Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_Fe__MO_650279905230_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.865948021411896
cohesive_energy=4.290335425356015
mass=55.845
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=[5.2308343399822196e-21, 4.26648422397762e-20, 1.223665608570768e-19, 2.10836831974596e-19, 2.8695784603257e-19, 3.5040243856233597e-19, 4.0488445500150593e-19, 4.52688599230164e-19, 4.9464800309799e-19, 5.31006197453352e-19, 5.61989089201644e-19, 5.88003631207902e-19, 6.095913591744179e-19, 6.27337067572602e-19, 6.41795109517818e-19, 6.534637619432399e-19, 6.6277240818678e-19, 6.700975597574279e-19, 6.757756737483239e-19, 6.80104755013392e-19, 6.833411518140719e-19, 6.855906078082079e-19, 6.86905994824722e-19, 6.87333775986e-19, 6.86873951292042e-19, 6.853951422588599e-19, 6.827227116333479e-19, 6.78646774276452e-19, 6.72917390633268e-19, 6.652237384368e-19, 6.551893061780579e-19, 6.42351064809816e-19, 6.261274242139319e-19, 6.0579259837520395e-19, 5.804381531421539e-19, 5.4892173657474e-19, 5.0979658317246e-19, 4.61233007219286e-19, 4.0087100253333596e-19, 3.25576711618506e-19, 2.3101144014992395e-19, 1.108292869156428e-19, -4.4576078746474803e-20, -2.4976972418079596e-19, -5.26172430548574e-19, -9.046818538011719e-19, -1.43019098322327e-18, -2.1711576220324198e-18]
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: -2.38418579101562e-07 eV

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

Energy: 0.016120849682829824
Energy: 0.016288537446199167
Energy: 1.7219619489576807
Energy: 0.016797028697915235
Energy: 0.016645904931518074
Energy: 1.7193118499836468
Energy: 0.016476654218805318
Energy: 0.016516149849530697
Energy: 0.2033546128771061
Energy: 0.3915249740542397
Energy: 0.1687775580431661
Energy: 0.39093183068990045
Energy: 0.20220407945479196
Energy: 0.16841710879989366
Energy: 0.1685681306864229
Energy: 0.20462221285540008
Energy: 0.3915128951471914
Energy: 0.16826106901440435
Energy: 0.39045408425993955
Energy: 0.20213443351743327
Energy: 0.1687288770847401
Energy: 0.1693109675975127
Energy: 0.39189718475798646
Energy: 0.20303507870017348
Energy: 0.16912657550356675
Energy: 0.1697019654054956
Energy: 0.20272373950453784
Energy: 0.16852070611873107
Energy: 0.16825558462847948
Energy: 0.2022170623088326
Energy: 0.39143282949909275
Energy: 0.1696915788607481
Energy: 0.3902619665830825
Energy: 0.2018921103419103
Energy: 0.16891026101300505
Energy: 0.01654734100807666
Energy: 0.2018490415347928
Energy: 0.39084904399845777
Energy: 0.01703427156639574
Energy: 0.017302996044856637
Energy: 0.3923455197089417
Energy: 0.16832883227349668

minimum gb energy = 0.016120849682829824 eV
minimum distance =  2.4505682305629 Angstroms
sigma value = 5


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

Energy: 2.3663682379944246
Energy: 1.279597045901171
Energy: 1.4147559994627998
Energy: 1.2744892470521774
Energy: 1.2511071205494595
Energy: 2.1595188385472968
Energy: 1.2788669247934719
Energy: 1.3374189015557156
Energy: 1.3306557574905378
Energy: 1.3282517718914042
Energy: 1.3427321733651567
Energy: 1.3450637628752928
Energy: 1.3350690470145232
Energy: 1.3155171808887904
Energy: 1.302143422622787
Energy: 1.3430703471565568
Energy: 1.367934971041895
Energy: 1.3248865049871295
Energy: 1.3623014453168782
Energy: 1.367351072752742
Energy: 1.318779236371742
Energy: 1.2844090915809956
Energy: 1.3457262368426182
Energy: 1.3653356247772788
Energy: 1.3183026091170718
Energy: 1.3478938589951994
Energy: 1.3611098304993217
Energy: 1.31108300977315
Energy: 1.3184364836808542
Energy: 1.3422182778286593
Energy: 1.3494179673678561
Energy: 1.3141684014636574
Energy: 1.3320023947073143
Energy: 1.3570227379259818
Energy: 1.3269763374735737
Energy: 1.3286990006246977
Energy: 1.3163430182561553
Energy: 1.3112782535133858
Energy: 1.353461386654557
Energy: 1.3385876031499568
Energy: 1.3115271248087716
Energy: 1.3449845660020194
Energy: 1.3171471009616256
Energy: 1.3057732604406058
Energy: 1.3272635055730555
Energy: 1.3668998152633285
Energy: 1.3533983121355966
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Energy: 1.3537077861367388
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Energy: 1.3186240093888877
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Energy: 1.344693333965902
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Energy: 1.2920357714955824
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Energy: 1.3716181535640293
Energy: 1.2753471294849608
Energy: 1.3288507082127976
Energy: 1.325117362224643
Energy: 1.267959588807131
Energy: 1.2540793456853399
Energy: 1.3124225982857638
Energy: 1.35773598053234
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Energy: 1.3412383323841637
Energy: 1.2999769614180239
Energy: 1.285107361229925
Energy: 1.3277792833936555
Energy: 1.2970741743354688
Energy: 1.3761249093070744
Energy: 1.3172704444039716
Energy: 1.2753578704349295
Energy: 1.3321909599890174
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Energy: 1.401996418035902
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Energy: 1.2886940890010787
Energy: 1.2807442661682724
Energy: 1.2528315161365768
Energy: 1.3375354791745087
Energy: 1.2807911838135075
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Energy: 1.3652214223208667
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Energy: 1.3689287955343925
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Energy: 1.3086044278955216
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Energy: 1.2887943844418308
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Energy: 1.3396451047557993
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Energy: 1.2924367968152382
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Energy: 1.316474099932217
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Energy: 1.4137793555276696
Energy: 1.324942154166423
Energy: 1.3733139882098906
Energy: 1.2787315877923167
Energy: 1.287486566178049
Energy: 1.3739661147890962
Energy: 1.2978134457970174
Energy: 1.257102022277236
Energy: 1.2667662932751405
Energy: 1.2985052644268436
Energy: 1.3495851102654632
Energy: 1.2752567730661886
Energy: 1.3027538331855593
Energy: 1.3458400834194333
Energy: 1.2535573741877237
Energy: 1.2837246851097726
Energy: 1.2969927515127007
Energy: 1.3055811012805425
Energy: 1.2788135492820216
Energy: 1.3156649523340955
Energy: 1.2934531657785338
Energy: 1.2481281422431092
Energy: 1.279610484967956
Energy: 1.2945591984151636
Energy: 1.2907778160531498
Energy: 1.2758666227366733
Energy: 1.3086336769452422
Energy: 1.2849064582051097
Energy: 1.380376831016311
Energy: 1.318310109792617
Energy: 1.3171241165663283
Energy: 1.3988435690659895
Energy: 1.3784969534790146
Energy: 1.3051029964631011
Energy: 1.372947674041299
Energy: 1.297412162126741
Energy: 1.3309948499449789
Energy: 1.3460820686182937
Energy: 1.307306352808132
Energy: 1.3450668797999987
Energy: 1.3483598678980404
Energy: 1.298937354472182
Energy: 1.2958920241303125
Energy: 1.3420405086925644
Energy: 1.3658130920313392
Energy: 1.3201413237879691
Energy: 1.3581218103876012
Energy: 1.3670295150413834
Energy: 1.3278157463249112
Energy: 1.2930698650449226
Energy: 1.3781057190998895
Energy: 1.4126759869908523
Energy: 1.3140776476090124
Energy: 1.3744561004887625
Energy: 1.3935640299033767
Energy: 1.321152054564447
Energy: 1.2705042577260142
Energy: 1.3485847856091164
Energy: 1.316414269882944
Energy: 1.281392744184558
Energy: 1.2782519695477448
Energy: 1.296027566684792
Energy: 1.3426902652322683

