 0.9658059295585286
Energy: 0.9610255381174813
Energy: 0.9621508660969268
Energy: 0.9658059295564624
Energy: 0.9610411678138566
Energy: 0.9621281774489088
Energy: 0.965805929554396
Energy: 0.9610255381174813
Energy: 0.9417369772692502
Energy: 0.960032738980245
Energy: 0.9296810482054199
Energy: 0.9417369772671839
Energy: 0.9600327389781785
Energy: 0.9296810482033534
Energy: 0.9417369772671839
Energy: 0.9600327389781785
Energy: 0.929681048201287
Energy: 0.9417369772692502
Energy: 1.0464702528303345
Energy: 0.9750531267498259
Energy: 0.9742907458794345
Energy: 1.0464702528324006
Energy: 0.975053126751892
Energy: 0.9742907458773681
Energy: 1.0464702528324006
Energy: 0.975053126751892
Energy: 0.9742907458773681
Energy: 1.0464702528324006
Energy: 0.9646816031178459
Energy: 1.0844685646434016
Energy: 1.0142129774851698
Energy: 0.9646832605552388
Energy: 1.084468564641335
Energy: 1.0142129774851698
Energy: 0.9646816031199124
Energy: 1.0844685646434016
Energy: 1.0142129774831035
Energy: 0.9646832605573052
Energy: 0.9892052729613326
Energy: 0.9315036067595169
Energy: 1.0181358719335565
Energy: 0.9892052729613326
Energy: 0.9315036067636497
Energy: 1.0181358719356226
Energy: 0.9892052729592663
Energy: 0.931503606765716
Energy: 1.0181358719335565
Energy: 0.9892052729613326
Energy: 1.057466145695827
Energy: 1.0821580004408504
Energy: 1.0542501721924515
Energy: 1.057466145695827
Energy: 1.0821580004408504
Energy: 1.0542501721924515
Energy: 1.057466145695827
Energy: 1.0821580004429165
Energy: 1.054250172194518
Energy: 1.057466145695827
Energy: 1.0609378289007638
Energy: 0.9353202459835869
Energy: 1.0219430071895235
Energy: 1.0603072382383305
Energy: 0.9350968220215612
Energy: 1.0219430071895235
Energy: 1.0609378288986977
Energy: 0.9353202459856158
Energy: 1.0219430071895235
Energy: 1.0603072382424632
Energy: 0.9614730999912933
Energy: 0.9298551563154394
Energy: 1.0620781312638983
Energy: 0.9614730999912933
Energy: 0.9298551563154394
Energy: 1.0620781312659648
Energy: 0.961473099993322
Energy: 0.929855156313373
Energy: 1.0620781312659648
Energy: 0.961473099993322
Energy: 0.994256311826169
Energy: 1.0365093664638303
Energy: 0.9463671178126151
Energy: 0.994256311826169
Energy: 1.036509366467963
Energy: 0.9461542041983992
Energy: 0.994256311826169
Energy: 1.0365093664658966
Energy: 0.9463671178126151
Energy: 0.994256311826169
Energy: 0.9325487885512185
Energy: 1.0542759016934902
Energy: 1.058439697872161
Energy: 0.9325487885491521
Energy: 1.0542759016934902
Energy: 1.0584396978762938
Energy: 0.9325487885491521
Energy: 1.0542759016955563
Energy: 1.0584396978762938
Energy: 0.9325487885512185
Energy: 0.9730288110766347
Energy: 1.0521401373999173
Energy: 0.9376827776559343
Energy: 0.9593080077208842
Energy: 1.0521401373978507
Energy: 0.9376827776518014
Energy: 0.9730288110766347
Energy: 1.0521401373957846
Energy: 0.9376827776518014
Energy: 0.9593080077208842
Energy: 0.9720929279000173
Energy: 1.044731197067232
Energy: 1.0481073832068766
Energy: 0.9597478436922414
Energy: 1.0447311970651656
Energy: 1.0450273188947636
Energy: 0.9720929278979509
Energy: 1.044731197067232
Energy: 1.0481073832048104
Energy: 0.9597478436943079
Energy: 0.9337506391392127
Energy: 1.130926119025679
Energy: 1.031400849203733
Energy: 0.9337506391371464
Energy: 1.130926119025679
Energy: 1.0314008492057993
Energy: 0.9337506391371464
Energy: 1.130926119025679
Energy: 1.0314008492057993
Energy: 0.9337506391392127
Energy: 0.9837944981033204
Energy: 0.9463952204377849
Energy: 1.0559271340638854
Energy: 0.9837944981012541
Energy: 0.946395220439851
Energy: 1.0559271340618193
Energy: 0.9837944981033204
Energy: 0.946395220439851
Energy: 1.055927134059753
Energy: 0.9837944980991878
Energy: 0.9614624739562966
Energy: 1.0592988461333557
