Model name: model_name=EAM_Dynamo_AngeloMoodyBaskes_1995_NiAlH__MO_418978237058_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050000071525574
cohesive_energy=3.360264249995487
mass=26.981538
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=[1.570104262140588e-19, 2.26679154531588e-19, 2.7780300874589397e-19, 3.18291614463708e-19, 3.5160567321447e-19, 3.7964536648610397e-19, 4.035882941046e-19, 4.24225931327154e-19, 4.42125448682202e-19, 4.57703412094584e-19, 4.71281859067734e-19, 4.831155356864579e-19, 4.93404714030006e-19, 5.02320826998216e-19, 5.10001661781612e-19, 5.16560972921208e-19, 5.22102901898214e-19, 5.26709159720964e-19, 5.3045665086789e-19, 5.33409462404352e-19, 5.356252726891739e-19, 5.37155351374644e-19, 5.3804295722988e-19, 5.38331349024e-19, 5.38023731110272e-19, 5.370367903037279e-19, 5.3525677206335395e-19, 5.325522979051619e-19, 5.2876635451902e-19, 5.23714691592018e-19, 5.171778109252979e-19, 5.08888149020982e-19, 4.98530077082172e-19, 4.8571586836344e-19, 4.69977687287658e-19, 4.50737148089952e-19, 4.27282884344826e-19, 3.98722483667142e-19, 3.6393922894300196e-19, 3.2150878514478e-19, 2.6960627308634996e-19, 2.0585406264285599e-19, 1.271146113119358e-19, 2.91969454543722e-20, -9.275689470178619e-20, -2.4469723295755197e-19, -4.379229393712199e-19, -6.799701721761359e-19, -9.718018395293339e-19, -1.3533922484491139e-18, -1.87986588820488e-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: 0.0 eV

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

Energy: 0.01264522802285287
Energy: 0.2312103703517038
Energy: 0.22781733306121868
Energy: 0.23910217800785624
Energy: 0.241446932654385
Energy: 0.11386943043659133
Energy: 0.013276034994259686
Energy: 0.06543685220337091
Energy: 0.1883609598499928
Energy: 0.09732548270791687
Energy: 0.205118247836763
Energy: 0.19068888514211263
Energy: 0.013510225769304591
Energy: 0.06633452215271955
Energy: 0.012855310255620159
Energy: 0.1888652662671679
Energy: 0.24872775962725951
Energy: 0.20344406160274223
Energy: 0.1889020909355756
Energy: 0.06575014879277198
Energy: 0.0669591168726536
Energy: 0.014235184967800074
Energy: 0.23151036045124687
Energy: 0.20082433222961094
Energy: 0.2403712852052069
Energy: 0.18832140338255987
Energy: 0.06567302000981502
Energy: 0.013210483130653658
Energy: 0.0655660296729392
Energy: 0.19054249450304428
Energy: 0.09682145321062377
Energy: 0.2316546519502697
Energy: 0.19007850909046567
Energy: 0.013879608657631432
Energy: 0.06594063880931354
Energy: 0.01285228218231069
Energy: 0.1904632297840439
Energy: 0.22728263773830637
Energy: 0.18846029391299404
Energy: 0.19028017581906856
Energy: 0.06537257489047014
Energy: 0.06664169551450602

minimum gb energy = 0.01264522802285287 eV
minimum distance =  2.83779406125599 Angstroms
sigma value = 5


