Model name: model_name=EAM_Dynamo_MendelevBorovikov_2020_FeNiCr__MO_922363340570_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518474650382997
cohesive_energy=4.34606645024629
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[3.9172417612983e-19, 4.404928306921559e-19, 4.73504078059092e-19, 5.0180973265197e-19, 5.24025513859014e-19, 5.40324456756696e-19, 5.5284706932804e-19, 5.636409333112979e-19, 5.7416402944341e-19, 5.849675064864719e-19, 5.96096225386236e-19, 6.07582229675382e-19, 6.19555295661264e-19, 6.317991294982919e-19, 6.43487008043322e-19, 6.533243725760819e-19, 6.606238893205859e-19, 6.661578074144219e-19, 6.719496759463319e-19, 6.79894869874338e-19, 6.883046950262039e-19, 6.93696019399614e-19, 6.9579326861352e-19, 6.962611041906479e-19, 6.958156990863959e-19, 6.943529118195539e-19, 6.916676637809699e-19, 6.87535650241884e-19, 6.81714942530562e-19, 6.7393317061922395e-19, 6.638907274773119e-19, 6.512383385986139e-19, 6.35537007585414e-19, 6.16208348672838e-19, 5.92443262660716e-19, 5.631955282070459e-19, 5.27279534602668e-19, 4.82865596131554e-19, 4.2673173558273e-19, 3.5353629605843995e-19, 2.5374472440975e-19, 1.077627208381668e-19, -1.0862405099660518e-19, -4.3334231637461397e-19, -9.29129467059378e-19]
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: 0.0216695954512325
Energy: 0.022311912816536508
Energy: 0.4756509264539151
Energy: 1.0949686184180785
Energy: 1.0898034693388485
Energy: 0.41737301263363685
Energy: 0.022375042453486895
Energy: 0.022762753508344325
Energy: 1.0915868585922663
Energy: 0.3078071261080258
Energy: 0.6925068958477132
Energy: 0.8307681661156341
Energy: 0.0228257956442183
Energy: 0.1447673233557756
Energy: 0.022375283600562346
Energy: 1.0908228540915208
Energy: 0.6972523164253627
Energy: 0.6927179753878008
Energy: 0.9155804566078578
Energy: 0.1430780840563518
Energy: 0.14505503842220677
Energy: 0.025020481964555825
Energy: 0.8879741167381818
Energy: 0.692696788406226
Energy: 1.0963025872408614
Energy: 1.0902820171050054
Energy: 0.14356202328570114
Energy: 0.022791351087477946
Energy: 0.4177552045269292
Energy: 1.0922192642669093
Energy: 0.3079215254675493
Energy: 0.47621964750359314
Energy: 0.830495053140387
Energy: 0.022528468808524594
Energy: 0.14327166206862962
Energy: 0.022081848317188697
Energy: 1.0913297859360611
Energy: 0.6966896418817018
Energy: 0.6928804801497016
Energy: 0.9165852591673097
Energy: 0.14306081135164062
Energy: 0.1451915436090918

minimum gb energy = 0.0216695954512325 eV
minimum distance =  2.46748455658185 Angstroms
sigma value = 5


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

Energy: 1.457303650545909
Energy: 1.5502027599745638
Energy: 1.4258571107284355
Energy: 1.3814393850566962
Energy: 1.5292307004695955
Energy: 1.6014097695531648
Energy: 1.5460185681913217
Energy: 1.3726011153783726
Energy: 1.4613242015239731
Energy: 1.345219688587855
Energy: 1.4336719756078216
Energy: 1.3870495581800948
Energy: 1.3408164697873701
Energy: 1.4282160866481697
Energy: 1.4104379717940116
Energy: 1.441144186779979
Energy: 1.4463788083956546
Energy: 1.376646569039827
Energy: 1.3641707040538977
Energy: 1.4032209267925737
Energy: 1.4070793559269452
Energy: 1.3739175207773733
Energy: 1.4217329598587252
Energy: 1.4028558701809326
Energy: 1.4758219820305931
Energy: 1.465381360062858
Energy: 1.445296538120242
Energy: 1.4343929950247287
Energy: 1.395204829538033
Energy: 1.4138417901146785
Energy: 1.3916564855488964
Energy: 1.3771731073474112
Energy: 1.3906652740931031
Energy: 1.3905835918596074
Energy: 1.3638520577406248
Energy: 1.3739514910466717
Energy: 1.4100299175302782
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Energy: 1.3982575874745005
Energy: 1.3788644036474211
Energy: 1.3691169158346346
Energy: 1.4339073299714333
Energy: 1.3740447126701893
Energy: 1.470552253548266
Energy: 1.4633133976222767
Energy: 1.4538640898624289
Energy: 1.4377204296968158
Energy: 1.4621543568753583
Energy: 1.4386477504236674
Energy: 1.404363954531034
Energy: 1.4286679592452782
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Energy: 1.4801298447339393
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Energy: 1.3695055359373487
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Energy: 1.4067262725583987
Energy: 1.3780009209832622
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Energy: 1.3560553966946034
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Energy: 1.366524668323744
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Energy: 1.4236408513547099
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Energy: 1.448930650564877
Energy: 1.3848620714658448
Energy: 1.4025766688108208
Energy: 1.4659036705441975
Energy: 1.4195447186892831
Energy: 1.3741200139943575
Energy: 1.5493332830010926
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Energy: 1.476706828614521
Energy: 1.4288195988893841
Energy: 1.5094990200534013
Energy: 1.3260689362073945
Energy: 1.4231591046084162
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Energy: 1.4001950733728996
Energy: 1.3723971885480823
Energy: 1.4123644746466555
Energy: 1.388308882139597
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Energy: 1.379186301735043
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Energy: 1.455837830790163
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Energy: 1.426616508725869
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Energy: 1.427137139191159
Energy: 1.4403077419985673
Energy: 1.3816049728904503
Energy: 1.4219765948955
Energy: 1.4415497202764675
Energy: 1.4845043797945665
Energy: 1.5199422891847625
Energy: 1.384915094443456
Energy: 1.4603632338179584
Energy: 1.3919191129595492
Energy: 1.4434426559396356
Energy: 1.436335451860384
Energy: 1.4453564167262276
Energy: 1.4443751807735856
Energy: 1.3263345870185597
Energy: 1.3936765730644434
Energy: 1.3888315373246702
Energy: 1.4585571829819781
Energy: 1.37725538687504
Energy: 1.406015910515077
Energy: 1.3807217874811597
Energy: 1.4225780928378866
Energy: 1.4268299636546753
Energy: 1.4088419466573139
Energy: 1.4337036685054134
Energy: 1.4087030163573497
Energy: 1.4618562788935123
Energy: 1.3804291416873005
Energy: 1.3240728988718478
Energy: 1.4401944947717484
Energy: 1.3907899878720988
Energy: 1.4039044997123309
Energy: 1.414029067208736
Energy: 1.42265448975424
Energy: 1.3898068291024537
Energy: 1.3816877257982547
Energy: 1.4166432070021624
Energy: 1.4152426601507986
Energy: 1.389409065577529
Energy: 1.400252488356878
Energy: 1.4425120041010262
Energy: 1.3788533773861216
Energy: 1.3970417673058688
Energy: 1.4283022669874799
Energy: 1.4155331061415193
Energy: 1.4092777814969881
Energy: 1.4394973345906854
Energy: 1.344994482664306
Energy: 1.4410638890803
Energy: 1.3854699796837195
Energy: 1.3945289068790077
Energy: 1.3807278700264467
Energy: 1.449919545435003
Energy: 1.358527822319586
Energy: 1.3319459157018947
Energy: 1.4250470634771928