minimum gb energy = 1.2313451194729175 eV
minimum distance =  2.29505996666582 Angstroms
sigma value = 401


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

Energy: 2.0387340998109473
Energy: 1.6836907016000773
Energy: 1.9090276495258076
Energy: 1.5972057820836798
Energy: 1.5975333489315193
Energy: 1.3897442097348072
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Energy: 1.3871098249323885
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Energy: 1.4128007784988572
Energy: 1.3018230223493894
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Energy: 1.318731285889483
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Energy: 1.4663047023145692
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Energy: 1.2912674627857652
Energy: 1.3846538096859218
Energy: 1.322752930056511
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Energy: 1.4913513229399151
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Energy: 1.3876440280925886
Energy: 1.389531723224077
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Energy: 1.260539833873966
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Energy: 1.4028287828372177
Energy: 1.2571988834049006
Energy: 1.256257247060297
Energy: 1.384957148900451
Energy: 1.3464174837793885
Energy: 1.3867348077212251
Energy: 1.3504192166262887
Energy: 1.4550111834794495
Energy: 1.3927780642683036
Energy: 1.321068780431982
Energy: 1.4465416037904528
Energy: 1.386168876507959
Energy: 1.3708441222364822
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Energy: 1.5111595902589918
Energy: 1.3922477990940672
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Energy: 1.3983356797128879
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Energy: 1.4383007011736113
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Energy: 1.418374742374693
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Energy: 1.4833402286630966
Energy: 1.3597231698368935
Energy: 1.413416272440674
Energy: 1.4789139554670883
Energy: 1.4924790437951485
Energy: 1.4140927586308196
Energy: 1.3944197298959746
Energy: 1.495988367388623
Energy: 1.49556054578972
Energy: 1.3824849226583202
Energy: 1.467349891364006
Energy: 1.495861983736559
Energy: 1.4183509429289818
Energy: 1.4197292935362575
Energy: 1.48493166318816
Energy: 1.5123838593826266
Energy: 1.415813492400309
Energy: 1.452991033410087
Energy: 1.3974013578846944
Energy: 1.3390361605864436
Energy: 1.3947064100885986
Energy: 1.387338983795592
Energy: 1.400663550453624
Energy: 1.4121763132746117
Energy: 1.4618440273563373
Energy: 1.5303776059156866
Energy: 1.3802201424192655
Energy: 1.728499949026285
Energy: 1.4293230483110484
Energy: 1.4003336267685158
Energy: 1.7272703099187048
Energy: 1.39438498825541
Energy: 1.3792829415663859
Energy: 1.3974857804483107
Energy: 1.4308423996062534
Energy: 1.3820758489950562
Energy: 1.3829432551401575
Energy: 1.3826834519323576
Energy: 1.433693938941053
Energy: 1.5561493885709474
Energy: 1.4662674312991113
Energy: 1.4176292906808583
Energy: 1.4790450990738602
Energy: 1.5481170989203727
Energy: 1.4259791236671644
Energy: 1.4965583630701864
Energy: 1.5575937549695944
Energy: 1.463892709220716
Energy: 1.4349909887278949
Energy: 1.5075772847114788
Energy: 1.5311540655016511
Energy: 1.434786730613029
Energy: 1.4657262000859668
Energy: 1.5508824237494507
Energy: 1.454606517888969
Energy: 1.4345593414678894
Energy: 1.470292916069286
Energy: 1.4072219250739118
Energy: 1.4430062827843368
Energy: 1.4582608388883944
Energy: 1.3459941062278102
Energy: 1.3689310834837325
Energy: 1.38139396997682
Energy: 1.3912622582887095
Energy: 1.3040085996341244
Energy: 1.3795096738570913
Energy: 1.3890645661960976
Energy: 1.3434574606955365
Energy: 1.3627847843394223
Energy: 1.3907695403600304
Energy: 1.3619704374290345
Energy: 1.3613442589011793
Energy: 1.3712157172571822
Energy: 1.3708990246954298
Energy: 1.3681456376545131
Energy: 1.3553335948307046
Energy: 1.3951542550806917
Energy: 1.380521245850443
Energy: 1.3351499285712627
Energy: 1.3792521901606274
Energy: 1.3733149246591876
Energy: 1.406957740224813
Energy: 1.3019508480730537
Energy: 1.466500737851486
Energy: 1.2999979337371295
Energy: 1.3118167220721446
Energy: 1.384269374171572
Energy: 1.2975717051061575
Energy: 1.422117009000076
Energy: 1.32984042099569
Energy: 1.3934430786258467
Energy: 1.2961921548113702
Energy: 1.347255062470398
Energy: 1.525770424103809
Energy: 1.4674807830201813
Energy: 1.3158244917212143
Energy: 1.2951088790817147
Energy: 1.369076730442183
Energy: 1.317648125302423
Energy: 1.3186066151529372
Energy: 1.3792162483768644
Energy: 1.3163162838545386
Energy: 1.3373561129669131
Energy: 1.2590944703362217
Energy: 1.3273585960277217
Energy: 1.2566203082095297
Energy: 1.257938212471689
Energy: 1.3273750706083556
Energy: 1.3119339677370858

minimum gb energy = 1.2556133079539535 eV
minimum distance =  2.2881348425796 Angstroms
sigma value = 311