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

Energy: 0.3232507845161252
Energy: 0.36162642811190787
Energy: 0.28691778584452676
Energy: 0.32195463369522603
Energy: 0.3471887681640802
Energy: 0.3298822096095033
Energy: 0.34547768190047506
Energy: 0.2721428135450554
Energy: 0.2885008107771275
Energy: 0.29674433296405056
Energy: 0.30892999886104183
Energy: 0.28817593385321255
Energy: 0.2845706332450534
Energy: 0.31780029848487135
Energy: 0.3423957594918924
Energy: 0.3085909127028828
Energy: 0.3317889438576648
Energy: 0.3269584055827282
Energy: 0.32186047333178647
Energy: 0.3192788843294953
Energy: 0.3174473927477181
Energy: 0.2833600085258812
Energy: 0.3182582154754072
Energy: 0.2846771679644309
Energy: 0.307707323072116
Energy: 0.31771119956425925
Energy: 0.28802442051442645
Energy: 0.3355415295156061
Energy: 0.28645591665666836
Energy: 0.35398807400716353
Energy: 0.28551554188075956
Energy: 0.28420317238926945
Energy: 0.3051392299946517
Energy: 0.3017074991573888
Energy: 0.3101906575307382
Energy: 0.2741115937906565
Energy: 0.3249478971222804
Energy: 0.27470488581209557
Energy: 0.28167608336170713
Energy: 0.2836067008913384
Energy: 0.2734125170442831
Energy: 0.3072825170934509
Energy: 0.2879757415980571
Energy: 0.3306522398601019
Energy: 0.2989000250559061
Energy: 0.3115052936132324
Energy: 0.329395792939837
Energy: 0.3039246838769134
Energy: 0.31660916511936765
Energy: 0.29308985041765573
Energy: 0.3184204518447406
Energy: 0.32219748573398466
Energy: 0.3037779498281178
Energy: 0.31827328763715096
Energy: 0.3248658354579866
Energy: 0.3440044971616008
Energy: 0.28839987786447824
Energy: 0.2976558063745436
Energy: 0.29554729798012885
Energy: 0.28441812306796405
Energy: 0.33079475545135995
Energy: 0.31106495635390435
Energy: 0.30085727369287757
Energy: 0.2728651520452782
Energy: 0.3325110958699237
Energy: 0.27982347587844114
Energy: 0.28173248947211377
Energy: 0.3208300696362754
Energy: 0.2942712208454968
Energy: 0.3157145713757575
Energy: 0.2831083968158831
Energy: 0.3098980054042584
Energy: 0.31078796539517933
Energy: 0.34068450985294907
Energy: 0.31086393195338985
Energy: 0.29125686167507964
Energy: 0.31571464847686237
Energy: 0.3248074380806987
Energy: 0.3024161116742328
Energy: 0.31361135363394615
Energy: 0.32409165708281096
Energy: 0.30946386320762126
Energy: 0.30431451774324003
Energy: 0.3003812352167838
Energy: 0.2860953525876575
Energy: 0.3275806970255717
Energy: 0.3068462932510355
Energy: 0.3128815711053298
Energy: 0.30676930799481134
Energy: 0.30535775290771183
Energy: 0.30873103958144366
Energy: 0.2970367822907405
Energy: 0.32964036308463474
Energy: 0.3047329808319097
Energy: 0.3107706027658363
Energy: 0.31837981321973297
Energy: 0.32755562536749194
Energy: 0.3185910207981714
Energy: 0.28630705360059233
Energy: 0.3089714794480313
Energy: 0.27443534731259
Energy: 0.2926408339073973
Energy: 0.3011949269590739
Energy: 0.283472128419012
Energy: 0.32304220090536445
Energy: 0.3113964349792606
Energy: 0.32422826782763375
Energy: 0.3038214847601187
Energy: 0.32107409788276436
Energy: 0.3229383706072939
Energy: 0.30416417654137246
Energy: 0.31044797436563554
Energy: 0.2949851302419914
Energy: 0.31414832544648774
Energy: 0.31721004367135974
Energy: 0.29830306207762236
Energy: 0.3019460338798817
Energy: 0.30872642213681417
Energy: 0.33448438454885515
Energy: 0.3214626545131488
Energy: 0.3161990509716389
Energy: 0.30841252265300645
Energy: 0.3214921765383559
Energy: 0.3372938003077627
Energy: 0.2975983188597426
Energy: 0.3088137409675032
Energy: 0.3078545613271036
Energy: 0.3051165374332315
Energy: 0.2741307085869299
Energy: 0.2820593399513299
Energy: 0.29858600229106974
Energy: 0.27609086353711426
Energy: 0.3029600939388043
Energy: 0.3004763518733324
Energy: 0.3508660743683471
Energy: 0.3114049195090618
Energy: 0.3167073566325382
Energy: 0.30579021272130663
Energy: 0.3243020418221219
Energy: 0.3135226470552823
Energy: 0.27782019909715505
Energy: 0.31957526340387216
Energy: 0.2921106645765436
Energy: 0.30012429762606874
Energy: 0.2940324642802037
Energy: 0.3032568635140613
Energy: 0.33984409453908004
Energy: 0.32696565237197706
Energy: 0.3165221847460959
Energy: 0.34191807778182975
Energy: 0.321267651686186
Energy: 0.3289622177655693
Energy: 0.3266738660278467
Energy: 0.30971668234136046
Energy: 0.2826412981037057
Energy: 0.32157818419840245
Energy: 0.30733255240832663
Energy: 0.29831844642827493
Energy: 0.2774569655581991
Energy: 0.2810398515682162
Energy: 0.31466353885881965
Energy: 0.27866337725964935
Energy: 0.3475275149214911
Energy: 0.2822323948288796
Energy: 0.2894343695492828
Energy: 0.3550812117670782
Energy: 0.3170087379039549
Energy: 0.3456769447873296
Energy: 0.2702595460429247
Energy: 0.2984886870324179
Energy: 0.29592993686911273
Energy: 0.3107376687991386
Energy: 0.29326280677907157
Energy: 0.29289338927509895
Energy: 0.29450174917694455
Energy: 0.30566324282940666
Energy: 0.3206653376550942
Energy: 0.33008876782297136
Energy: 0.32928119401129546
Energy: 0.31569377059069365
Energy: 0.3313716884165391
Energy: 0.31775539814025905
Energy: 0.28667538659643915
Energy: 0.33405989910445344
Energy: 0.2828132326181374
Energy: 0.30876620624348117
Energy: 0.31934832830877374
Energy: 0.2901558254127268
Energy: 0.32603316697876983
Energy: 0.2734106669372313
Energy: 0.31334202020185786
Energy: 0.2748372085474043
Energy: 0.2840573208282429
Energy: 0.29000550540337017
Energy: 0.287588743369477
Energy: 0.31013959202352365
Energy: 0.2813323606030543
Energy: 0.32476669123556695
Energy: 0.27323928573346257
Energy: 0.29129292106735927
Energy: 0.28977464901002026
Energy: 0.2706434824739231
Energy: 0.3152461732731864
Energy: 0.31059126515555163
Energy: 0.3160979829419721
Energy: 0.28974893857970896
Energy: 0.30842779423091105
Energy: 0.3070350238306807
Energy: 0.29768256230742296
Energy: 0.31410214717143964
Energy: 0.30342107389968287
Energy: 0.32627255651992737
Energy: 0.32108769046555363
Energy: 0.3151777385913569
Energy: 0.3102027399869581
Energy: 0.3279281162255806
Energy: 0.34283108422406494
Energy: 0.274258135820441
Energy: 0.3317548245171535
Energy: 0.3001142955499066
Energy: 0.2938034444771571
Energy: 0.3074900342110915
Energy: 0.31022129087194855
Energy: 0.2977064394157247
Energy: 0.2755908697990621
Energy: 0.3526049763067333
Energy: 0.28453876336259254
Energy: 0.3091405132115349
Energy: 0.3039194907233391
Energy: 0.3003063207799212
Energy: 0.3360363663900098
Energy: 0.2805676595599536
Energy: 0.3143763944498102
Energy: 0.3165142516931561
Energy: 0.31642980375446944
Energy: 0.3107205587991231
Energy: 0.2893181390205369
Energy: 0.32976504298591786
Energy: 0.32487317253361586
Energy: 0.31222270467891045
Energy: 0.31535295131410895
Energy: 0.3263856697583343
Energy: 0.3056842573492335
Energy: 0.32437748536197814
Energy: 0.3065798227413765
Energy: 0.28861545913722636
Energy: 0.3142900666327883
Energy: 0.30416299493857823
Energy: 0.32062247241876574
Energy: 0.2963980023620319
Energy: 0.3036756958303255
Energy: 0.3200400156321863
Energy: 0.302147989133258
Energy: 0.3347275464090678
Energy: 0.33676190276482293
Energy: 0.3227348064376971
Energy: 0.31774818999204096
Energy: 0.32393581270444366
Energy: 0.3169162764007434
Energy: 0.28825969606912805
Energy: 0.3105328997001554
Energy: 0.27533261322343344
Energy: 0.28771300722953974
Energy: 0.3120803849877014
Energy: 0.27938009702330124
Energy: 0.3010503002403998
Energy: 0.3142849207798804
Energy: 0.32476803192923154
Energy: 0.3196876645850682
Energy: 0.3220773783964036
Energy: 0.32252057119740546
Energy: 0.31688900934487235
Energy: 0.31255607647302186
Energy: 0.29223304425005375
Energy: 0.3196476761694592
Energy: 0.29833042291050843
Energy: 0.29812248466838326
Energy: 0.30180157231496163
Energy: 0.3085586986869355
Energy: 0.35839881585127775
Energy: 0.3253324640330603
Energy: 0.3212242577587127
Energy: 0.29977248750534957
Energy: 0.32184292761361644
Energy: 0.32897798343803614
Energy: 0.31251153665804143
Energy: 0.3090261503668998
Energy: 0.3091340596051553
Energy: 0.31828152778581037
Energy: 0.27344880890603646
Energy: 0.2897137809840605
Energy: 0.29658660251685554
Energy: 0.2777302312252397
Energy: 0.298415909077747
Energy: 0.3117271367913963
Energy: 0.3554286296339732
Energy: 0.32788950637289893
Energy: 0.311153704250195
Energy: 0.30706208841318355
Energy: 0.323110110942757
Energy: 0.3169835571683346
Energy: 0.2738447499268067
Energy: 0.3209961964235759
Energy: 0.28870533273764243
Energy: 0.30278264061361465
Energy: 0.31270522522237215
Energy: 0.3013167059940492
Energy: 0.3279610726481614
Energy: 0.3254923824135922
Energy: 0.31073053012699636
Energy: 0.3132719732369718
Energy: 0.3253001724357025
Energy: 0.3248175708622446
Energy: 0.3152066457686037
Energy: 0.3235998223004107
Energy: 0.2835175545124097
Energy: 0.32499835902976953
Energy: 0.30908359074072267
Energy: 0.3075329581867598
Energy: 0.30552807965542195
Energy: 0.2879282557819086
Energy: 0.3129365523739885
Energy: 0.27778754764618213
Energy: 0.3479483973852766
Energy: 0.27727808468316195
Energy: 0.2945626040980048
Energy: 0.3058590455374196
Energy: 0.31569564733472444
Energy: 0.34411381323749857

minimum gb energy = 0.2702595460429247 eV
minimum distance =  2.53498219067034 Angstroms
sigma value = 401