minimum gb energy = 1.3240728988718478 eV
minimum distance =  2.17752571065824 Angstroms
sigma value = 401


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

Energy: 1.5389753896354694
Energy: 1.3421070632903846
Energy: 1.3905023495309454
Energy: 1.3793778333599602
Energy: 1.8097848516589148
Energy: 1.3923936866529663
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Energy: 1.356344916077215
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Energy: 1.3689071070334295
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Energy: 1.356250037840507
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Energy: 1.4813906607989378
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Energy: 1.404083898272942
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Energy: 1.377253194553682
Energy: 1.3099434742307425
Energy: 1.4236764285037724
Energy: 1.470401407034022
Energy: 1.4785969778382968
Energy: 1.3809247612674829
Energy: 1.482489319639703
Energy: 1.364922241733253
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Energy: 1.3682790737326451
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Energy: 1.3562612817199906
Energy: 1.4448275024477035
Energy: 1.4470402606334256
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Energy: 1.3311363596836476
Energy: 1.3573033021546648
Energy: 1.4583578297908828
Energy: 1.3774408493058166
Energy: 1.3698011489572988
Energy: 1.4512759397675696
Energy: 1.34123749608524
Energy: 1.3483540442948878
Energy: 1.419273962200171
Energy: 1.4374865478188241
Energy: 1.4142537604742011
Energy: 1.3807068969368137
Energy: 1.404847618706721
Energy: 1.3588256721438072
Energy: 1.4121220457445902
Energy: 1.4602661768472198
Energy: 1.487511274408572
Energy: 1.3708622974323819
Energy: 1.4043468939109383
Energy: 1.3885086824754809
Energy: 1.3766534601073381
Energy: 1.4448763524775423
Energy: 1.347004839391113
Energy: 1.4094698476719854
Energy: 1.3622390121860906
Energy: 1.3731126917581913
Energy: 1.3698559346233379
Energy: 1.3433721794973192
Energy: 1.3898083304616795
Energy: 1.3619124296568392
Energy: 1.3539068302016808
Energy: 1.3644088347586707
Energy: 1.372505553674478
Energy: 1.3695471588700765
Energy: 1.3476109340204578
Energy: 1.5108834453990816
Energy: 1.368180365018099
Energy: 1.3523808917209015
Energy: 1.3636429124494507
Energy: 1.3984104661452041
Energy: 1.3820619623328636
Energy: 1.3355428305253625
Energy: 1.3067752166949242
Energy: 1.4291509919792948
Energy: 1.4618321827854095
Energy: 1.3312141867314653
Energy: 1.4092160836180845
Energy: 1.485595501532368
Energy: 1.3431332715708555
Energy: 1.395227138834462
Energy: 1.424637560168128
Energy: 1.4359880194405024
Energy: 1.474475907085469
Energy: 1.3809982897243305
Energy: 1.3715245657701773
Energy: 1.3477653656880575
Energy: 1.3354726131702086
Energy: 1.378482523165887
Energy: 1.486986071838356
Energy: 1.3574531266189886
Energy: 1.3778896919936707
Energy: 1.4213289789120518
Energy: 1.388540738117288
Energy: 1.3495474832824617
Energy: 1.340714347603625
Energy: 1.4064445021209186
Energy: 1.4401963891874456
Energy: 1.371170027599575
Energy: 1.3564905717635352
Energy: 1.3493750258541064
Energy: 1.3171061246021536
Energy: 1.3615642585883818
Energy: 1.46876735102753
Energy: 1.4251405989725856
Energy: 1.3652033703890984
Energy: 1.444422017976613
Energy: 1.3501309051856378
Energy: 1.3527173152622207
Energy: 1.417030696471511
Energy: 1.4184343714720908
Energy: 1.4135982365401087
Energy: 1.3784062180317325
Energy: 1.3945414397485596
Energy: 1.4088515227916094
Energy: 1.351718515984739
Energy: 1.417824569619844
Energy: 1.4855067329775422
Energy: 1.4655669281812969
Energy: 1.3894618770044878
Energy: 1.374570677460839
Energy: 1.3815650369946224
Energy: 1.4748384290048635
Energy: 1.415389558312118
Energy: 1.423691113556673
Energy: 1.3584867214093308
Energy: 1.3458257840348964
Energy: 1.3586928036412649
Energy: 1.3778344321221407
Energy: 1.3541651458724044
Energy: 1.4128985943556975
Energy: 1.3801417315567839

minimum gb energy = 1.3067752166949242 eV
minimum distance =  2.18293601204644 Angstroms
sigma value = 311