Energy: 0.9301773316890779
Energy: 0.9614624739562966
Energy: 1.0592988461312893
Energy: 0.9303255138907358
Energy: 0.9614624739562966
Energy: 1.0592988461312893
Energy: 0.9301773316890779
Energy: 0.9614624739583629
Energy: 1.0849678364688102
Energy: 1.0344229027808278
Energy: 0.9352130995608686
Energy: 1.0849678364667437
Energy: 1.0344229027808278
Energy: 0.9352130995608686
Energy: 1.0849678364688102
Energy: 1.0344229027808278
Energy: 0.9352130995650013
Energy: 1.0849678364688102
Energy: 1.0439853676650712
Energy: 1.04194317413672
Energy: 0.9611221082515392
Energy: 1.0439853676650712
Energy: 1.0419431741387863
Energy: 0.9611221082515392
Energy: 1.0439853676650712
Energy: 1.0419431741408527
Energy: 0.9611221082494728
Energy: 1.0439853676630046
Energy: 0.9642809970618179
Energy: 1.0300250427218574
Energy: 0.9315699979930272
Energy: 0.9642809968593903
Energy: 1.0300250427218574
Energy: 0.9315699979909606
Energy: 0.964280996208789
Energy: 1.0300250427177249
Energy: 0.9315699979909606
Energy: 0.9642809955375241
Energy: 0.9682818797558181
Energy: 1.0588734267245021
Energy: 0.9742214900963194
Energy: 0.9682818797558181
Energy: 1.058873426722436
Energy: 0.974221490094253
Energy: 0.9682818797578845
Energy: 1.058873426722436
Energy: 0.9742214900921867
Energy: 0.9682818797578845
Energy: 1.0581022261842856
Energy: 0.9614687441131409
Energy: 0.9630528207488774
Energy: 1.0581022261863515
Energy: 0.9614687441110747
Energy: 0.9630528207488774
Energy: 1.058102226188418
Energy: 0.9614687441110747
Energy: 0.963052820750944
Energy: 1.058102226188418
Energy: 1.036801338112669
Energy: 0.9306444285530411
Energy: 1.0324114639317379
Energy: 1.0368013380672467
Energy: 0.9306444285468796
Energy: 1.0324114639317379
Energy: 1.0368013380465833
Energy: 0.9306444285509748
Energy: 1.0324114639317379
Energy: 1.0368013380321188
Energy: 0.9608630989259077
Energy: 1.222538296544345
Energy: 0.9610639522197043
Energy: 0.960863098927974
Energy: 1.2225382965422784
Energy: 0.9610639522197043
Energy: 0.960863098927974
Energy: 1.2225382965422784
Energy: 0.9610639522176381
Energy: 0.960863098927974
Energy: 0.9660100993231637
Energy: 0.9345699163022785
Energy: 1.0870471867735014
Energy: 0.9660100993231637
Energy: 0.9345664743369936
Energy: 1.0870471867879659
Energy: 0.9660100993210974
Energy: 0.9345699163043448
Energy: 1.0870471867776341
Energy: 0.9660100993210974
Energy: 1.0504334866513685
Energy: 0.9486742137047545
Energy: 1.0579385073156284
Energy: 1.050433486649302
Energy: 0.9486742137068208
Energy: 1.0579385073156284
Energy: 1.0504334866472356
Energy: 0.9486742137068208
Energy: 1.0579385073156284
Energy: 1.050433486649302
Energy: 0.9488131401757943
Energy: 0.9740831504964504
Energy: 0.946950450168263
Energy: 0.9488131401757943
Energy: 0.9740831504964504
Energy: 0.9469497981859772
Energy: 0.9488131401757943
Energy: 0.9740831504964504
Energy: 0.946950450168263
Energy: 0.9488131401757943
Energy: 0.9311823439004246
Energy: 0.998275351248145
Energy: 0.9373526639439133
Energy: 0.9311823438983582
Energy: 0.9982753512502112
Energy: 0.937352663919117
Energy: 0.9311823438983582
Energy: 0.998275351248145
Energy: 0.9373526638840265
Energy: 0.9311823438983582
Energy: 0.9597351462957721
Energy: 1.0355764198334036
Energy: 1.0435978259095673
Energy: 0.9597351462937058
Energy: 1.0355764198354702
Energy: 1.0435978259095673
Energy: 0.9597351462957721
Energy: 1.0355764198354702
Energy: 1.0435978259095673
Energy: 0.9597351462978384

minimum gb energy = 0.929681048201287 eV
minimum distance =  2.26906668590239 Angstroms
sigma value = 437


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

Energy: 0.9372727443812436
Energy: 0.9503036309924299
Energy: 0.9499481724275037
Energy: 0.9372727443812436
Energy: 0.9503036309931825