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

Energy: 0.2866885856481235
Energy: 0.3504248970686323
Energy: 0.27288161075604556
Energy: 0.28889576965059105
Energy: 0.32082292843868393
Energy: 0.27705143662575316
Energy: 0.2945590611565113
Energy: 0.26746643995460617
Energy: 0.2860731884673031
Energy: 0.3203857165759664
Energy: 0.3296586995928599
Energy: 0.27908176906077947
Energy: 0.2982153156067535
Energy: 0.2774381274787252
Energy: 0.3071592965904025
Energy: 0.31194375874352204
Energy: 0.3424857048650913
Energy: 0.2758479628753592
Energy: 0.29899483542316646
Energy: 0.2919008436370598
Energy: 0.31322817234861483
Energy: 0.29846324690821086
Energy: 0.2845513824897895
Energy: 0.2787153472097008
Energy: 0.2730051717458692
Energy: 0.29494402442249
Energy: 0.31317713630299643
Energy: 0.3258483412786571
Energy: 0.2721695276799225
Energy: 0.27695648184477756
Energy: 0.27114104581539883
Energy: 0.2670941406878235
Energy: 0.2752066192101117
Energy: 0.3394616635626694
Energy: 0.2994405391836161
Energy: 0.29368918499996005
Energy: 0.3134278375297719
Energy: 0.2650495418172676
Energy: 0.26474517162291733
Energy: 0.27593596036056833
Energy: 0.2766425283716431
Energy: 0.3008979946305397
Energy: 0.28187403990004317
Energy: 0.3040850965672795
Energy: 0.30355284288365064
Energy: 0.28525347664527123
Energy: 0.26715849668481734
Energy: 0.3264892195027457
Energy: 0.308238958775395
Energy: 0.27864028497103077
Energy: 0.3051969872433983
Energy: 0.2664692536466569
Energy: 0.3065838738594955
Energy: 0.28965259891615563
Energy: 0.2994958547039649
Energy: 0.32202841236999863
Energy: 0.26381880417858944
Energy: 0.3003261407931995
Energy: 0.3089147640626257
Energy: 0.3093038209101925
Energy: 0.35975047787923964
Energy: 0.3043223486787366
Energy: 0.27687123382380663
Energy: 0.26849418232663574
Energy: 0.2718469494713709
Energy: 0.29562208888665686
Energy: 0.29316633691935834
Energy: 0.3137126730532067
Energy: 0.2661832449396455
Energy: 0.27514910528050684
Energy: 0.2764582606232192
Energy: 0.27724542870330376
Energy: 0.27654783393648613
Energy: 0.34456029426237345
Energy: 0.33322879034950015
Energy: 0.2810987878992941
Energy: 0.2736314070470776
Energy: 0.26297796872573187
Energy: 0.2858333335882089
Energy: 0.3222631052433676
Energy: 0.3000035376163888
Energy: 0.2867809935054204
Energy: 0.3087885864596775
Energy: 0.2700358770981253
Energy: 0.3037071412999796
Energy: 0.31592042966243206
Energy: 0.29414268776444424
Energy: 0.2983207411599067
Energy: 0.2954053002037745
Energy: 0.28506367287611895
Energy: 0.30896377715467693
Energy: 0.2952953649823294
Energy: 0.30280661806269354
Energy: 0.3084041766322076
Energy: 0.26412619907456797
Energy: 0.2962130580866179
Energy: 0.30136744755298334
Energy: 0.2678811557421941
Energy: 0.27419123334937723
Energy: 0.26792007849324434
Energy: 0.26569175598316624
Energy: 0.27022182355839797
Energy: 0.28401666609347925
Energy: 0.30464821198709213
Energy: 0.29545698148578703
Energy: 0.27662688209694763
Energy: 0.2676570531805601
Energy: 0.2665139893727433
Energy: 0.26682270805193614
Energy: 0.2766117097104429
Energy: 0.2784942628631592
Energy: 0.30257593656316206
Energy: 0.2962191999993827
Energy: 0.3027005906011132
Energy: 0.3092066085130326
Energy: 0.28284809701372193
Energy: 0.26378023490275104
Energy: 0.31665100676859925
Energy: 0.3142875014849559
Energy: 0.2754712729673367
Energy: 0.29557935415557685
Energy: 0.2654165372229118
Energy: 0.30617253412051804
Energy: 0.2929575286312514
Energy: 0.30728947543165525
Energy: 0.34386193046138486
Energy: 0.26247837447277717
Energy: 0.2871178154325436
Energy: 0.3239567355731837
Energy: 0.28663105114306814
Energy: 0.2903659679115158
Energy: 0.2927386544444686
Energy: 0.2810492601452119
Energy: 0.27726628856292507
Energy: 0.272516505858282
Energy: 0.30290787448299034
Energy: 0.3071970777871944
Energy: 0.3164976727896487
Energy: 0.27268211733269376
Energy: 0.28228211615582244
Energy: 0.2683930852167552
Energy: 0.3125258533130287
Energy: 0.2872972136253142
Energy: 0.29344130958450765
Energy: 0.3044307830806599
Energy: 0.27664501465237307
Energy: 0.30707357267915103
Energy: 0.2637555110562918
Energy: 0.2837080599193448
Energy: 0.28816885837164136
Energy: 0.3001162774549783
Energy: 0.30777113392053174
Energy: 0.30866767961943503
Energy: 0.3224628755620311
Energy: 0.30572797001478813
Energy: 0.2864538692346699
Energy: 0.29236563348888933
Energy: 0.33251390706423034
Energy: 0.3056305101776369
Energy: 0.30039793852924374
Energy: 0.2888848895590422
Energy: 0.3089142866501693
Energy: 0.3027460610821134
Energy: 0.30963065003732665
Energy: 0.2849062868579769
Energy: 0.2987954399394139
Energy: 0.30312994032005663
Energy: 0.3087126944364075
Energy: 0.27577143349660715
Energy: 0.28647928777860376
Energy: 0.2646807187322573
Energy: 0.27526721441120977
Energy: 0.306670581951547
Energy: 0.3047018679250134
Energy: 0.3013602248606818
Energy: 0.2736940422340672
Energy: 0.2911109019620895
Energy: 0.27114327177062925
Energy: 0.2753238798196973
Energy: 0.27212253040519263
Energy: 0.27574501640699023
Energy: 0.29609762646230603
Energy: 0.2929415454426566
Energy: 0.2771731172653085
Energy: 0.27883201294852683
Energy: 0.26727924473243
Energy: 0.26265587110701816
Energy: 0.27356545233612745
Energy: 0.31719097703299826
Energy: 0.2988800124933741
Energy: 0.2873449917254565
Energy: 0.2972559092111143
Energy: 0.27341159797324394
Energy: 0.30742362615276014
Energy: 0.34986585984388413
Energy: 0.31710952472044357
Energy: 0.2633052124200596
Energy: 0.288455087501722
Energy: 0.30801850803937564
Energy: 0.31244709252124264
Energy: 0.29884713261297435
Energy: 0.29689092569169034
Energy: 0.27069337746069
Energy: 0.27793318059481226
Energy: 0.2870740572195089
Energy: 0.3035792932870131
Energy: 0.2637979235662783
Energy: 0.31233197548753056
Energy: 0.2743836874323686
Energy: 0.28117815601395657
Energy: 0.2638843317548526
Energy: 0.28385737401229416
Energy: 0.2738238053128675
Energy: 0.30394126226880847
Energy: 0.2945170002836081
Energy: 0.27654852360693316
Energy: 0.3168990231343073
Energy: 0.26798557435529125
Energy: 0.26489681432262624
Energy: 0.2941008069183341
Energy: 0.27200190129103335
Energy: 0.31328162979984775
Energy: 0.3108522699654245
Energy: 0.31205412496768553
Energy: 0.2776430782871509
Energy: 0.2769743203335517
Energy: 0.29444535694431734
Energy: 0.3325930988569744
Energy: 0.3053362980788879
Energy: 0.2989455502993221
Energy: 0.2858447053638001
Energy: 0.3074781197918024
Energy: 0.32136443418943444
Energy: 0.30675412843653277
Energy: 0.28879923965998416
Energy: 0.3034845391523897
Energy: 0.3005748133527039
Energy: 0.3167137469529736
Energy: 0.2775758706081833
Energy: 0.28681530274129025
Energy: 0.26495052290730825
Energy: 0.2684833791170078
Energy: 0.2939478412439016
Energy: 0.284531558118174
Energy: 0.3282756856655774
Energy: 0.27307762668135654
Energy: 0.29260066320353184
Energy: 0.2726676377247112
Energy: 0.28896677137276044
Energy: 0.27475765822114007
Energy: 0.35139341962501386
Energy: 0.29358049661975616
Energy: 0.2917831133184895
Energy: 0.29581749695908355
Energy: 0.2703862166995841
Energy: 0.2658554352773888
Energy: 0.2635066438758672
Energy: 0.2817986405342735
Energy: 0.3153601206808424
Energy: 0.302845871993117
Energy: 0.2646228951232007
Energy: 0.2985489768494712
Energy: 0.28346181934433756
Energy: 0.27422793978537513
Energy: 0.3282975332766867
Energy: 0.31071677110976353
Energy: 0.275827319809928
Energy: 0.3230138717246116
Energy: 0.2821926145727679
Energy: 0.3034628086444513
Energy: 0.3088625083189284
Energy: 0.3015578884496307
Energy: 0.2983833799699411
Energy: 0.30614225850040816
Energy: 0.31639530074212496
Energy: 0.30141374098692386
Energy: 0.2818998869249082
Energy: 0.3270594064765131
Energy: 0.2666535437100817
Energy: 0.2774958966769268
Energy: 0.2629762284350464
Energy: 0.2865781465639728
Energy: 0.30070531346633705
Energy: 0.3027293650863018
Energy: 0.3271520025191936
Energy: 0.2730141736147758
Energy: 0.26742572586171626

minimum gb energy = 0.26247837447277717 eV
minimum distance =  2.58085343798305 Angstroms
sigma value = 311