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

Energy: 1.3604312118201964
Energy: 1.3469953790097604
Energy: 1.3478466091643793
Energy: 1.3652310064205666
Energy: 1.3908242299679983
Energy: 1.3449091452133997
Energy: 1.3903456948235544
Energy: 1.3768177015145806
Energy: 1.3307948222731922
Energy: 1.4041368120699291
Energy: 1.4541296786730167
Energy: 1.3500026068641047
Energy: 1.3670455422854824
Energy: 1.4765311378679988
Energy: 1.351448940536993
Energy: 1.3223595203862428
Energy: 1.399595136830548
Energy: 1.3192027913971558
Energy: 1.3868228718493218
Energy: 1.3903067948793268
Energy: 1.3519499698772843
Energy: 1.3606981897247428
Energy: 1.3413295740615279
Energy: 1.3383564893287803
Energy: 1.3699424522158785
Energy: 1.356748258320657
Energy: 1.4040657597858968
Energy: 1.4035687325459467
Energy: 1.4217481628021258
Energy: 1.3161929196936146
Energy: 1.3479082804094091
Energy: 1.3110957062319242
Energy: 1.3889906034974717
Energy: 1.3782306168818896
Energy: 1.3870490246710963
Energy: 1.360534118117257
Energy: 1.321046412311331
Energy: 1.363399495934393
Energy: 1.35897642969701
Energy: 1.3615506982294188
Energy: 1.3384359683217388
Energy: 1.3536650562555983
Energy: 1.346998387802329
Energy: 1.4360682097289856
Energy: 1.3356857572596936
Energy: 1.3166212321233568
Energy: 1.3282751762971217
Energy: 1.4095964832233785
Energy: 1.3976625558886693
Energy: 1.384047307770102
Energy: 1.3160274610364093
Energy: 1.4099600595351212
Energy: 1.390205815267417
Energy: 1.3685852576800797
Energy: 1.4279409666370402
Energy: 1.3761168821925571
Energy: 1.3832055574437676
Energy: 1.3408903721300915
Energy: 1.423700830753641
Energy: 1.308726747115562
Energy: 1.3822202333134894
Energy: 1.3742449664857455
Energy: 1.373271180425599
Energy: 1.3545902012923163
Energy: 1.4366083146132755
Energy: 1.3684884637751344
Energy: 1.4179810441563796
Energy: 1.4021386942267753
Energy: 1.3485815421916885
Energy: 1.3623897221737487
Energy: 1.366544760380678
Energy: 1.3787559466482806
Energy: 1.3630098221292875
Energy: 1.3490461109405707
Energy: 1.3991199539320607
Energy: 1.308052754220342
Energy: 1.352409348890407
Energy: 1.3693947893614977
Energy: 1.3543109848852173
Energy: 1.333947481903985
Energy: 1.4197296429963138
Energy: 1.3896015238924269
Energy: 1.3564650269309302
Energy: 1.373170854103358
Energy: 1.3273491750958728
Energy: 1.3548848567597145
Energy: 1.3667590278368655
Energy: 1.3419159323556793
Energy: 1.3206894738966444
Energy: 1.3660872779300173
Energy: 1.3323312664383506
Energy: 1.4661040891280452
Energy: 1.3329462050935907
Energy: 1.3677773347872013
Energy: 1.4234453288792392
Energy: 1.4471001033737765
Energy: 1.4155628813182894
Energy: 1.3286729232425125
Energy: 1.347133082626182
Energy: 1.3430908248598046
Energy: 1.3581391887742489
Energy: 1.3408619471225312
Energy: 1.3789384550493502
Energy: 1.3294145372056325
Energy: 1.4386655009965694
Energy: 1.3483998246283488
Energy: 1.4054234052345438
Energy: 1.371390816613715
Energy: 1.348335066941918
Energy: 1.3811786097417675
Energy: 1.3471003766716185
Energy: 1.3890224516726062
Energy: 1.4144945123922996
Energy: 1.2774102236313292
Energy: 1.36581012309417
Energy: 1.4365659000073947
Energy: 1.385092248365663
Energy: 1.4137232706931346
Energy: 1.423940759822043
Energy: 1.3424007561444091
Energy: 1.3796640078230984
Energy: 1.3740774345807312
Energy: 1.3615053016669982
Energy: 1.3341803405323212
Energy: 1.3164634271800562
Energy: 1.3868545721209107
Energy: 1.3499181353938872
Energy: 1.413768140488983
Energy: 1.3514243748404307
Energy: 1.3083622021444576
Energy: 1.431754681922272
Energy: 1.3373213071214594
Energy: 1.3619885899274342
Energy: 1.494524455229405
Energy: 1.267768596916825
Energy: 1.4631563125019684
Energy: 1.4369261506756357
Energy: 1.4386779195024848
Energy: 1.4333592770509742
Energy: 1.4680127533543914
Energy: 1.362982184559377
Energy: 1.33829113129216
Energy: 1.3504844822208724
Energy: 1.3418583984327745
Energy: 1.3418588914485041
Energy: 1.3738728806933853
Energy: 1.458873310472063
Energy: 1.3737487460128577
Energy: 1.378164525488115
Energy: 1.33952790577433
Energy: 1.3730085044178295
Energy: 1.3409669490350866
Energy: 1.3386611855864032
Energy: 1.3750258604386498
Energy: 1.398951373584405
Energy: 1.3469527003804287
Energy: 1.3976040803957819
Energy: 1.3670478166581366
Energy: 1.385713455718542
Energy: 1.3523373788862028
Energy: 1.3876122845175862
Energy: 1.3494541610332225
Energy: 1.3809194131105902
Energy: 1.327663790245709
Energy: 1.3539287837972611
Energy: 1.3771999783513809
Energy: 1.3651566461377556
Energy: 1.369005331789231
Energy: 1.3918839267792973
Energy: 1.33076480434175
Energy: 1.344156803918626
Energy: 1.3526276755395807
Energy: 1.3677048893502781
Energy: 1.371042457546043
Energy: 1.4149875314538618
Energy: 1.4671434772880347
Energy: 1.3549786256427403
Energy: 1.3760767557489821
Energy: 1.4475303023927335
Energy: 1.5006395524730156
Energy: 1.427525675599825
Energy: 1.4069110138552587
Energy: 1.3350388887893727
Energy: 1.3324536478193334
Energy: 1.385364127383007
Energy: 1.315045009908735
Energy: 1.4492967500225247
Energy: 1.3504839034799359
Energy: 1.3730406353471756
Energy: 1.341732373507754
Energy: 1.3885128683546322
Energy: 1.3740400004289033
Energy: 1.3279631314721148
Energy: 1.3961957251254271
Energy: 1.3007646419129133
Energy: 1.336956460519452
Energy: 1.3831826617288854
Energy: 1.3796096896935135
Energy: 1.3534857536319729
Energy: 1.399017383189762
Energy: 1.4141809463395436
Energy: 1.312078986239958
Energy: 1.3576004684216862
Energy: 1.358067034863287
Energy: 1.3859502520558313
Energy: 1.380131981601598
Energy: 1.4642198266258402
Energy: 1.3685344975377252
Energy: 1.3910013275607775
Energy: 1.38523411202874
Energy: 1.4395352760611344
Energy: 1.3353926052000353
Energy: 1.3379326318430342
Energy: 1.3770219268091073
Energy: 1.3662866539024372
Energy: 1.373671969809021
Energy: 1.4250579361738858
Energy: 1.381009945435774
Energy: 1.3815438390444825
Energy: 1.3660850652915224
Energy: 1.4642261162573633
Energy: 1.365714702499347
Energy: 1.4014424661153253
Energy: 1.3574919633759495
Energy: 1.37853084882677
Energy: 1.3770722649867753
Energy: 1.3370144597998728
Energy: 1.3222700579699074
Energy: 1.5052393317471497
Energy: 1.34689702536371
Energy: 1.3631149333795927
Energy: 1.3487557037346336
Energy: 1.4056916177866043
Energy: 1.363954672034958
Energy: 1.3964777890826559
Energy: 1.3507376883187021
Energy: 1.3647722002105318
Energy: 1.3437420547898717
Energy: 1.3842904862405054
Energy: 1.3489869839840565
Energy: 1.394902427862139
Energy: 1.388482943668787
Energy: 1.3590424298278174
Energy: 1.3639417018298927
Energy: 1.395436050592064
Energy: 1.3604883311832676
Energy: 1.3777234146227462
Energy: 1.4137215748051821
Energy: 1.3346559835646645
Energy: 1.3801364361398876
Energy: 1.3421408092320066
Energy: 1.3198494282223168