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

Energy: 1.503622555988552
Energy: 1.4749311935032592
Energy: 1.4544180523612302
Energy: 1.3491727225212289
Energy: 1.4640164849472967
Energy: 1.6468481312966212
Energy: 1.4006362010641167
Energy: 1.2401708441745307
Energy: 1.3354441327255109
Energy: 1.3257761704583497
Energy: 1.3107016696650033
Energy: 1.294173199317005
Energy: 1.3289919789505926
Energy: 1.2764112732726494
Energy: 1.2807437498297827
Energy: 1.2847704063374354
Energy: 1.305205110005055
Energy: 1.2735144715992488
Energy: 1.4808062313355488
Energy: 1.4455468051509281
Energy: 1.2724893034323381
Energy: 1.3149657514855237
Energy: 1.228954638129404
Energy: 1.341904888334444
Energy: 1.5031379468063792
Energy: 1.534273962152537
Energy: 1.5336182850214273
Energy: 1.4885820692949283
Energy: 1.4596526699666272
Energy: 1.4431215098820727
Energy: 1.2934653411665828
Energy: 1.2784917046179645
Energy: 1.3118961884966411
Energy: 1.4389295350003912
Energy: 1.4026550581322874
Energy: 1.5360438293602934
Energy: 1.3355750203078345
Energy: 1.3616697478299336
Energy: 1.2810473275825678
Energy: 1.4446617974734548
Energy: 1.4956292058357121
Energy: 1.4917331053187461
Energy: 1.551568081373404
Energy: 1.5582737929997763
Energy: 1.5331702214573624
Energy: 1.557898529031623
Energy: 1.546849055405615
Energy: 1.5310354774188921
Energy: 1.5854446852595705
Energy: 1.434342598295757
Energy: 1.4354440483511364
Energy: 1.4140238889245358
Energy: 1.4425105486649694
Energy: 1.3968852486758583
Energy: 1.360964485850773
Energy: 1.4735078025586859
Energy: 1.3633135500211144
Energy: 1.3913619982082854
Energy: 1.4391127297953688
Energy: 1.4249436266230286
Energy: 1.406489443153364
Energy: 1.3799272219684713
Energy: 1.4122375396406244
Energy: 1.5428507030759047
Energy: 1.5077101884279043
Energy: 1.4127700433322246
Energy: 1.4478294919067387
Energy: 1.3525652961769357
Energy: 1.4667351521394407
Energy: 1.5906534205716567
Energy: 1.352450968900684
Energy: 1.377911472152237
Energy: 1.3678790913021412
Energy: 1.4276939425540558
Energy: 1.3723963142814373
Energy: 1.3903257683426937
Energy: 1.503504115302035
Energy: 1.4758162421439227
Energy: 1.4294560346991183
Energy: 1.4810292788280321
Energy: 1.4999032335326767
Energy: 1.4417211855428091
Energy: 1.4434551307671248
Energy: 1.4607180891693525
Energy: 1.5988693502110067
Energy: 1.4391297144157507
Energy: 1.343957873615043
Energy: 1.3322757662922218
Energy: 1.3927307190935159
Energy: 1.3648784568233052
Energy: 1.4214296581097505
Energy: 1.3764588890416802
Energy: 1.4090556023602372
Energy: 1.3587298000080763
Energy: 1.3752523234315253
Energy: 1.359498776481949
Energy: 1.386278844976904
Energy: 1.3733244989746425
Energy: 1.4585591709582526
Energy: 1.3962289152299026
Energy: 1.3719914915238176
Energy: 1.359119113618576
Energy: 1.4341900817834325
Energy: 1.3753604707019718
Energy: 1.526290658097686
Energy: 1.3661433832715084
Energy: 1.5245784871834107
Energy: 1.3404135861920277
Energy: 1.3781107725327333
Energy: 1.5100563718650226
Energy: 1.5373609901106031
Energy: 1.4532721396946773
Energy: 1.4868035107056088
Energy: 1.4780367008172537
Energy: 1.3315904099533418
Energy: 1.3820708424547261
Energy: 1.3975994050501561
Energy: 1.3626080639333025
Energy: 1.35761642093893
Energy: 1.5519310874752388
Energy: 1.5129259019035959
Energy: 1.527796209315245
Energy: 1.4662960673893857
Energy: 1.427155346747864
Energy: 1.439089401868493
Energy: 1.421131833752258
Energy: 1.5363344580946168
Energy: 1.5981132842102077
Energy: 1.5310539729004278
Energy: 1.5327436319274546
Energy: 1.598686019966321
Energy: 1.5365022528036272
Energy: 1.5286727821725565
Energy: 1.4291658485268341
Energy: 1.4683598613786484
Energy: 1.4150607284266172
Energy: 1.4409235001563359
Energy: 1.484313363377176
Energy: 1.4423875257135608
Energy: 1.406458893168374
Energy: 1.4283396604306946
Energy: 1.5521750298252712
Energy: 1.39618161015606
Energy: 1.4321570027675845
Energy: 1.5199704294930623
Energy: 1.5138207997955941
Energy: 1.3712949782011588
Energy: 1.4302979573558718
Energy: 1.4339978452899664
Energy: 1.4845876673516007
Energy: 1.5301897615173246
Energy: 1.4061689495131844
Energy: 1.3560140820162685
Energy: 1.3947155311133026
Energy: 1.3742968920589658
Energy: 1.4118577882558552
Energy: 1.3650979505540004
Energy: 1.5283787291786015
Energy: 1.3563749496218462
Energy: 1.360102381979951
Energy: 1.3696138553054875
Energy: 1.499056894088294
Energy: 1.5196164245396888
Energy: 1.4865732216786058
Energy: 1.5184597283098558
Energy: 1.555394055572181
Energy: 1.344094551405254
Energy: 1.453210754787496
Energy: 1.4866778463101207
Energy: 1.3337128423781581
Energy: 1.244777949780965
Energy: 1.4779768464420935
Energy: 1.3683599921504281
Energy: 1.2449566634267681
Energy: 1.3545655778352481
Energy: 1.3556086751439413
Energy: 1.3580302805564464
Energy: 1.426878149653665
Energy: 1.4981735130605291
Energy: 1.3529722269346014
Energy: 1.364522207987443
Energy: 1.3907973584377258
Energy: 1.4016896837381703
Energy: 1.3766020253345934
Energy: 1.36580309514391
Energy: 1.5570834119654229
Energy: 1.3999666418464385
Energy: 1.3843373009633386
Energy: 1.449681808827263
Energy: 1.3456355814669745
Energy: 1.4589622413031795
Energy: 1.371643204359985
Energy: 1.3697228004253266
Energy: 1.4770414817850166
Energy: 1.4582774163090864
Energy: 1.5576509970137602
Energy: 1.3773010463614235
Energy: 1.397903224261381
Energy: 1.378867260793159
Energy: 1.4702481705982051
Energy: 1.3933796245563868
Energy: 1.4139579534895852
Energy: 1.4163123465687437
Energy: 1.5427151224301632
Energy: 1.5064991128713496
Energy: 1.5735194247548656
Energy: 1.5716779696958771
Energy: 1.555543028764008
Energy: 1.5644096930981113
Energy: 1.5570873608194766
Energy: 1.4560538794658513
Energy: 1.4515958967690057
Energy: 1.5512746427455428
Energy: 1.4463557794531727
Energy: 1.5436537961041277
Energy: 1.5542394565811266
Energy: 1.5630749849059633
Energy: 1.356654082121053
Energy: 1.3538342702962427
Energy: 1.2891766471167874
Energy: 1.2728929223439187
Energy: 1.3911646286854196
Energy: 1.4718767931061845
Energy: 1.4460402122546512
Energy: 1.5074746671346484
Energy: 1.4722825480520612
Energy: 1.5710697120293091
Energy: 1.3866647118461184
Energy: 1.3878229979966543
Energy: 1.406668411725022
Energy: 1.5118285232598614
Energy: 1.2951059338729747
Energy: 1.2856444835046705
Energy: 1.3030970769990344
Energy: 1.2725384865301335
Energy: 1.459629484515963
Energy: 1.2939786421997679
Energy: 1.4265416693931525
Energy: 1.2954202481347488
Energy: 1.2914775338878486
Energy: 1.4097218463052996
Energy: 1.3826969126679989
Energy: 1.4574672778487823
Energy: 1.420120648322918
Energy: 1.276428084074276
Energy: 1.358934737002733
Energy: 1.448640044765026
Energy: 1.436260082517418
Energy: 1.3449453827478428
Energy: 1.4936244219985875
Energy: 1.53938922967789
Energy: 1.3999902446444346