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

Energy: 0.2712289154558064
Energy: 0.3003605757108782
Energy: 0.27479078404181395
Energy: 0.3115726783141581
Energy: 0.2817484829571062
Energy: 0.28870232952893216
Energy: 0.2796083679208231
Energy: 0.2686904232169566
Energy: 0.3115071552582696
Energy: 0.28561428106903053
Energy: 0.3074027900477953
Energy: 0.28190870178293786
Energy: 0.2726058419951565
Energy: 0.31042452105567214
Energy: 0.27292821775261833
Energy: 0.3043161108208239
Energy: 0.2981727506211427
Energy: 0.2874771711560464
Energy: 0.28395374916947247
Energy: 0.2793048714433003
Energy: 0.28926798896352784
Energy: 0.2774267823479634
Energy: 0.30715417732550787
Energy: 0.27766932215209433
Energy: 0.30534021860171995
Energy: 0.30821089862884227
Energy: 0.27141520489908166
Energy: 0.29762492541342633
Energy: 0.28142346055611117
Energy: 0.30005116062559195
Energy: 0.29005170439978467
Energy: 0.27454329860178733
Energy: 0.2781441752373708
Energy: 0.27168019791474035
Energy: 0.2919278349187588
Energy: 0.275152972316744
Energy: 0.28460788181520247
Energy: 0.27330047850345546
Energy: 0.3089821367887143
Energy: 0.2800026160453555
Energy: 0.27687680891886185
Energy: 0.2858537494952169
Energy: 0.2754940924709887
Energy: 0.3000146330525346
Energy: 0.28020832911182686
Energy: 0.3027258233253686
Energy: 0.27830776972281696
Energy: 0.29481303020294697
Energy: 0.3244979103514999
Energy: 0.2855936620794329
Energy: 0.3071325795911274
Energy: 0.28271826548121837
Energy: 0.306976947227479
Energy: 0.28451871686864155
Energy: 0.29974227553230504
Energy: 0.29836344064754744
Energy: 0.294347610076365
Energy: 0.3195051316029126
Energy: 0.30059456267742396
Energy: 0.2756408776967434
Energy: 0.2888984127250388
Energy: 0.29234233320132524
Energy: 0.28756519152573184
Energy: 0.2784311139070639
Energy: 0.30546172637662045
Energy: 0.2757273582324433
Energy: 0.3044387012127024
Energy: 0.30207877007700246
Energy: 0.2746750945101011
Energy: 0.30164189806661584
Energy: 0.27898248987052826
Energy: 0.28383685052275054
Energy: 0.28092617573292356
Energy: 0.3032879965757143
Energy: 0.2825100666260269
Energy: 0.27531505492807856
Energy: 0.30276622603635067
Energy: 0.2763225977977767
Energy: 0.2992882266027154
Energy: 0.2756278312684663
Energy: 0.2949543688371984
Energy: 0.28680669277617854
Energy: 0.2704763572386771
Energy: 0.2969389133792199
Energy: 0.29216387815029515
Energy: 0.30545862797800005
Energy: 0.27309450962515686
Energy: 0.2907608640579681
Energy: 0.2946793342319637
Energy: 0.2876334843219306
Energy: 0.30609496612306764
Energy: 0.2687996861797875
Energy: 0.30191917109281535
Energy: 0.28559528403997086
Energy: 0.30205711701724863
Energy: 0.28224255854488156
Energy: 0.29665316626875526
Energy: 0.29989841371178944
Energy: 0.29422045033882915
Energy: 0.3139629297763694
Energy: 0.2861793066031636
Energy: 0.3069527219587513
Energy: 0.295037979980338
Energy: 0.28595884769007773
Energy: 0.29750448791435785
Energy: 0.27332392948735573
Energy: 0.30579568916574046
Energy: 0.29220935982669144
Energy: 0.2928879354324909
Energy: 0.30089396618998676
Energy: 0.2924346508188827
Energy: 0.30786695321505764
Energy: 0.2792859508616122
Energy: 0.28121360168354703
Energy: 0.27592712792154267
Energy: 0.28223070495578945
Energy: 0.2750401143552079
Energy: 0.2752703300818096
Energy: 0.30231790153612303
Energy: 0.26421739590233845
Energy: 0.29233288996493884
Energy: 0.2858155761075163
Energy: 0.28151210834502555
Energy: 0.2889790541005598
Energy: 0.2754198439781084
Energy: 0.2972122152437193
Energy: 0.27023179555894694
Energy: 0.30312639478077313
Energy: 0.27251576880009337
Energy: 0.2951243954442771
Energy: 0.30042176680788074
Energy: 0.2886062092553634
Energy: 0.31525612049713436
Energy: 0.29289589143233946
Energy: 0.30946538095177134
Energy: 0.2794758519282186
Energy: 0.3134230047884256
Energy: 0.27992452447124944
Energy: 0.3017897738772296
Energy: 0.3033304718649116
Energy: 0.28357660706150767
Energy: 0.3118595585665344
Energy: 0.2972277236834453
Energy: 0.300117451458911
Energy: 0.28199575602920113
Energy: 0.29343988291852136
Energy: 0.29705017272090617
Energy: 0.27395498306299393
Energy: 0.2882869590312
Energy: 0.27731165145054076
Energy: 0.2913116082886694
Energy: 0.2948683336933615
Energy: 0.28005835164342685
Energy: 0.30212677634528273
Energy: 0.2814047102500809
Energy: 0.2811043301212341
Energy: 0.2716153323127917
Energy: 0.3061145200157805
Energy: 0.284102142387574
Energy: 0.2827273968734212
Energy: 0.29349791195748254
Energy: 0.2864349915414221
Energy: 0.30343177682045364
Energy: 0.27406997892713486
Energy: 0.2874646521935974
Energy: 0.2829802233973189
Energy: 0.2887847648811738
Energy: 0.291186538423586
Energy: 0.27336975799602803
Energy: 0.29874904774244243
Energy: 0.2773278035782925
Energy: 0.30424846225223107
Energy: 0.290164125741163
Energy: 0.2759287395142555
Energy: 0.31181005545668466
Energy: 0.2907356800020985
Energy: 0.3138169838934682
Energy: 0.2765980763395877
Energy: 0.3074227479364235
Energy: 0.283037068022089
Energy: 0.2915204757710469
Energy: 0.2881043937195207
Energy: 0.2723099263891619
Energy: 0.304414699520085
Energy: 0.2823996830650559
Energy: 0.29936846358218033
Energy: 0.3061456630351405
Energy: 0.27356006250453796
Energy: 0.31130057589520116
Energy: 0.2772006874891363
Energy: 0.29435000900389263
Energy: 0.2803595996791903
Energy: 0.28820209630973265
Energy: 0.29354486082211984
Energy: 0.2668690341523011
Energy: 0.30182322440364406
Energy: 0.28070622468449274
Energy: 0.29412738647416853
Energy: 0.27094947786958895
Energy: 0.2752689802958329
Energy: 0.277655536015791
Energy: 0.28067339746602155
Energy: 0.3052037580700122
Energy: 0.2840718644566359
Energy: 0.31508971595537455
Energy: 0.26952983247302575
Energy: 0.2982987909640676
Energy: 0.28718107158551726
Energy: 0.27678640234850366
Energy: 0.29420913442658636
Energy: 0.2794569472765144
Energy: 0.3230793389801856
Energy: 0.2849027947695763
Energy: 0.2750050267952636
Energy: 0.2862350087457279
Energy: 0.271475378612085
Energy: 0.2915424951700512
Energy: 0.27444997039048447
Energy: 0.31063260964495465
Energy: 0.28475452070233637
Energy: 0.32518788350291694
Energy: 0.28467433887648635
Energy: 0.2967582564473289
Energy: 0.2959129503590769
Energy: 0.26941943262319284
Energy: 0.2989971686614257
Energy: 0.29599187064841015
Energy: 0.3056750539007682
Energy: 0.3090083254795724
Energy: 0.29138100518408694
Energy: 0.2974863889744665
Energy: 0.2804772268776793
Energy: 0.3030213756722667
Energy: 0.27587949851307686
Energy: 0.30253023781817673
Energy: 0.2901482211502246
Energy: 0.27182341549674843
Energy: 0.29882336739526183
Energy: 0.2804651088631655
Energy: 0.2978644350482376
Energy: 0.27530039055086253
Energy: 0.27060257869398724
Energy: 0.27334659112836224
Energy: 0.2808221592735406
Energy: 0.30805897468098875
Energy: 0.2810709863492473
Energy: 0.3111919956999415
Energy: 0.27605547329265323
Energy: 0.3028019786425992
Energy: 0.2935584627131512
Energy: 0.281541077403733
Energy: 0.2877613500173682