Energy: 0.9499481724275037
Energy: 0.9372727443812436
Energy: 0.9503036309924299
Energy: 0.9499481724282566
Energy: 0.9372727443812436
Energy: 1.0013621545317979
Energy: 0.9154576098676198
Energy: 0.9168921179480406
Energy: 1.0013621545317979
Energy: 0.9154576098676198
Energy: 0.9168921179472878
Energy: 1.0013621545325504
Energy: 0.9154576098676198
Energy: 0.9168921179480406
Energy: 1.0013621545325504
Energy: 1.017527649664162
Energy: 0.9031475858575613
Energy: 1.1401355778915487
Energy: 1.0175276496634091
Energy: 0.9031475858583141
Energy: 1.140135577914133
Energy: 1.017527649664162
Energy: 0.9031475858590668
Energy: 1.1401355778900428
Energy: 1.017527649664162
Energy: 0.9896229446402125
Energy: 1.077714921288214
Energy: 0.9911324775167637
Energy: 0.9896229446394599
Energy: 1.077714921288214
Energy: 0.9911324775175165
Energy: 0.9896229446394599
Energy: 1.0777149212874613
Energy: 0.9911324775175165
Energy: 0.9896229446402125
Energy: 0.9811470663024261
Energy: 0.930856420752392
Energy: 1.1217515909928057
Energy: 0.9811470663024261
Energy: 0.930856420752392
Energy: 1.121751590992053
Energy: 0.9811470663024261
Energy: 0.930856420752392
Energy: 1.1217515909928057
Energy: 0.9811470663016733
Energy: 0.9818880168559255
Energy: 1.0169114871599303
Energy: 0.9152105839129603
Energy: 0.981888016857431
Energy: 1.0169114871599303
Energy: 0.9152105839122074
Energy: 0.981888016857431
Energy: 1.0169114871599303
Energy: 0.9152105839129603
Energy: 0.9818880168566784
Energy: 1.0785641495255414
Energy: 0.9452999946127062
Energy: 0.9030288154109841
Energy: 1.0785641495255414
Energy: 0.9452999946112006
Energy: 0.9030288154109841
Energy: 1.0785641495255414
Energy: 0.9452999946112006
Energy: 0.9030288154102314
Energy: 1.0785641495255414
Energy: 0.9892646489807418
Energy: 1.045401617974072
Energy: 0.986819334013805
Energy: 0.9892646489807418
Energy: 1.0454016179748247
Energy: 0.9868193340258156
Energy: 0.9892646489807418
Energy: 1.045401617974072
Energy: 0.9868193340168162
Energy: 0.9892646489807418
Energy: 0.9501149162212025
Energy: 0.9129969415675325
Energy: 0.9261023136498785
Energy: 0.9501149163588982
Energy: 0.9129969415667797
Energy: 0.9261023136491258
Energy: 0.9501149166621436
Energy: 0.9129969415667797
Energy: 0.9261023136498785
Energy: 0.9501149165891554
Energy: 0.991306336722882
Energy: 1.0053823619674014
Energy: 0.9898731227286036
Energy: 0.991306336722882
Energy: 1.005382361965896
Energy: 0.9898731227293565
Energy: 0.991306336722882
Energy: 1.0053823619674014
Energy: 0.9898731227293565
Energy: 0.991306336722882
Energy: 0.9813081963078117
Energy: 0.9785816007037138
Energy: 0.9656404254380891
Energy: 0.9813081963078117
Energy: 0.9785816006901633
Energy: 0.965640425438842
Energy: 0.9813081963085645
Energy: 0.9785816007195228
Energy: 0.9656404254380891
Energy: 0.9813081963078117
Energy: 1.0060099603894368
Energy: 0.9140569934624199
Energy: 1.0025124202285114
Energy: 1.0060099609116813
Energy: 0.9140569934624199
Energy: 1.0025124202277587
Energy: 1.0060099606452895
Energy: 0.9140569934616671
Energy: 1.0025124202285114
Energy: 1.0060099607807267
Energy: 0.9142919104252518
Energy: 1.1008834571281187
Energy: 0.9140464846588069
Energy: 0.9142919104252518
Energy: 1.1008834571273662
Energy: 0.9140464846580539
Energy: 0.9142919104252518
Energy: 1.1008834571281187
Energy: 0.9140464846588069
Energy: 0.9142919104252518
Energy: 0.930089083284072
Energy: 0.9164634189856855
Energy: 0.9889844357936682
Energy: 0.930089083284072
Energy: 0.9164634189849326
Energy: 0.9889844358011962
Energy: 0.930089083284072
Energy: 0.9164634189849326
Energy: 0.9889844358011962
Energy: 0.930089083284072

minimum gb energy = 0.9030288154102314 eV
minimum distance =  2.29037072940604 Angstroms
sigma value = 33