minimum gb energy = 1.228954638129404 eV
minimum distance =  2.29527800486041 Angstroms
sigma value = 39


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

Energy: 1.5598738928223832
Energy: 1.560494823417892
Energy: 1.3386985559565094
Energy: 1.562022831251585
Energy: 1.5599609470310303
Energy: 1.5613013671455522
Energy: 1.5606309564455838
Energy: 1.3646226932215182
Energy: 1.3481490107383276
Energy: 1.3271047970067258
Energy: 1.4072033147356713
Energy: 1.349142808127724
Energy: 1.362160327449852
Energy: 1.4165063032088552
Energy: 1.4067537590294208
Energy: 1.3158711402983914
Energy: 1.3377035385512435
Energy: 1.4084580354048488
Energy: 1.3638338009713586
Energy: 1.328228370322667
Energy: 1.3360050509472776
Energy: 1.4434198815159414
Energy: 1.2678003560469224
Energy: 1.33935598866189
Energy: 1.4514835895488762
Energy: 1.384941254740212
Energy: 1.3156418434665218
Energy: 1.3313594833620055
Energy: 1.4250003217770368
Energy: 1.2979308413916375
Energy: 1.319374848926582
Energy: 1.3382008573462467
Energy: 1.297013524054099
Energy: 1.2963826896793986
Energy: 1.3359461644035266
Energy: 1.3548521137074414
Energy: 1.2978210316760483
Energy: 1.3297682073317814
Energy: 1.4091714545468401
Energy: 1.3469667172019228
Energy: 1.3281864625584319
Energy: 1.3382032235176848
Energy: 1.358226830710075
Energy: 1.3471052219919353
Energy: 1.3586149857998273
Energy: 1.388448378861633
Energy: 1.350326530678986
Energy: 1.3560776978008384
Energy: 1.3987235342013082
Energy: 1.3593874248378135
Energy: 1.349251880023938
Energy: 1.3515155225879385
Energy: 1.35805636924441
Energy: 1.3486060508540836
Energy: 1.303320014414229
Energy: 1.4042790383735313
Energy: 1.3549250074267343
Energy: 1.3804386856982034
Energy: 1.3403180944480055
Energy: 1.4210432394060462
Energy: 1.3576153801642612
Energy: 1.326600259225225
Energy: 1.4224501321200818
Energy: 1.3423541200203808
Energy: 1.3581970775508587
Energy: 1.441020367794117
Energy: 1.4344331598460252
Energy: 1.4037564011785315
Energy: 1.442685928513538
Energy: 1.4063442327620972
Energy: 1.3443736450743058
Energy: 1.3287223132762227
Energy: 1.2970650833284625
Energy: 1.41535049503382
Energy: 1.3281945964283837
Energy: 1.298828069753196
Energy: 1.4025801556799127
Energy: 1.4072089920773787
Energy: 1.2738873611954191
Energy: 1.3195643102454595
Energy: 1.4078738661990855
Energy: 1.3297730165072408
Energy: 1.3177222280086636
Energy: 1.4085466192450806
Energy: 1.4171379891277165
Energy: 1.2996123753284203
Energy: 1.5262094071214842
Energy: 1.5180871118042338
Energy: 1.3411721871180873
Energy: 1.1980387140170186
Energy: 1.5176563537899765
Energy: 1.4066612501948244
Energy: 1.3398749323302654
Energy: 1.3185746040225037
Energy: 1.410329123553039
Energy: 1.3624550096091717
Energy: 1.295614332763884
Energy: 1.4140798138596373
Energy: 1.3646625402274237
Energy: 1.3585830748804588
Energy: 1.4414487386474812
Energy: 1.4063978171200797
Energy: 1.3566469748478505
Energy: 1.4416002044014946
Energy: 1.4161823137289662
Energy: 1.559588915722076
Energy: 1.4700106055208488
Energy: 1.3622727159913202
Energy: 1.5605047503235485
Energy: 1.5601826951724431
Energy: 1.5424751867259316
Energy: 1.4750346052342167
Energy: 1.4053562413622331
Energy: 1.34830419759482
Energy: 1.327208939246229
Energy: 1.4072226376045749
Energy: 1.3486440638845882
Energy: 1.3618962062105577
Energy: 1.4165258231184963
Energy: 1.4067722139676357
Energy: 1.3158984541481857
Energy: 1.3377262610201772
Energy: 1.4086006562680842
Energy: 1.364036084739285
Energy: 1.3280810692989606
Energy: 1.397733908203865
Energy: 1.443142338924249
Energy: 1.2674320112718482
Energy: 1.3401697082497923
Energy: 1.3313275355361658
Energy: 1.384886191863758
Energy: 1.3148587813332493
Energy: 1.331296765553985
Energy: 1.3085513530199675
Energy: 1.2979961629218488
Energy: 1.319279022496314
Energy: 1.3381348694626631
Energy: 1.307376343010284
Energy: 1.297118143582522
Energy: 1.3361909791506583
Energy: 1.3553039269154006
Energy: 1.2979179236683867
Energy: 1.329662758445819
Energy: 1.4037861233765596
Energy: 1.3471672583963885
Energy: 1.341885200829818
Energy: 1.3461443934562076
Energy: 1.3710091828417037
Energy: 1.3468792125277134
Energy: 1.3587533653702921
Energy: 1.387642992592269
Energy: 1.3507568795014524
Energy: 1.3561325137785747
Energy: 1.3984296848533657
Energy: 1.3590559298129539
Energy: 1.3491872340641444
Energy: 1.3514162707599464
Energy: 1.35914990095175
Energy: 1.3487981216906955
Energy: 1.3023146144268913
Energy: 1.4038663908371345
Energy: 1.3551589718231636
Energy: 1.3790148686873573
Energy: 1.3403676482684668
Energy: 1.4215588742706309
Energy: 1.3591496260167335
Energy: 1.3265119467773743
Energy: 1.4231542064984435
Energy: 1.340782162597085
Energy: 1.3581801361563934
Energy: 1.441429603569078
Energy: 1.4238664247320747
Energy: 1.3424409307886993
Energy: 1.4427725240637357
Energy: 1.4060488337653294
Energy: 1.344331135013108
Energy: 1.328762788800512
Energy: 1.297476488112272
Energy: 1.4158888384075148
Energy: 1.3286607720740091
Energy: 1.2983686581392513
Energy: 1.4025004534789094
Energy: 1.410743209650143
Energy: 1.273825009485066
Energy: 1.3189983704802284
Energy: 1.4078587636402378
Energy: 1.329845136837841
Energy: 1.3181267280365956
Energy: 1.3883632746245933
Energy: 1.428220678293413
Energy: 1.2993895698697682
Energy: 1.526056358455651
Energy: 1.51838605121998
Energy: 1.3418860520904108
Energy: 1.1982295269620518
Energy: 1.5178264907846741
Energy: 1.4069390938465947
Energy: 1.3395600900495896
Energy: 1.318602075403704
Energy: 1.4104403954132676
Energy: 1.3620558857763307
Energy: 1.2974786029860743
Energy: 1.4089624379303618
Energy: 1.364697064553281
Energy: 1.3584251731264008
Energy: 1.4416008417132307
Energy: 1.406553393030639
Energy: 1.3566609920854622
Energy: 1.441878614038986
Energy: 1.4160606710417616

minimum gb energy = 1.1980387140170186 eV
minimum distance =  2.28965627985515 Angstroms
sigma value = 21