minimum gb energy = 1.267768596916825 eV
minimum distance =  2.18122496983198 Angstroms
sigma value = 39


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

Energy: 1.2416993895647352
Energy: 1.219733934555031
Energy: 1.7316908838464191
Energy: 1.499678799494445
Energy: 1.3656017016140647
Energy: 1.4188580032826599
Energy: 1.2198564862597565
Energy: 1.2239371250274151
Energy: 1.3848870912190752
Energy: 1.4216266631373549
Energy: 1.3388870979297904
Energy: 1.3043249970880804
Energy: 1.3231177916874675
Energy: 1.334910557408825
Energy: 1.3198444507954026
Energy: 1.3210019949129832
Energy: 1.4194223932697676
Energy: 1.3377417621329586
Energy: 1.3016721942596703
Energy: 1.3336345384700736
Energy: 1.3188675868234663
Energy: 1.3202704397088687
Energy: 1.2721975147288016
Energy: 1.2840433468046137
Energy: 1.2839599583875254
Energy: 1.3536169572619314
Energy: 1.307822877311484
Energy: 1.4147420882091013
Energy: 1.320470331177434
Energy: 1.3020819200606368
Energy: 1.421581595514524
Energy: 1.3308950440829257
Energy: 1.3579599371798676
Energy: 1.308608608930792
Energy: 1.330936128959994
Energy: 1.2333691699552787
Energy: 1.3046118784117706
Energy: 1.3137476249170597
Energy: 1.2609028079113789
Energy: 1.3817250956616736
Energy: 1.3552642168076783
Energy: 1.319722885670493
Energy: 1.3263595022135768
Energy: 1.3571120604453264
Energy: 1.306964158756749
Energy: 1.3374438827860964
Energy: 1.2189776357003241
Energy: 1.2224549437403287
Energy: 1.399545247334581
Energy: 1.222688317901529
Energy: 1.2999819073361891
Energy: 1.352283399917974
Energy: 1.260852932060586
Energy: 1.4654981642346723
Energy: 1.2351144623190853
Energy: 1.319306115499131
Energy: 1.2240345414146476
Energy: 1.3860747166456469
Energy: 1.3173801150962876
Energy: 1.3123566299098366
Energy: 1.301382777394508
Energy: 1.309507719621883
Energy: 1.3200573439693364
Energy: 1.3279961709125034
Energy: 1.3733772687717112
Energy: 1.3048508002908568
Energy: 1.3397884050969262
Energy: 1.3199493668996816
Energy: 1.3214481604806263
Energy: 1.3196275153133716
Energy: 1.3267297334432444
Energy: 1.28473675273919
Energy: 1.3049226021026126
Energy: 1.269404916341536
Energy: 1.3015274683034055
Energy: 1.3350844404565
Energy: 1.4160420672700322
Energy: 1.3633754634661608
Energy: 1.3047401870118025
Energy: 1.271213510714256
Energy: 1.2844581600199698
Energy: 1.3390319807987368
Energy: 1.3056280360416583
Energy: 1.3482910302837496
Energy: 1.234398981627003
Energy: 1.3033877981242679
Energy: 1.4177312660955335
Energy: 1.307187396056584
Energy: 1.429369666094687
Energy: 1.316658927353971
Energy: 1.3190295289584657
Energy: 1.3537807870088625
Energy: 1.3254569766869857
Energy: 1.329374195182769
Energy: 1.4327740768969375
Energy: 1.2190167626435573
Energy: 1.2189610833968925
Energy: 1.3377676407032566
Energy: 1.2258214735603203
Energy: 1.375357507120545
Energy: 1.304828329941331
Energy: 1.3536414253686508
Energy: 1.2307760147242564
Energy: 1.2202034939688158
Energy: 1.3361345614434732
Energy: 1.2418154743956835
Energy: 1.3027797868701998
Energy: 1.3157537106527812
Energy: 1.3080688073705806
Energy: 1.3656292077016638
Energy: 1.4209594003546864
Energy: 1.2189254501935716
Energy: 1.3206097373554702
Energy: 1.3877861393103954
Energy: 1.4207701525723448
Energy: 1.3544169364523648
Energy: 1.303820158461971
Energy: 1.3226945186973653
Energy: 1.3337712250472735
Energy: 1.3203037739661694
Energy: 1.320561167939794
Energy: 1.419007677629748
Energy: 1.3376328265243604
Energy: 1.301924091597899
Energy: 1.3332609530576773
Energy: 1.3310964459273422
Energy: 1.3204114010113126
Energy: 1.2858365087668728
Energy: 1.2842958173848718
Energy: 1.2840030488147678
Energy: 1.3536466721485356
Energy: 1.3085000071809487
Energy: 1.4143136375871688
Energy: 1.3199835137253015
Energy: 1.3020402099929205
Energy: 1.4225866237983424
Energy: 1.331677727083883
Energy: 1.3590102266806094
Energy: 1.3072057322491162
Energy: 1.319442330179512
Energy: 1.2333046898528914
Energy: 1.301574580990824
Energy: 1.313663401945191
Energy: 1.2610206102017691
Energy: 1.3818412888922311
Energy: 1.2376525045833398
Energy: 1.3187479594234586
Energy: 1.3251140163537976
Energy: 1.3661705878592163
Energy: 1.3051854704333443
Energy: 1.3842905185018897
Energy: 1.2194052046427983
Energy: 1.2209635255992592
Energy: 1.3996806873331875
Energy: 1.22145430918487
Energy: 1.3000743695053107
Energy: 1.3525716246587378
Energy: 1.2610094949268096
Energy: 1.465257437911101
Energy: 1.234935540064598
Energy: 1.3192948090524703
Energy: 1.219247642621157
Energy: 1.3001271879683576
Energy: 1.3168187284576174
Energy: 1.312014787267495
Energy: 1.3011002050640263
Energy: 1.3101813124479862
Energy: 1.3194055680153614
Energy: 1.3283340350124526
Energy: 1.2652464198300297
Energy: 1.305049310145723
Energy: 1.3383122652739237
Energy: 1.3019813529239928
Energy: 1.3211987024869383
Energy: 1.3199290499559144
Energy: 1.3253580465596435
Energy: 1.2841919877447563
Energy: 1.305208729895737
Energy: 1.2693407721678043
Energy: 1.300951682683696
Energy: 1.3139393747896353
Energy: 1.4157874756783264
Energy: 1.3645828163079767
Energy: 1.3045694412817068
Energy: 1.2692988542679258
Energy: 1.2843502601013554
Energy: 1.3776265244474648
Energy: 1.304853502682086
Energy: 1.3480971612898625
Energy: 1.2209843336499715
Energy: 1.3031722622853115
Energy: 1.455758527982558
Energy: 1.3066717709364162
Energy: 1.429369863887927
Energy: 1.3162339132120435
Energy: 1.3188385847051538
Energy: 1.3546692569159315
Energy: 1.3140714200487942
Energy: 1.3294148456389066
Energy: 1.4318494633696723
Energy: 1.218929061895747
Energy: 1.2188949725397669
Energy: 1.3346822666520304
Energy: 1.2195418098562794
Energy: 1.3749235817837477
Energy: 1.3049223815218047
Energy: 1.2840692943879277
Energy: 1.2310924977337039
Energy: 1.220425560975922
Energy: 1.336157405681576