minimum gb energy = 0.26421739590233845 eV
minimum distance =  2.57060601246728 Angstroms
sigma value = 39


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

Energy: 0.2676692206856434
Energy: 0.304947957356888
Energy: 0.33736210450766224
Energy: 0.3127834427454996
Energy: 0.315540088415367
Energy: 0.29766610441440783
Energy: 0.24299489912717873
Energy: 0.2733962605480271
Energy: 0.29248983752281366
Energy: 0.3011483767423286
Energy: 0.30764393547445823
Energy: 0.2936166078272537
Energy: 0.2732839595816707
Energy: 0.2882880430168103
Energy: 0.27135299489130793
Energy: 0.2895327385484977
Energy: 0.29351274755264806
Energy: 0.3137668621738141
Energy: 0.28347311334976416
Energy: 0.27676704096032695
Energy: 0.2965706653386232
Energy: 0.2667707764392305
Energy: 0.3022730381904582
Energy: 0.30219741306173326
Energy: 0.297583598974943
Energy: 0.3064922715813853
Energy: 0.30149683372450503
Energy: 0.279773398898049
Energy: 0.2725773669449609
Energy: 0.2902482349488353
Energy: 0.3174310873569155
Energy: 0.2943300893308442
Energy: 0.29521697468980923
Energy: 0.2898039078415276
Energy: 0.2999584324417118
Energy: 0.24104749590453284
Energy: 0.2931268534531341
Energy: 0.2896307905810756
Energy: 0.29352617264082975
Energy: 0.2807356327174573
Energy: 0.2794233006175468
Energy: 0.2737837708676803
Energy: 0.29218266941395166
Energy: 0.28997551070713695
Energy: 0.2865560836149852
Energy: 0.32826997047905176
Energy: 0.24249943001678873
Energy: 0.24207776393216687
Energy: 0.26802558473560995
Energy: 0.24083555698885933
Energy: 0.2708012768187922
Energy: 0.30627806744844394
Energy: 0.28896201846613423
Energy: 0.29371073785982565
Energy: 0.29123209166939745
Energy: 0.28483855183507567
Energy: 0.24098246584128963
Energy: 0.2811223373161715
Energy: 0.3178850730162992
Energy: 0.297097131369839
Energy: 0.2941832692891866
Energy: 0.2912848966779001
Energy: 0.2838637086601585
Energy: 0.291966093657444
Energy: 0.3140363231113105
Energy: 0.299614200750568
Energy: 0.31602306490408033
Energy: 0.2850478542686902
Energy: 0.26971228819392046
Energy: 0.2711184992925478
Energy: 0.26531414771592016
Energy: 0.2974689071796169
Energy: 0.29858062743700364
Energy: 0.29086730850132636
Energy: 0.2912350160007372
Energy: 0.2816900357019953
Energy: 0.3097180784387192
Energy: 0.2787008000679424
Energy: 0.29244786363454983
Energy: 0.2886541561756927
Energy: 0.2930639026109334
Energy: 0.3224162180442708
Energy: 0.28824545199202206
Energy: 0.297156142885392
Energy: 0.24165422280883228
Energy: 0.2893030306339221
Energy: 0.3015664535472066
Energy: 0.29509136671510017
Energy: 0.2954167296594027
Energy: 0.3017616056716386
Energy: 0.2722030941346315
Energy: 0.27886451424230574
Energy: 0.2886282866132536
Energy: 0.2940169833114821
Energy: 0.3166216064045825
Energy: 0.24197218863815087
Energy: 0.24078730250765423
Energy: 0.27961578579222823
Energy: 0.24044202499250855
Energy: 0.2929010735919518
Energy: 0.2886365857631033
Energy: 0.3224256824755797
Energy: 0.2406252522461521
Energy: 0.2542852886270458
Energy: 0.2890596674531321
Energy: 0.2401445987050021
Energy: 0.2756628720679734
Energy: 0.33685626544561137
Energy: 0.2906202741568864
Energy: 0.3161774413069225
Energy: 0.30030226226192136
Energy: 0.24095375071299913
Energy: 0.2733790533540289
Energy: 0.2921296694290234
Energy: 0.3008813598684969
Energy: 0.30767372576026936
Energy: 0.2931476007289721
Energy: 0.2733983044606081
Energy: 0.28845452540552574
Energy: 0.2716220826437503
Energy: 0.2896724953187769
Energy: 0.2933219137783967
Energy: 0.3139849090141973
Energy: 0.283505839478279
Energy: 0.2769819082899847
Energy: 0.2672511427161265
Energy: 0.26657588296424867
Energy: 0.30186339937721535
Energy: 0.3026410163771077
Energy: 0.2970134635563311
Energy: 0.3065027945271609
Energy: 0.3019593545116617
Energy: 0.2799551923688515
Energy: 0.27222489298042063
Energy: 0.2911093342882882
Energy: 0.3177838164323352
Energy: 0.2945121584175587
Energy: 0.2941620460423012
Energy: 0.28987346604306513
Energy: 0.2988817513127205
Energy: 0.24119139307589268
Energy: 0.29321120297876535
Energy: 0.28931692379472423
Energy: 0.2932681931791377
Energy: 0.28059629073332126
Energy: 0.24075346778088377
Energy: 0.2729950614472638
Energy: 0.2936551940025667
Energy: 0.3085998107373941
Energy: 0.2860522106417038
Energy: 0.33214626283885584
Energy: 0.24239179229776642
Energy: 0.2423146305859163
Energy: 0.2842024620408325
Energy: 0.24091505971981192
Energy: 0.2709781899404381
Energy: 0.30614647527593414
Energy: 0.2909206208995661
Energy: 0.2936511974344536
Energy: 0.30041689757305107
Energy: 0.284645135034606
Energy: 0.2409698888160238
Energy: 0.28104392702493286
Energy: 0.31778107559528973
Energy: 0.2893074974615063
Energy: 0.29421041688471855
Energy: 0.2914633151270733
Energy: 0.28345927028772716
Energy: 0.29171245313084904
Energy: 0.29944001856585184
Energy: 0.2983002825440613
Energy: 0.31559322802138534
Energy: 0.2837054765798675
Energy: 0.26986702604574286
Energy: 0.27108176558219366
Energy: 0.265119356839268
Energy: 0.2963961787229504
Energy: 0.30044419046691057
Energy: 0.29131225876557787
Energy: 0.2914122470595043
Energy: 0.2934143047076876
Energy: 0.31310785101685124
Energy: 0.2800160570304153
Energy: 0.2847858289248394
Energy: 0.28870932151682366
Energy: 0.29317019594222865
Energy: 0.31522311598711367
Energy: 0.288096759038598
Energy: 0.29661354186281813
Energy: 0.24186423330870538
Energy: 0.28924393102398105
Energy: 0.3016159470543278
Energy: 0.2954956478973036
Energy: 0.29497498573893777
Energy: 0.3014887033933828
Energy: 0.2722227484944682
Energy: 0.27880021507438796
Energy: 0.288719413326481
Energy: 0.29442387611825815
Energy: 0.31651494309527395
Energy: 0.2419891191759306
Energy: 0.24063923403345588
Energy: 0.2792856725805062
Energy: 0.24074481486389304
Energy: 0.29271157531206776
Energy: 0.2880932014530422
Energy: 0.3049867930529578
Energy: 0.24018682976039227
Energy: 0.24125150364596157
Energy: 0.2889004250796118