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

Energy: 1.767346782137874
Energy: 1.2318675993838804
Energy: 1.1935501256444783
Energy: 1.3224338130109436
Energy: 1.4135096119309418
Energy: 1.2226531675611052
Energy: 1.2317734906205227
Energy: 1.287759022060727
Energy: 1.2803959974857373
Energy: 1.2248523284639814
Energy: 1.3042861949275235
Energy: 1.2321299724565238
Energy: 1.2239901796207453
Energy: 1.3051414018978769
Energy: 1.249718585136789
Energy: 1.2012862092115928
Energy: 1.2316436512987183
Energy: 1.234040169201359
Energy: 1.2317880182796137
Energy: 1.2316199111379242
Energy: 1.2395678286031522
Energy: 1.2858267960181335
Energy: 1.1880407538415054
Energy: 1.1646063186827353
Energy: 1.2917802477002875
Energy: 1.2224142324176053
Energy: 1.1647544675141142
Energy: 1.2301687359063773
Energy: 1.1904214192377809
Energy: 1.1924008341881618
Energy: 1.2321963293641316
Energy: 1.2396629317461214
Energy: 1.1943546133137402
Energy: 1.164394493714517
Energy: 1.2410790021246139
Energy: 1.1556935605179843
Energy: 1.195585772285829
Energy: 1.227029296572984
Energy: 1.1842743716339854
Energy: 1.1943389783820009
Energy: 1.2026283835747265
Energy: 1.2209129503765663
Energy: 1.1560879566326772
Energy: 1.1742914384894083
Energy: 1.1381603338790645
Energy: 1.1970367308524468
Energy: 1.1737802594723827
Energy: 1.1823099644953823
Energy: 1.168271113627789
Energy: 1.1553860371221716
Energy: 1.155735982523043
Energy: 1.2254245849601957
Energy: 1.1723309082464985
Energy: 1.155047475599046
Energy: 1.238681561482741
Energy: 1.153809228628621
Energy: 1.1665962676564732
Energy: 1.1551659007711945
Energy: 1.251700802788416
Energy: 1.1779632628977514
Energy: 1.1551188845659879
Energy: 1.2519448046340884
Energy: 1.1786627857308254
Energy: 1.1136630057572923
Energy: 1.1098160607917615
Energy: 1.2406809730835806
Energy: 1.1517762800155464
Energy: 1.110465890478127
Energy: 1.241230635634143
Energy: 1.1514778188393426
Energy: 1.18951778910941
Energy: 1.1944382749812994
Energy: 1.2180124728790525
Energy: 1.1714623349904578
Energy: 1.1947299557396867
Energy: 1.2179687544779478
Energy: 1.1714216316611636
Energy: 1.1777430071631942
Energy: 1.1881856680661733
Energy: 1.1871033300179332
Energy: 1.1718051235196927
Energy: 1.1865139632704431
Energy: 1.1884675993297737
Energy: 1.1716958578238483
Energy: 1.155532776899728
Energy: 1.1120715001974903
Energy: 1.1098751412020802
Energy: 1.1515386178404565
Energy: 1.2406917919672418
Energy: 1.1098567004068294
Energy: 1.1623306645140872
Energy: 1.1788371335891765
Energy: 1.1101729657575274
Energy: 1.1523716879276147
Energy: 1.1518366809182508
Energy: 1.2314848529740359
Energy: 1.1510574996483576
Energy: 1.1518271962782693
Energy: 1.1812778193902258
Energy: 1.2372011306573085
Energy: 1.155100707971522
Energy: 1.1770603257125967
Energy: 1.2421951602774455
Energy: 1.1549631708041108
Energy: 1.1729292148968846
Energy: 1.2139541315114408
Energy: 1.1753464067298383
Energy: 1.1735915186613621
Energy: 1.2216595072393082
Energy: 1.1821023120276726
Energy: 1.1812954791128978
Energy: 1.165283219273747
Energy: 1.2368652297621023
Energy: 1.1956066902677431
Energy: 1.173761092492879
Energy: 1.2205428396895492
Energy: 1.2159935058254843
Energy: 1.173963593845063
Energy: 1.1657068387844938
Energy: 1.2389391232131213
Energy: 1.2237699331523881
Energy: 1.194956808861839
Energy: 1.2342965619449555
Energy: 1.2316132193820082
Energy: 1.1949290552623184
Energy: 1.2355221219392967
Energy: 1.260982394019649
Energy: 1.1647029944081466
Energy: 1.239993394774075
Energy: 1.2391617330429983
Energy: 1.164740776188081
Energy: 1.1926446493534018
Energy: 1.2227041562735446
Energy: 1.2324447303649368
Energy: 1.2315016685538704
Energy: 1.2241853413469146
Energy: 1.230379215600819
Energy: 1.2325231823089804
Energy: 1.2016639460440832
Energy: 1.284270248065277
Energy: 1.2392313606430283
Energy: 1.2248591772766246
Energy: 1.2322216534736443
Energy: 1.3032421143519834
Energy: 1.2318682969797412
Energy: 1.224872749683096
Energy: 1.3039010631184809
Energy: 1.3284414937555147
Energy: 1.1879480106984837
Energy: 1.2774273039657131
Energy: 1.2784411880867907
Energy: 1.2225298928166872
Energy: 1.2318914353169932
Energy: 1.2776711561108043
Energy: 1.3342179588362106
Energy: 1.1880391176946496
Energy: 1.2774577417514517
Energy: 1.2784499179117357
Energy: 1.2227381442164909
Energy: 1.1646446277653506
Energy: 1.2778973846690105
Energy: 1.26023649173825
Energy: 1.224267678511958
Energy: 1.2327564018132642
Energy: 1.302932698011242
Energy: 1.2325582210590729
Energy: 1.2312034383474888
Energy: 1.3037635412808481
Energy: 1.353238982076034
Energy: 1.2582457073691902
Energy: 1.2244493517334694
Energy: 1.2782592347062418
Energy: 1.2783431985501004
Energy: 1.2031057018434117
Energy: 1.304715230879993

minimum gb energy = 1.1098160607917615 eV
minimum distance =  2.2936104773409 Angstroms
sigma value = 113