minimum gb energy = 1.2188949725397669 eV
minimum distance =  2.25198387037824 Angstroms
sigma value = 21


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

Energy: 1.5998896283673099
Energy: 1.469108461530908
Energy: 1.4820468099274668
Energy: 1.303107057337922
Energy: 1.4511415126860785
Energy: 1.4138596850994047
Energy: 1.4671394206475452
Energy: 1.290835143666076
Energy: 1.2476231352980958
Energy: 1.379988187581084
Energy: 1.1651451239178412
Energy: 1.2514221223179798
Energy: 1.3582785230155277
Energy: 1.4879565041553386
Energy: 1.3458329654890346
Energy: 1.2461254709176965
Energy: 1.3315419636876222
Energy: 1.2661929879540004
Energy: 1.2491465430178017
Energy: 1.2927048494974074
Energy: 1.3309504163597397
Energy: 1.5615556247324265
Energy: 1.2950190574397202
Energy: 1.3557542295447607
Energy: 1.2995889093700181
Energy: 1.215051695364563
Energy: 1.2713196012603607
Energy: 1.3638576305291188
Energy: 1.2852281429448569
Energy: 1.2268559352253645
Energy: 1.3004722190644522
Energy: 1.2476779542072636
Energy: 1.2322145699543423
Energy: 1.3208615583987184
Energy: 1.2954693893888283
Energy: 1.2547801506247471
Energy: 1.2298421946188538
Energy: 1.3124831925346452
Energy: 1.2536953215921298
Energy: 1.255402804163206
Energy: 1.299192159801207
Energy: 1.2895490787222437
Energy: 1.4340525272030096
Energy: 1.2558580094459764
Energy: 1.2713106575917996
Energy: 1.280846636417777
Energy: 1.2551808670038065
Energy: 1.2563905370613897
Energy: 1.3066947211686457
Energy: 1.2704145743585968
Energy: 1.2476077813684312
Energy: 1.3341278820212377
Energy: 1.2543631970208207
Energy: 1.2284785728863052
Energy: 1.3038807285238452
Energy: 1.2962597043651665
Energy: 1.2748985542990652
Energy: 1.2502624245500458
Energy: 1.3195946449159726
Energy: 1.3904409530490418
Energy: 1.2945325233185807
Energy: 1.3620029604655992
Energy: 1.3090631806100985
Energy: 1.2917172902042797
Energy: 1.22772979546602
Energy: 1.4712637170311202
Energy: 1.307928133065849
Energy: 1.2701815043974705
Energy: 1.3234792890003917
Energy: 1.295108325714005
Energy: 1.2704150950070232
Energy: 1.2682546710929663
Energy: 1.3220241470282579
Energy: 1.3856723257703802
Energy: 1.311326441847014
Energy: 1.2573846364041006
Energy: 1.4867855464764284
Energy: 1.2707450975634933
Energy: 1.3977083953444516
Energy: 1.3070723679266243
Energy: 1.2211589095059772
Energy: 1.2546601972543956
Energy: 1.256352205969234
Energy: 1.4743248390115475
Energy: 1.5510436440502164
Energy: 1.2935729683351878
Energy: 1.4346343565271895
Energy: 1.3788302745718983
Energy: 1.3783174321777798
Energy: 1.275830301236339
Energy: 1.3083424199473643
Energy: 1.2551588664211848
Energy: 1.2474871099163343
Energy: 1.397338579757213
Energy: 1.249609898223102
Energy: 1.3460616431113372
Energy: 1.307906582838259
Energy: 1.3691045476679677
Energy: 1.2708410958496918
Energy: 1.3557287067433745
Energy: 1.448043906436207
Energy: 1.214835266245491
Energy: 1.4594787782893293
Energy: 1.5606877156523373
Energy: 1.2963773462495005
Energy: 1.3449157458741685
Energy: 1.247929395191763
Energy: 1.3299803574593916
Energy: 1.3006450623256958
Energy: 1.221240364608697
Energy: 1.323299102411446
Energy: 1.2943037236589687
Energy: 1.2886379196249618
Energy: 1.2642910580046307
Energy: 1.3200848666525304
Energy: 1.248023824854505
Energy: 1.1687619243448668
Energy: 1.3020080626152748
Energy: 1.323370461212821
Energy: 1.25572401416813
Energy: 1.2383277678208306
Energy: 1.2803390669931443
Energy: 1.2632272448848743
Energy: 1.2539453142124588
Energy: 1.2890624654318967
Energy: 1.4838575281428286
Energy: 1.255926261752527
Energy: 1.254630417703724
Energy: 1.318102937908762
Energy: 1.2547084339513215
Energy: 1.2849162332593023
Energy: 1.2570449640505925
Energy: 1.2975267976394083
Energy: 1.3051199558390039
Energy: 1.2467132857958236
Energy: 1.312330939929187
Energy: 1.3006955940744154
Energy: 1.2225788348596291
Energy: 1.2874872350813762
Energy: 1.3229158975061923
Energy: 1.270529941321526
Energy: 1.2543406304317815
Energy: 1.330017804950889
Energy: 1.3848091197981693
Energy: 1.452995592823913
Energy: 1.284107351447062
Energy: 1.4844402105284842
Energy: 1.285861910435206
Energy: 1.2489394689752806
Energy: 1.3246918702331103
Energy: 1.3361433825093372
Energy: 1.2740656469680565
Energy: 1.299963508514509
Energy: 1.3087318498365719
Energy: 1.3309906506808271
Energy: 1.2463143514506416
Energy: 1.2151495233093321
Energy: 1.3813074420249953
Energy: 1.3787419260466625
Energy: 1.3372557321292506
Energy: 1.3262178474954627
Energy: 1.4149075339293729
Energy: 1.3593250140197335
Energy: 1.225273829981275
Energy: 1.2210441266768803
Energy: 1.551372597101955
Energy: 1.5543441982860704
Energy: 1.4866586686826815
Energy: 1.2550861317231317
Energy: 1.247879439895599
Energy: 1.3688825227635468
Energy: 1.2462497853049657
Energy: 1.3814081594919754
Energy: 1.311682529918115
Energy: 1.3691954549548218