minimum gb energy = 0.2401445987050021 eV
minimum distance =  2.62575366664779 Angstroms
sigma value = 21


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

Energy: 0.3430897256316649
Energy: 0.2964361585774262
Energy: 0.2546805993566932
Energy: 0.29381252494794247
Energy: 0.2573736028190018
Energy: 0.26097904717769504
Energy: 0.3256398802944597
Energy: 0.25378978243404826
Energy: 0.30688595700930194
Energy: 0.2683148068597727
Energy: 0.3007190598514312
Energy: 0.28673095022459827
Energy: 0.2539662079396066
Energy: 0.30774246675248285
Energy: 0.25463714763552514
Energy: 0.2716488431785433
Energy: 0.2807701951824414
Energy: 0.25734024975947445
Energy: 0.3005610048792398
Energy: 0.2587285775584951
Energy: 0.28183997174157627
Energy: 0.3168620903762292
Energy: 0.300798033359741
Energy: 0.28063965121452045
Energy: 0.3006928693873243
Energy: 0.27956868439554666
Energy: 0.2610196751211314
Energy: 0.2748790486656966
Energy: 0.2543727059027607
Energy: 0.28955494774573204
Energy: 0.26701327540238456
Energy: 0.2984646319494851
Energy: 0.2647860758428368
Energy: 0.26721005086367644
Energy: 0.2931118759796684
Energy: 0.24222998644413815
Energy: 0.25505399201849904
Energy: 0.27938970126856133
Energy: 0.2980081032575072
Energy: 0.2646386970453429
Energy: 0.2783629746588241
Energy: 0.2791643763647594
Energy: 0.3057728839622495
Energy: 0.3015969815250097
Energy: 0.26008953222381376
Energy: 0.2998499415454698
Energy: 0.24073180985959558
Energy: 0.24220921671859955
Energy: 0.28268052967951474
Energy: 0.2521237479123448
Energy: 0.2712190359933045
Energy: 0.2857865398504281
Energy: 0.26411855270697393
Energy: 0.2782660539361414
Energy: 0.2552163915157372
Energy: 0.27962493592343846
Energy: 0.25911528718793575
Energy: 0.2868173121506961
Energy: 0.27059803592601983
Energy: 0.2982429153771182
Energy: 0.281799878453904
Energy: 0.27965394286069667
Energy: 0.28371110891071866
Energy: 0.27102259780522414
Energy: 0.297855802572802
Energy: 0.31890031553788606
Energy: 0.2801089898515135
Energy: 0.24991383211504095
Energy: 0.2555022614421116
Energy: 0.3090455892573116
Energy: 0.25837665468795257
Energy: 0.3222759134850894
Energy: 0.2676105195877598
Energy: 0.2711542262633926
Energy: 0.24053685474170924
Energy: 0.24082531714402955
Energy: 0.348990009233289
Energy: 0.2689830421080178
Energy: 0.3145891949447424
Energy: 0.2884216366752968
Energy: 0.2960612760783704
Energy: 0.23897261177089055
Energy: 0.2386214329104377
Energy: 0.32552929305895434
Energy: 0.3048977879592105
Energy: 0.27858689817969146
Energy: 0.28828543224291914
Energy: 0.2938323034460026
Energy: 0.259847494470345
Energy: 0.26004377042749577
Energy: 0.3174920610108711
Energy: 0.2383039100289319
Energy: 0.25792464810400706
Energy: 0.26892537717842835
Energy: 0.2834520965855387
Energy: 0.2848256581779747
Energy: 0.2765145682132516
Energy: 0.3080170208225523
Energy: 0.25533231888758523
Energy: 0.26124880994507493
Energy: 0.29789927151175066
Energy: 0.31379744699477014
Energy: 0.3414759638250636
Energy: 0.33019356371314823
Energy: 0.283853056474904
Energy: 0.25626588699735464
Energy: 0.3007802965236966
Energy: 0.27649482817448023
Energy: 0.2708329195547031
Energy: 0.27051116652470825
Energy: 0.27064087585690866
Energy: 0.31227162796521507
Energy: 0.25764145413049255
Energy: 0.29937181195357815
Energy: 0.26750990735518415
Energy: 0.26669537206679067
Energy: 0.23821002191486437
Energy: 0.25262366801091213
Energy: 0.2803123547470774
Energy: 0.23990741708358979
Energy: 0.25816599159560605
Energy: 0.2669093241823215
Energy: 0.2691674613417901
Energy: 0.2725549048544884
Energy: 0.2749148714994611
Energy: 0.2879511923323011
Energy: 0.23797807682013444
Energy: 0.26493516196712136
Energy: 0.26777939580077825
Energy: 0.2594759800272049
Energy: 0.24114477105779414
Energy: 0.24164237301135372
Energy: 0.2710683681924291
Energy: 0.2563220394512172
Energy: 0.2658016771909852
Energy: 0.27321992608711787
Energy: 0.27957464795223974
Energy: 0.27874080815934127
Energy: 0.25421657935316827
Energy: 0.28989058461519596
Energy: 0.2742032727157362
Energy: 0.3133642755910472
Energy: 0.28101427320430594
Energy: 0.2983626545435899
Energy: 0.33575222008309025
Energy: 0.28651674908066116
Energy: 0.31338200327082727
Energy: 0.25854055086017913
Energy: 0.3004769697489649
Energy: 0.26727355506556794
Energy: 0.29166093541183813
Energy: 0.26786106524687464
Energy: 0.26006883972560535
Energy: 0.28071851422799
Energy: 0.25444421800253864
Energy: 0.31498361003534225
Energy: 0.3251303572582895
Energy: 0.3177832039010521
Energy: 0.2602707416342085
Energy: 0.2768478229463871
Energy: 0.3527203286212753
Energy: 0.25374489435026565
Energy: 0.29644132631353426
Energy: 0.3111125414494358
Energy: 0.2706234199381374
Energy: 0.3032775428640564
Energy: 0.30913960046408867
Energy: 0.3164400068410356
Energy: 0.23833079159008472
Energy: 0.32185090098161645
Energy: 0.28951610965700664
Energy: 0.2938619116660694
Energy: 0.2614190812363627
Energy: 0.274495148529846
Energy: 0.3304226435042988

minimum gb energy = 0.23797807682013444 eV
minimum distance =  2.5552341435945 Angstroms
sigma value = 113