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

Energy: 1.7575600356381298
Energy: 1.0890994532386358
Energy: 1.1100085780654272
Energy: 1.2206642302214679
Energy: 1.220709542549883
Energy: 1.1216752062107218
Energy: 1.0226941096280726
Energy: 1.2065521269810124
Energy: 1.054032630675274
Energy: 1.0910746360829398
Energy: 1.0655748759651544
Energy: 1.0847685748730156
Energy: 1.0567039205027553
Energy: 1.0840836212483156
Energy: 1.092151272060659
Energy: 1.058752215060528
Energy: 1.1188977494755297
Energy: 1.0838598936851143
Energy: 1.0851181117679733
Energy: 1.0873552178042651
Energy: 1.0882911387829357
Energy: 1.0351539717127725
Energy: 1.0695146348088855
Energy: 1.0586963586020548
Energy: 1.042982822190216
Energy: 1.0386592303287838
Energy: 1.0585492258550548
Energy: 1.0861803756490687
Energy: 0.9952507511831622
Energy: 1.0700137804818017
Energy: 1.1165928932428368
Energy: 1.0670530605799327
Energy: 1.0436395564485892
Energy: 1.0584187300387298
Energy: 1.0910758306397934
Energy: 1.0535924464055701
Energy: 1.0519286007424096
Energy: 1.0790936539435383
Energy: 1.0588396872041133
Energy: 1.046987645744147
Energy: 1.0516739973323106
Energy: 1.0798721918208425
Energy: 1.0489258716033174
Energy: 1.1658521446579402
Energy: 1.0414455750652016
Energy: 1.0492275031284464
Energy: 1.0464210466333717
Energy: 1.0524536514890117
Energy: 1.0468765670502698
Energy: 1.0488232795937642
Energy: 1.1513688317062098
Energy: 1.0901376337459887
Energy: 1.0068780556206023
Energy: 1.0316198274228594
Energy: 1.0733264004924716
Energy: 1.0147335620578783
Energy: 1.0422592378704396
Energy: 1.04463506340852
Energy: 1.052078466228129
Energy: 1.0382517054526887
Energy: 1.0395101362680677
Energy: 1.0495508233896447
Energy: 1.0114781204130445
Energy: 0.9920203288292103
Energy: 1.013905450657874
Energy: 1.0060215545588769
Energy: 1.02710402155027
Energy: 1.0172982047844195
Energy: 1.0589500784644932
Energy: 1.0028191509364015
Energy: 1.024561208045659
Energy: 1.0562099543881116
Energy: 0.9907274271735812
Energy: 1.0198151111922813
Energy: 1.01888056321862
Energy: 0.9915159701089354
Energy: 1.0158827356025155
Energy: 1.0271547753763437
Energy: 1.0211867747671306
Energy: 0.9931542691337174
Energy: 1.018301445583497
Energy: 1.0398497886739202
Energy: 0.9944146835057778
Energy: 1.017326737418869
Energy: 1.0124473828562572
Energy: 1.0284756183966306
Energy: 0.971918759174721
Energy: 0.9942580743319273
Energy: 1.0507146100880718
Energy: 0.973631895102342
Energy: 0.9842834436563261
Energy: 1.01328137091962
Energy: 0.9854254348512378
Energy: 0.9703719369382507
Energy: 0.9924343628412121
Energy: 1.0194705856047328
Energy: 0.9588893733235052
Energy: 0.9856014141824903
Energy: 1.0039934577947505
Energy: 0.999198572182874
Energy: 0.9963316338291442
Energy: 1.015140756832075
Energy: 0.9970828985418609
Energy: 0.999660338222243
Energy: 1.01256505653014
Energy: 0.9773142539416809
Energy: 0.9778486272141919
Energy: 0.9899904962135978
Energy: 0.9968381249616248
Energy: 0.9702274119955728
Energy: 0.9923858859712936
Energy: 0.9969817422478697
Energy: 0.9743203474289498
Energy: 0.9696743895826456
Energy: 0.9904625118802597
Energy: 0.9940311181161223
Energy: 0.9703692486668135
Energy: 0.9726335679513242
Energy: 0.9858997803985412
Energy: 0.9789213022655093
Energy: 0.9716371069514432
Energy: 1.0097590641487624
Energy: 0.9951387315897867
Energy: 0.9755392667344339
Energy: 1.0096128870532728
Energy: 0.9952919354274022
Energy: 0.9755898076230946
Energy: 0.9713625251708111
Energy: 1.0143249427203753
Energy: 0.9926861904040327
Energy: 0.9736065928053617
Energy: 1.024270363534919
Energy: 0.9950329931259776
Energy: 0.9585148234979903
Energy: 0.9522451031311185
Energy: 1.0106771304279065
Energy: 0.971879551886427
Energy: 0.945851222001821
Energy: 1.0109361816012137
Energy: 0.9672668423128209
Energy: 0.9939927737508811
Energy: 0.9888483320595363
Energy: 1.0071646532559604
Energy: 0.9856755435961871
Energy: 0.9833498400481053
Energy: 1.021430577065709
Energy: 0.9833052550290277
Energy: 0.9874635957099323
Energy: 0.9860278600421791
Energy: 0.9850464025035429
Energy: 0.9848597467535979
Energy: 1.0154186719792768
Energy: 0.9869082755673129
Energy: 0.9845431044917642
Energy: 0.9745224698168624
Energy: 0.9698882724006233