minimum gb energy = 1.1651451239178412 eV
minimum distance =  2.19168259234779 Angstroms
sigma value = 113


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

Energy: 1.5989270196380527
Energy: 1.488205710703306
Energy: 1.4178777713730055
Energy: 1.5091129750899972
Energy: 1.5715809263511944
Energy: 1.5781722763486885
Energy: 1.6048842477754748
Energy: 1.4295764148785828
Energy: 1.4468533536595163
Energy: 1.7087196301259167
Energy: 1.2631694538991076
Energy: 1.453991705322989
Energy: 1.4291256011962414
Energy: 1.5883051149718654
Energy: 1.5749227630525382
Energy: 1.4594321415511817
Energy: 1.526663522138571
Energy: 1.346821259017323
Energy: 1.4184023326034862
Energy: 1.562150503550925
Energy: 1.4774158290464072
Energy: 1.3604638347584181
Energy: 1.3338301590629607
Energy: 1.4859708242967866
Energy: 1.6097558836652999
Energy: 1.562316086011492
Energy: 1.5952875198436534
Energy: 1.37253745620084
Energy: 1.3915397625921908
Energy: 1.4270506443876618
Energy: 1.4675174150114718
Energy: 1.4416246581226086
Energy: 1.3990311928856807
Energy: 1.4934559043882858
Energy: 1.520621451703601
Energy: 1.410870669381352
Energy: 1.4181035232979102
Energy: 1.5269583840046674
Energy: 1.3478676157612728
Energy: 1.2812304790806273
Energy: 1.4796747732567777
Energy: 1.4291739315002334
Energy: 1.427362789238724
Energy: 1.3476248971275453
Energy: 1.4130823498420986
Energy: 1.3703078006818152
Energy: 1.370899137435639
Energy: 1.481449253774319
Energy: 1.6035356138442973
Energy: 1.4178577104669428
Energy: 1.304115119554879
Energy: 1.2741604451023252
Energy: 1.5156089098546894
Energy: 1.455908565664157
Energy: 1.311266327591596
Energy: 1.3746070596329119
Energy: 1.2936722983383477
Energy: 1.3589683788269233
Energy: 1.3486995967235536
Energy: 1.3585466320616926
Energy: 1.4105968966933558
Energy: 1.4672894891219697
Energy: 1.3751007332770813
Energy: 1.516951165278741
Energy: 1.383376302334378
Energy: 1.316386468881981
Energy: 1.308596348118177
Energy: 1.3198550132819447
Energy: 1.458534457510349
Energy: 1.3441794132713258
Energy: 1.5192679789761565
Energy: 1.3431162712608875
Energy: 1.3031903908958011
Energy: 1.3548906756199595
Energy: 1.3374009911691371
Energy: 1.375252259584529
Energy: 1.3462505670241909
Energy: 1.3259858486484337
Energy: 1.2631669217835666
Energy: 1.3555956940903366
Energy: 1.4961628567738872
Energy: 1.3781023152428677
Energy: 1.480265252057833
Energy: 1.345677718456552
Energy: 1.346180225637228
Energy: 1.3095116006868406
Energy: 1.2676659842622846
Energy: 1.466945933174956
Energy: 1.3493113615181116
Energy: 1.2922877949187317
Energy: 1.2806069872187296
Energy: 1.4649924409576043
Energy: 1.3175143877028272
Energy: 1.3428972117271016
Energy: 1.3554829604826593
Energy: 1.3216628955615088
Energy: 1.4366994829564141
Energy: 1.432400566562866
Energy: 1.353483154631247
Energy: 1.3244184335017117
Energy: 1.4411468047005185
Energy: 1.3626718643811362
Energy: 1.2798605080236263
Energy: 1.3508907920010922
Energy: 1.3389866153174486
Energy: 1.411320977646654
Energy: 1.4040026293255463
Energy: 1.3530371115286701
Energy: 1.4255455329270286
Energy: 1.4536430958177688
Energy: 1.445371507983405
Energy: 1.505179261168676
Energy: 1.4441138656777694
Energy: 1.4909027733243294
Energy: 1.460264163610753
Energy: 1.4545189532578038
Energy: 1.531183577435628
Energy: 1.5396673753545
Energy: 1.5206260311710373
Energy: 1.4243645856043936
Energy: 1.4932338627031365
Energy: 1.5032684838199868
Energy: 1.4955504253178695
Energy: 1.314576978705696
Energy: 1.4340927623634734
Energy: 1.5245706452971846
Energy: 1.606894928582968
Energy: 1.597233696712163
Energy: 1.4029919062591485
Energy: 1.4193370281033966
Energy: 1.4226546017171664
Energy: 1.4764769667959952
Energy: 1.5025807124865393
Energy: 1.6116456539925084
Energy: 1.4479544637750157
Energy: 1.434328278531303
Energy: 1.4692657794999988
Energy: 1.5823372947098795
Energy: 1.5988124113260342
Energy: 1.6393061552176735
Energy: 1.5355782612392541
Energy: 1.4383881146643798
Energy: 1.331045502100223
Energy: 1.4029592045506076
Energy: 1.5532572128588296
Energy: 1.460555684157264
Energy: 1.4565122395949608
Energy: 1.55077806535183
Energy: 1.4653715572425419
Energy: 1.4745643281335878
Energy: 1.418537559906014
Energy: 1.5227169654045036
Energy: 1.4849944826281336
Energy: 1.587343782510215
Energy: 1.57669533989181