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

Energy: 0.2881128455707769
Energy: 0.39797295301677854
Energy: 0.29400678011453135
Energy: 0.3813727658887896
Energy: 0.3431449164984276
Energy: 0.3254419842264658
Energy: 0.3625919898970645
Energy: 0.3052983819730709
Energy: 0.3739811966215354
Energy: 0.3254762618088775
Energy: 0.31046884340100733
Energy: 0.32739561929933153
Energy: 0.316589630808872
Energy: 0.3664808388188656
Energy: 0.31932630606866147
Energy: 0.3857053595221557
Energy: 0.3265935494276684
Energy: 0.3487863645783898
Energy: 0.34303099515531443
Energy: 0.3067080525050908
Energy: 0.35922214655006485
Energy: 0.2855532597874745
Energy: 0.35334785909054206
Energy: 0.307542758573789
Energy: 0.2840379026493913
Energy: 0.321416255481994
Energy: 0.3021885222536914
Energy: 0.3703564579645882
Energy: 0.2911293041410028
Energy: 0.348142135454385
Energy: 0.31167637583493174
Energy: 0.33487226165142586
Energy: 0.3240290456503791
Energy: 0.30845264543612366
Energy: 0.36556525809348156
Energy: 0.29501371413311334
Energy: 0.32718070641962027
Energy: 0.30841096836417503
Energy: 0.34378267306339655
Energy: 0.3212751800057123
Energy: 0.29720042914331085
Energy: 0.37964362739343244
Energy: 0.3032804735013007
Energy: 0.326062317925652
Energy: 0.3049946934862589
Energy: 0.3254260524550517
Energy: 0.3361535449106192
Energy: 0.31913230583960467
Energy: 0.3315686574792581
Energy: 0.29346030541446355
Energy: 0.32568939304748884
Energy: 0.2972844372444636
Energy: 0.2968408977280003
Energy: 0.2851487092542399
Energy: 0.3329010035489937
Energy: 0.33695388890388983
Energy: 0.2684468823149433
Energy: 0.3138398250486626
Energy: 0.2985524022158421
Energy: 0.3331936338397731
Energy: 0.33643201338112233
Energy: 0.33407643893655664
Energy: 0.31648413374792383
Energy: 0.30538578323780186
Energy: 0.3133794785639158
Energy: 0.28931669015103534
Energy: 0.29839048859024087
Energy: 0.30891222636018695
Energy: 0.2727204122200661
Energy: 0.32701935847227864
Energy: 0.31012933004981225
Energy: 0.33124357052839276
Energy: 0.26911636516682474
Energy: 0.30959860780575865
Energy: 0.2931679423254581
Energy: 0.2661353387208378
Energy: 0.3483234384679334
Energy: 0.2897598562812212
Energy: 0.2867172892296122
Energy: 0.3060445259476885
Energy: 0.3395449695107656
Energy: 0.317017643167034
Energy: 0.30687607211138834
Energy: 0.30779702172820933
Energy: 0.29275424683058204
Energy: 0.3186234252633375
Energy: 0.2847112018830862
Energy: 0.36212266657136083
Energy: 0.27038448090305095
Energy: 0.2763662972184336
Energy: 0.33927510404557454
Energy: 0.3006205844899349
Energy: 0.3256357940137158
Energy: 0.2959449601962462
Energy: 0.32497639627314423
Energy: 0.30910574438490135
Energy: 0.3052469702838896
Energy: 0.3254209349753026
Energy: 0.2821580379375071
Energy: 0.3203794163870112
Energy: 0.2950242146128214
Energy: 0.32128243998060857
Energy: 0.31775570740071024
Energy: 0.33879045853646894
Energy: 0.3460937650165548
Energy: 0.2894653168912807
Energy: 0.3495702679103867
Energy: 0.3252698054276856
Energy: 0.36274847857174486
Energy: 0.2789512471782079
Energy: 0.3370273817145044
Energy: 0.35769986552809296
Energy: 0.2882572258830218
Energy: 0.32828981266905183
Energy: 0.31283506238541964
Energy: 0.3378104844897658
Energy: 0.32704207899103455
Energy: 0.33026142149324017
Energy: 0.35192793855837906
Energy: 0.2998446904587544
Energy: 0.36138573925717493
Energy: 0.3197168300038423
Energy: 0.33022763572073105
Energy: 0.33441105522457365
Energy: 0.28998521924136617
Energy: 0.3659226719411169
Energy: 0.3332245114083649
Energy: 0.351085892677043
Energy: 0.3261722841071248
Energy: 0.34741584493664157
Energy: 0.3276597252773861
Energy: 0.31137749027431866
Energy: 0.3667510828662236
Energy: 0.2825980801966523
Energy: 0.3590389382480862
Energy: 0.2907344461401158
Energy: 0.3471269760784455
Energy: 0.35101930476371784
Energy: 0.32928550555256375
Energy: 0.37012551307628694
Energy: 0.3139201401759515
Energy: 0.3570749892900428
Energy: 0.34530354314817924
Energy: 0.36505856697504513
Energy: 0.30237084938156783
Energy: 0.3091611277244486
Energy: 0.34987995608909495
Energy: 0.31677235522382974
Energy: 0.37601764645191255
Energy: 0.3151024317799643
Energy: 0.35353257677085564
Energy: 0.310748356608308
Energy: 0.3241119753661809
Energy: 0.3669214554722901
Energy: 0.28070717629595265
Energy: 0.38067542134178095
Energy: 0.31376214182035506
Energy: 0.30535797606552356
Energy: 0.34756445613899833
Energy: 0.2867257561119235
Energy: 0.3693350147781072
Energy: 0.3082148384125572
Energy: 0.37562975202120713
Energy: 0.316645046365795
Energy: 0.3612933113278748
Energy: 0.3272991551916691
Energy: 0.3249562155625285
Energy: 0.36615885025702266
Energy: 0.29794473405122474
Energy: 0.3866308204839286
Energy: 0.31391111346927747
Energy: 0.3076887192872735
Energy: 0.32095306520207684
Energy: 0.3055120540095102
Energy: 0.3597786629090445
Energy: 0.2841093685930907
Energy: 0.3517111888937218
Energy: 0.31083047733791497
Energy: 0.33076722720868157
Energy: 0.3242706578404723
Energy: 0.3141774662590221
Energy: 0.34849818027706486
Energy: 0.31031100101961473
Energy: 0.3737261328652894
Energy: 0.31093849731469697
Energy: 0.3520252385711905
Energy: 0.32819088838439425
Energy: 0.3038798459475637
Energy: 0.36442934801480076
Energy: 0.294931862668507
Energy: 0.33574027135915296
Energy: 0.31082030122581794
Energy: 0.3455998084049032
Energy: 0.3231965164798842
Energy: 0.28998632207454494
Energy: 0.36092510172706
Energy: 0.3027519675042881
Energy: 0.3219992323865034
Energy: 0.29287599349297155
Energy: 0.3481920077348825
Energy: 0.316813452437345
Energy: 0.31797407361679575
Energy: 0.32997524228881847
Energy: 0.2839083775111135
Energy: 0.3257404495412073
Energy: 0.2821197055823378
Energy: 0.2989005178277374
Energy: 0.29095487683396976
Energy: 0.3137108418673179
Energy: 0.33725367708007786
Energy: 0.2671623071866637
Energy: 0.30677816660479124
Energy: 0.2958576885890483
Energy: 0.33478938344761344
Energy: 0.3292554454772216
Energy: 0.33222359328045414
Energy: 0.30788658803814234
Energy: 0.29853038838710394
Energy: 0.3682132245555993
Energy: 0.28965461260602926
Energy: 0.307093737564955
Energy: 0.3072038297891463
Energy: 0.27005553952134287
Energy: 0.3281836961791904
Energy: 0.297949780617381
Energy: 0.3332640895321095
Energy: 0.2979582575129663
Energy: 0.3119088643385666
Energy: 0.29224953458292957
Energy: 0.26574771016103194
Energy: 0.34723412035883877
Energy: 0.25992768934579485
Energy: 0.2841785431373261
Energy: 0.3070177012361905
Energy: 0.3429804364036413
Energy: 0.3276690635706336
Energy: 0.3100224853996232
Energy: 0.308269182911879
Energy: 0.3009856403754317
Energy: 0.31693497772350365
Energy: 0.2741659150308231
Energy: 0.3176180123969636
Energy: 0.34837835122511707
Energy: 0.28926322286560546
Energy: 0.3357677889496072
Energy: 0.29829179100814424
Energy: 0.3304022256538788
Energy: 0.3356451487056143
Energy: 0.3183334064133626
Energy: 0.3061143367035065
Energy: 0.30283382162980726
Energy: 0.32147199035347757
Energy: 0.28187044538518397
Energy: 0.3891749991155341
Energy: 0.29532173340139944
Energy: 0.32003975675721313
Energy: 0.29630521373604873
Energy: 0.30862730624896545
Energy: 0.3572052347629584
Energy: 0.2924201152781227
Energy: 0.34902928285380763
Energy: 0.3079890182540196
Energy: 0.33271420465045304
Energy: 0.2855614216493082
Energy: 0.3378646892141231
Energy: 0.35647843642209814
Energy: 0.30015783529461443
Energy: 0.32876923015981896
Energy: 0.31213679896685104
Energy: 0.3335898660811479
Energy: 0.3241523712734506
Energy: 0.3118296108178599
Energy: 0.33389130051020227
Energy: 0.30007094389602706
Energy: 0.36105838659007405
Energy: 0.3200058206196759
Energy: 0.3305015638157608
Energy: 0.34391824020241973
Energy: 0.3040091238879546
Energy: 0.36539786921548073
Energy: 0.33246598445541625
Energy: 0.3780799027699823
Energy: 0.31470428891537755
Energy: 0.33445723257172005
Energy: 0.3211038841094065
Energy: 0.3006378847232136
Energy: 0.3674552324549156
Energy: 0.28334981199376946
Energy: 0.3627541418852836
Energy: 0.29132716432328815
Energy: 0.3445904825742434
Energy: 0.3512387844193914
Energy: 0.34659830834253685
Energy: 0.35623274980916125
Energy: 0.3122363716030247
Energy: 0.356762574852339
Energy: 0.31093755004666157
Energy: 0.35350195864266254
Energy: 0.3242547016418019
Energy: 0.30937823184599383
Energy: 0.3505810579213832
Energy: 0.3016701529933763
Energy: 0.3761431453743933
Energy: 0.3160344248389656
Energy: 0.3199457026633554
Energy: 0.3112693375900445
Energy: 0.31379736398458125
Energy: 0.3650766386999428
Energy: 0.27592094507671283
Energy: 0.3841992672533618
Energy: 0.2918595916613403
Energy: 0.3035339480822415
Energy: 0.3472332924597396
Energy: 0.28764037281632227
Energy: 0.3676053692804011