Energy: 0.9445225749584818
Energy: 0.9732370916400629
Energy: 1.0085853020400457
Energy: 0.9465559182402286
Energy: 0.9714144747176767
Energy: 1.002182994346852
Energy: 1.0183080171044179
Energy: 0.9719420802692795
Energy: 0.9913856040777782
Energy: 1.022483895958042
Energy: 0.9744125886215614
Energy: 0.9963358635436352
Energy: 1.0143065656674888
Energy: 1.0141996309231514
Energy: 0.973263834281605
Energy: 0.9913210553787438
Energy: 1.0125424681942345
Energy: 0.992068445593839
Energy: 0.9930037040369419
Energy: 0.9934445364825081
Energy: 0.9746061613709871
Energy: 0.9699832313798242
Energy: 0.9935280563413874
Energy: 0.9893465684288497
Energy: 0.9704993777487375
Energy: 0.9755133521621067
Energy: 0.995420416709216
Energy: 0.9770744304661856
Energy: 0.9724978347081804
Energy: 0.9969366854740346
Energy: 0.9902596443368218
Energy: 0.9783795802727561
Energy: 0.9891505974987943
Energy: 1.005386873819362
Energy: 0.9941342133940282
Energy: 0.9946394669676002
Energy: 1.0132306029337268
Energy: 0.9994626838689266
Energy: 0.9989556018163037
Energy: 1.0081395253479146
Energy: 0.9810163932049393
Energy: 0.9715671141970348
Energy: 1.0304868818663744
Energy: 0.9924419779310668
Energy: 0.9701835647689737
Energy: 1.0351480575647873
Energy: 0.9925645994017979
Energy: 0.9846451827871022
Energy: 0.9760562707637094
Energy: 1.0206431460412388
Energy: 0.9925510674715017
Energy: 0.9713703113910281
Energy: 1.0518136440822794
Energy: 0.9963645036791879
Energy: 1.0207251636631398
Energy: 0.993853223545194
Energy: 1.0416468817925952
Energy: 1.0170232831544919
Energy: 0.9936895896021123
Energy: 1.0302814457903915
Energy: 1.0174320831558195
Energy: 1.0235406444186708
Energy: 1.0039002060873736
Energy: 1.020552903861535
Energy: 1.0159109396104955
Energy: 0.9926476621939463
Energy: 1.027776913638113
Energy: 1.0204427277276704
Energy: 1.016357022896848
Energy: 1.0281589964072047
Energy: 1.0145682663114928
Energy: 1.0319910897898334
Energy: 1.059976252910838
Energy: 1.01520288200553
Energy: 1.0464148324740954
Energy: 1.0185681683764183
Energy: 1.0413687269391618
Energy: 1.0323689877678242
Energy: 1.040588480362965
Energy: 1.06003643237195
Energy: 1.0325450322219862
Energy: 1.040326638844502
Energy: 1.0604191079930905
Energy: 1.073277505540544
Energy: 1.0309471092809384
Energy: 1.0136365343729037
Energy: 1.0539306128268768
Energy: 1.0319907009304046
Energy: 1.0466051243771215
Energy: 1.0270442079719917
Energy: 1.0525355036980037
Energy: 1.0463967611518075
Energy: 1.0097798632543038
Energy: 1.0776906933484818
Energy: 1.0465274208413957
Energy: 1.0464195421787301
Energy: 1.1035154880442621
Energy: 1.0537345513061374
Energy: 1.031363660184192
Energy: 1.0772472545805596
Energy: 1.0763428561442125
Energy: 1.047862793859286
Energy: 1.0545719080599247
Energy: 1.1454581957347327
Energy: 1.0579964676975206
Energy: 1.0704076922440304
Energy: 1.0777536362971394
Energy: 1.0585351688245537
Energy: 1.0618355302179256
Energy: 1.0508432220975918
Energy: 1.1456884354617125
Energy: 1.1784363791570607
Energy: 1.0246436424678134
Energy: 1.0682587720590482
Energy: 1.059137574711127
Energy: 1.03937655854624
Energy: 1.042750570745907
Energy: 1.1482828088410018
Energy: 1.0880249515351545
Energy: 1.0855127138720384
Energy: 1.0656355542684726
Energy: 1.121912776877782
Energy: 1.0587352757914739
Energy: 1.0841318687064785
Energy: 1.087396117239631
Energy: 1.0724461359965238
Energy: 1.1001463029171243
Energy: 1.0671050751702824
Energy: 1.085256480216465
Energy: 1.0911519215366567
Energy: 1.1488185837903602
Energy: 1.0193204788046986
Energy: 1.0974261802901555
Energy: 1.0756587110436708
Energy: 1.0219616738635786
Energy: 1.0393995196735417
Energy: 1.0751050105869264
Energy: 1.096902971664046
Energy: 1.092772135495842
Energy: 1.0569292332135642
Energy: 1.080571957589146
Energy: 1.0672026910562082
Energy: 1.0808452815394356
Energy: 1.0859136529428064
Energy: 1.0869470376749257
Energy: 1.1505049673070638
Energy: 1.086613472662243
Energy: 1.0822937139941793
Energy: 1.06573805090422
Energy: 1.083924708586007
Energy: 1.083014657932669
Energy: 1.0842170301779512
Energy: 1.2045224022518086
Energy: 1.0232621270023838
Energy: 1.038602826916878
Energy: 1.076231923169398
Energy: 1.0761869439394551
Energy: 1.0392075710901538
Energy: 1.0240329822696366