Energy: 1.447673591251785
Energy: 1.392224054130737
Energy: 1.4506612600985105
Energy: 1.4541751409756536
Energy: 1.4993669349950718
Energy: 1.4870951052746737
Energy: 1.3855964456425136
Energy: 1.4450132768366029
Energy: 1.4959430445128759
Energy: 1.3119549191831819
Energy: 1.4554390727278472
Energy: 1.4416566446452914
Energy: 1.4817911080656363
Energy: 1.4249269156529525
Energy: 1.4558257490553381
Energy: 1.5285396636175232
Energy: 1.5003577255538532
Energy: 1.4460294088946486
Energy: 1.486903771260959
Energy: 1.4633704853583074
Energy: 1.5274548319783252
Energy: 1.4281519817735566
Energy: 1.4592921994868828
Energy: 1.6085083993629692
Energy: 1.5714918514107434
Energy: 1.5501769209152312
Energy: 1.5538258790789417
Energy: 1.3612988765033986
Energy: 1.426438674474026
Energy: 1.5044508103929068
Energy: 1.441795192854518
Energy: 1.4320536769748946
Energy: 1.4870710515105285
Energy: 1.4950704791740712
Energy: 1.4096120413166937
Energy: 1.4207593095811992
Energy: 1.525077633316377
Energy: 1.386602996066141
Energy: 1.4083351637921697
Energy: 1.3178025763563477
Energy: 1.4339307825308758
Energy: 1.4295973569641534
Energy: 1.4061526676553353
Energy: 1.4390024556346384
Energy: 1.4089538370360248
Energy: 1.3685862133270592
Energy: 1.4853089171761522
Energy: 1.464379323342938
Energy: 1.4508398583879827
Energy: 1.3032648479482587
Energy: 1.2681581674247182
Energy: 1.4720574689946442
Energy: 1.4023588116438064
Energy: 1.277335264996467
Energy: 1.375625591998255
Energy: 1.2949155708155684
Energy: 1.2883921473392823
Energy: 1.3585098745845487
Energy: 1.3292407974732192
Energy: 1.365540782650543
Energy: 1.3522957192331582
Energy: 1.372021867531489
Energy: 1.3935487639391735
Energy: 1.4052884498013964
Energy: 1.3626836908952058
Energy: 1.3163884301165514
Energy: 1.3186856638660136
Energy: 1.4022292272662709
Energy: 1.3503848801908807
Energy: 1.5180225464806074
Energy: 1.3430765865806966
Energy: 1.29772509718475
Energy: 1.295219851212886
Energy: 1.3374110005071103
Energy: 1.3745693620906179
Energy: 1.3938981903682273
Energy: 1.3440971361982572
Energy: 1.2620632489381793
Energy: 1.355592822569433
Energy: 1.4621082217507961
Energy: 1.4149713072942844
Energy: 1.3205772113414191
Energy: 1.354230731307497
Energy: 1.4088645747689703
Energy: 1.3074571917189928
Energy: 1.268084900613562
Energy: 1.4766633349477214
Energy: 1.3807110563517602
Energy: 1.337802686151021
Energy: 1.2800063052377506
Energy: 1.4764846214861507
Energy: 1.318031423484081
Energy: 1.373574569932502
Energy: 1.3273723413730931
Energy: 1.2896425170136663
Energy: 1.415069274429298
Energy: 1.557847884939321
Energy: 1.3523078697694317
Energy: 1.4905682809443577
Energy: 1.444628516240358
Energy: 1.2779545063138398
Energy: 1.2756711963152148
Energy: 1.3508473767953113
Energy: 1.3395820236161262
Energy: 1.4074179995892466
Energy: 1.4263426976358633
Energy: 1.4273125552216384
Energy: 1.4162530331468817
Energy: 1.4461979671670746
Energy: 1.4425134795049745
Energy: 1.465657646088349
Energy: 1.4122167306173816
Energy: 1.4327895939428745
Energy: 1.390063355330122
Energy: 1.4546111382261973
Energy: 1.5360347823690406
Energy: 1.4918494081743088
Energy: 1.4780512508709098
Energy: 1.4256365581203116
Energy: 1.4914805612592386
Energy: 1.5046303083646844
Energy: 1.500140139349143
Energy: 1.3464253205628665
Energy: 1.4512223035697556
Energy: 1.5225780340976833
Energy: 1.4834660401079343
Energy: 1.599686577030903
Energy: 1.437239681733034
Energy: 1.445254633680522
Energy: 1.4544583037546237
Energy: 1.5476753029701453
Energy: 1.495588181173671
Energy: 1.505079550162555
Energy: 1.3593371660309734
Energy: 1.5931667390654882
Energy: 1.4625756615345549
Energy: 1.5751021599495953
Energy: 1.4084024333432617
Energy: 1.5858491832364794
Energy: 1.5353507102065502
Energy: 1.4208747614468822
Energy: 1.3317243431420334
Energy: 1.4186369133026246
Energy: 1.5430957395689042
Energy: 1.3532321155193954
Energy: 1.396122093215812
Energy: 1.630440487253109
Energy: 1.5815656302068857
Energy: 1.46139786081711
Energy: 1.4029776031189185
Energy: 1.5540010261765589
Energy: 1.460642135355091
Energy: 1.3966781198954155
Energy: 1.5745728695406425
Energy: 1.4487119179687513
Energy: 1.432071660458855
Energy: 1.4488142475872337
Energy: 1.4532499153627496
Energy: 1.5027116488930754
Energy: 1.6709457143165607