minimum gb energy = 0.25992768934579485 eV
minimum distance =  2.51117512593515 Angstroms
sigma value = 365


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

Energy: 0.3202043297035625
Energy: 0.3985807973702463
Energy: 0.3185356831104358
Energy: 0.315302980702268
Energy: 0.31503021786066865
Energy: 0.3156070833424024
Energy: 0.3148059639306394
Energy: 0.3209244471553963
Energy: 0.39199847939269833
Energy: 0.319795661366217
Energy: 0.32253125256462944
Energy: 0.313453594011638
Energy: 0.324107074503668
Energy: 0.3716937786478546
Energy: 0.3174129642683698
Energy: 0.3908562436264139
Energy: 0.32055235756389167
Energy: 0.3154029045567785
Energy: 0.31479461243657436
Energy: 0.32143990434165826
Energy: 0.32264717161213496
Energy: 0.31683157630814207
Energy: 0.391151283018772
Energy: 0.3210799667653496
Energy: 0.3151799283328602
Energy: 0.3150225438881349
Energy: 0.32078639589392993
Energy: 0.3141415180897958
Energy: 0.3263170972017355
Energy: 0.39157541983205885
Energy: 0.3157439479208707
Energy: 0.3738264286666288
Energy: 0.3254327686185166
Energy: 0.31449997174601024
Energy: 0.371830680355309
Energy: 0.31823690346764916
Energy: 0.39320584004396475
Energy: 0.3191410619129448
Energy: 0.3144089077636869
Energy: 0.31460612162629853
Energy: 0.31446846199055956
Energy: 0.31640822570021115
Energy: 0.3186453537998006
Energy: 0.39099744595368213
Energy: 0.3204988639688743
Energy: 0.31279529472915385
Energy: 0.31322678705800194
Energy: 0.3231666270095429
Energy: 0.3937338470137361
Energy: 0.3181205505607337
Energy: 0.3914303661238593
Energy: 0.32107512261410787
Energy: 0.31361010833966285
Energy: 0.31298706315894426
Energy: 0.3202042387344211
Energy: 0.3927562105062895
Energy: 0.3180701120128558
Energy: 0.39246287909247296
Energy: 0.32048133023055775
Energy: 0.3147972795301633
Energy: 0.3141849133547564
Energy: 0.319569055284493
Energy: 0.31557909940241385
Energy: 0.3280007641876736
Energy: 0.3989685412219753
Energy: 0.3150526679760785
Energy: 0.39910936473649344
Energy: 0.3992416976192121
Energy: 0.3147422035616816
Energy: 0.3981291863014612
Energy: 0.3174988736604279
Energy: 0.3916392763255018
Energy: 0.31990846791803795
Energy: 0.3158849984927835
Energy: 0.3148754752370095
Energy: 0.32134102598279735
Energy: 0.3136225779127702
Energy: 0.3175179403154645
Energy: 0.3904337131605282
Energy: 0.3204842234749419
Energy: 0.3151133661900807
Energy: 0.3154233836500885
Energy: 0.3221671953449626
Energy: 0.39251143814904066
Energy: 0.31967632827774467
Energy: 0.3914512133817144
Energy: 0.32046633916118794
Energy: 0.31317013049593495
Energy: 0.31263469718787673
Energy: 0.3206544245957452
Energy: 0.39298034517981945
Energy: 0.31785861955048766
Energy: 0.3944017935679923
Energy: 0.31887368595800214
Energy: 0.31494743009012405
Energy: 0.3138808275117474
Energy: 0.3161007856747011
Energy: 0.3172578550906445
Energy: 0.3259516334336947
Energy: 0.3911373234153358
Energy: 0.3153983924690914
Energy: 0.3264272063207272
Energy: 0.3151973999874761
Energy: 0.32407237098125974
Energy: 0.3714424200330082
Energy: 0.31720846326264096
Energy: 0.3908922354628821
Energy: 0.3200600970663867
Energy: 0.31513496918155715
Energy: 0.3146966682955253
Energy: 0.3212656045648405
Energy: 0.3130486421815368
Energy: 0.31715542923588197
Energy: 0.39099885239152204
Energy: 0.32035789520352514
Energy: 0.3149283976722577
Energy: 0.31483613820860035
Energy: 0.32117250894595906
Energy: 0.3127509075019882
Energy: 0.325797009987724
Energy: 0.3925344579496901
Energy: 0.31883828768111727
Energy: 0.3129086467083386
Energy: 0.31395288732113374
Energy: 0.3238004197740877
Energy: 0.3717388306625335
Energy: 0.31989396558667266
Energy: 0.39119384957363296
Energy: 0.3180370871858035
Energy: 0.31404185208261565
Energy: 0.3143971718645219
Energy: 0.31549401572174374
Energy: 0.3152808481038066
Energy: 0.3201027678327034
Energy: 0.39165684338407647
Energy: 0.32002948577367707
Energy: 0.3130789666257848
Energy: 0.31326637182543376
Energy: 0.31984996591761633
Energy: 0.3930595349134476

minimum gb energy = 0.31263469718787673 eV
minimum distance =  2.56636047430271 Angstroms
sigma value = 23