minimum gb energy = 0.9445225749584818 eV
minimum distance =  2.28705567917243 Angstroms
sigma value = 365


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

Energy: 1.2810903386816244
Energy: 1.190504102475366
Energy: 1.2912124442442519
Energy: 1.2885337286238798
Energy: 1.288098806429053
Energy: 1.2899308341254054
Energy: 1.2420636835688175
Energy: 1.2081975873444672
Energy: 0.3805692541401689
Energy: 0.37994361849970343
Energy: 0.37930703178051917
Energy: 0.37931530040101485
Energy: 0.379402799601178
Energy: 0.38022686651187493
Energy: 0.3961142698414406
Energy: 0.38077624580980546
Energy: 0.38011388969057425
Energy: 0.3795991494065796
Energy: 0.3795385200546638
Energy: 0.37984181792486166
Energy: 0.38015077425236865
Energy: 1.208944016570519
Energy: 1.2326477049012368
Energy: 1.240004494682252
Energy: 1.2422938090662845
Energy: 1.2421522521494772
Energy: 1.2433454600603595
Energy: 1.239376132149338
Energy: 1.207931258083905
Energy: 1.207134167439272
Energy: 1.2318366900304671
Energy: 1.232643919575335
Energy: 1.2395492029023882
Energy: 1.2318062382644608
Energy: 1.232039597241309
Energy: 0.39626951281321204
Energy: 0.3806006260553518
Energy: 0.38029897222243847
Energy: 0.37994662010100805
Energy: 0.37986454186175594
Energy: 0.3797683953672773
Energy: 0.3799729971944093
Energy: 1.20828925063862
Energy: 1.2327676368683902
Energy: 1.2399220435668121
Energy: 1.239562076321431
Energy: 1.2393771158774491
Energy: 1.2393690152629677
Energy: 1.2316300483831324
Energy: 1.208484890247787
Energy: 1.231456771436914
Energy: 1.2399226557773777
Energy: 1.239616092617606
Energy: 1.2394372270619864
Energy: 1.2396554076274136
Energy: 1.231943236677846
Energy: 0.3958772832941786
Energy: 0.3802945289126784
Energy: 0.3798001347172588
Energy: 0.37974428984229225
Energy: 0.37978884839092786
Energy: 0.3799744332959903
Energy: 0.38048855011202537
Energy: 1.2079396203130977
Energy: 1.2317702325290394
Energy: 1.2318766957481015
Energy: 1.2320540803265505
Energy: 1.2322564434414245
Energy: 1.231551466200045
Energy: 1.2313198410932793
Energy: 1.208738375097172
Energy: 1.232314037708277
Energy: 1.2436484278288285
Energy: 1.2419183521846857
Energy: 1.2412909020331466
Energy: 1.243348190878041
Energy: 1.2402228506076765
Energy: 0.3957023832922154
Energy: 0.38047203938697616
Energy: 0.38010091282035074
Energy: 0.3796325223007891
Energy: 0.37957128273832297
Energy: 0.37978533577394524
Energy: 0.38027867860481723
Energy: 0.3963824223762467
Energy: 0.38074016675525657
Energy: 0.380116259601007
Energy: 0.3794835682174769
Energy: 0.3793994120582363
Energy: 0.3797269915880773
Energy: 0.3802070787789191
Energy: 1.2085094515645907
Energy: 1.2314839726132905
Energy: 1.243303555525207
Energy: 1.240258592967479
Energy: 1.2400752896342544
Energy: 1.2413894321644035
Energy: 1.244828874756824
Energy: 1.2079150346125045
Energy: 1.2077361684338843
Energy: 1.2324983214259573
Energy: 0.3793421156633525
Energy: 0.37890553881752026
Energy: 0.3795236228923239
Energy: 1.2319463044029326
Energy: 0.3957924767349186
Energy: 0.38078975377031776
Energy: 0.3802375460839522
Energy: 0.37976026988739464
Energy: 0.37962485483917197
Energy: 0.3798170085346323
Energy: 0.38029311176617314
Energy: 1.2088357742229627
Energy: 1.2319966025510292
Energy: 1.2399730581042205
Energy: 1.239472017168221
Energy: 1.2422669732121028
Energy: 1.240068469688802
Energy: 1.2395592945143497
Energy: 1.2079356018861427
Energy: 1.2314985531416955
Energy: 1.2327724112878713
Energy: 1.2395637242885482
Energy: 1.239305321090531
Energy: 1.2319084765415766
Energy: 1.232610134226996
Energy: 0.395730851663006
Energy: 0.38061593704768587
Energy: 0.38020873941494265
Energy: 0.3797141021173743
Energy: 0.37974205024153046
Energy: 0.37970427485687785
Energy: 0.38006714913052003
Energy: 1.2081809959095093
Energy: 1.2318108215297898
Energy: 1.231809508132166
Energy: 1.2392568986072154
Energy: 1.2393256227541058
Energy: 1.2396117801876207
Energy: 1.232566668521971

minimum gb energy = 0.37890553881752026 eV
minimum distance =  2.36944321220848 Angstroms
sigma value = 23