minimum gb energy = 1.2620632489381793 eV
minimum distance =  2.17010610475997 Angstroms
sigma value = 365


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

Energy: 1.389251212803779
Energy: 1.29042280903267
Energy: 1.2908037018365062
Energy: 1.2954736203267951
Energy: 1.2977296561033205
Energy: 1.290496990933448
Energy: 1.2910777887041012
Energy: 1.397552370568722
Energy: 1.475039027264009
Energy: 1.2915845188429642
Energy: 1.2907165531448996
Energy: 1.291240664663358
Energy: 1.2923492859342522
Energy: 1.475577642764895
Energy: 1.3589464496144266
Energy: 1.5024028333751678
Energy: 1.2913022442437256
Energy: 1.2906541997954974
Energy: 1.29119184946238
Energy: 1.2914378541769878
Energy: 1.2899331309778919
Energy: 1.3594993142656564
Energy: 1.502940107587643
Energy: 1.291240947295138
Energy: 1.2903702723683177
Energy: 1.2907086882792038
Energy: 1.2906962022776682
Energy: 1.2948544235597705
Energy: 1.3961735567444487
Energy: 1.4759604577314598
Energy: 1.3366555915367024
Energy: 1.5003738075558413
Energy: 1.3375014095785733
Energy: 1.3137225133125294
Energy: 1.4751895520569047
Energy: 1.359984700875177
Energy: 1.5005766017617244
Energy: 1.2911585838460529
Energy: 1.2963932380295902
Energy: 1.2900880803597135
Energy: 1.2909067301197643
Energy: 1.291729364403919
Energy: 1.3599958336571385
Energy: 1.5025873965909922
Energy: 1.2916276860754798
Energy: 1.2909501400374221
Energy: 1.2910590305630107
Energy: 1.2913120791057684
Energy: 1.502631054706005
Energy: 1.360383074092732
Energy: 1.5021011810287501
Energy: 1.2911981606624348
Energy: 1.2912418738376048
Energy: 1.2914023789448645
Energy: 1.2912705287934327
Energy: 1.5027241036480143
Energy: 1.361413983497047
Energy: 1.500829832038308
Energy: 1.2909800093601358
Energy: 1.2973344853031894
Energy: 1.2903994766208209
Energy: 1.291213206192617
Energy: 1.2928760084510817
Energy: 1.396034299600733
Energy: 1.5004680008100109
Energy: 1.35086631840893
Energy: 1.5005521115004956
Energy: 1.5008941315103548
Energy: 1.3514870795243563
Energy: 1.474654472309287
Energy: 1.3607664016001517
Energy: 1.502972443958041
Energy: 1.2908462264494287
Energy: 1.290098216945659
Energy: 1.2904840078043143
Energy: 1.2908375160250127
Energy: 1.2934555756393455
Energy: 1.3589582246911007
Energy: 1.5022565872643976
Energy: 1.2911065842597513
Energy: 1.2909440789679816
Energy: 1.29164671146256
Energy: 1.2908541636950592
Energy: 1.502541198072228
Energy: 1.360475926317029
Energy: 1.4758594959742712
Energy: 1.2922091362440036
Energy: 1.2911940752334417
Energy: 1.2911051829114681
Energy: 1.2916005047090464
Energy: 1.4761043195864962
Energy: 1.3610713438269642
Energy: 1.5008479412118096
Energy: 1.2908628074774489
Energy: 1.2960339331881692
Energy: 1.2981017862503734
Energy: 1.2905510408760232
Energy: 1.291359061784983
Energy: 1.3964744722256304
Energy: 1.47539079509697
Energy: 1.3365875106481533
Energy: 1.3385715116342374
Energy: 1.2916532319192193
Energy: 1.2938014041637276
Energy: 1.4763427520894727
Energy: 1.359672582822679
Energy: 1.5027842687249813
Energy: 1.2913043836797415
Energy: 1.2906722124865793
Energy: 1.2906969635405487
Energy: 1.2912036405471383
Energy: 1.2899090152704018
Energy: 1.359033360736471
Energy: 1.502717358651092
Energy: 1.2914367165140517
Energy: 1.2906967402334644
Energy: 1.2909522153693829
Energy: 1.2918301070415719
Energy: 1.2899674565808543
Energy: 1.3968870693509121
Energy: 1.4756093309242089
Energy: 1.290769369233464
Energy: 1.2918814329820116
Energy: 1.2913192955575725
Energy: 1.29307319482959
Energy: 1.475941853538232
Energy: 1.3609672310610745
Energy: 1.5000421078820707
Energy: 1.290729472271451
Energy: 1.2956092058006137
Energy: 1.29801252924595
Energy: 1.2903990241779861
Energy: 1.291083992273018
Energy: 1.3614369937674784
Energy: 1.4762390938232064
Energy: 1.2928198365493677
Energy: 1.2910481164986805
Energy: 1.2909496184282891
Energy: 1.2917278694032945
Energy: 1.4753968615344597

minimum gb energy = 1.2899090152704018 eV
minimum distance =  2.22605974319612 Angstroms
sigma value = 23