Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.9200812876224522
cohesive_energy=5.770451211374899
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.64412161827812e-19, 2.75449411270548e-19, 3.64930976279448e-19, 4.42610908202304e-19, 5.132572847019e-19, 5.76338183135748e-19, 6.30350761821156e-19, 6.75786888984762e-19, 7.14102943186872e-19, 7.466880115691639e-19, 7.746203590063201e-19, 7.987363217012879e-19, 8.19686383367472e-19, 8.38007273177262e-19, 8.5412837446857e-19, 8.68386144334536e-19, 8.81008091857188e-19, 8.92114380284076e-19, 9.017210313815398e-19, 9.097655602608539e-19, 9.16147029794076e-19, 9.20759696323362e-19, 9.23536268430084e-19, 9.24455917818e-19, 9.23456159598384e-19, 9.202373867406779e-19, 9.14477561741448e-19, 9.05867464510332e-19, 8.933400454090859e-19, 8.7580582432659e-19, 8.524605085925759e-19, 8.223347813434739e-19, 7.842013752776399e-19, 7.3648054423395e-19, 6.770926629414719e-19, 6.03285191942994e-19, 5.113955554531919e-19, 3.9663004098313793e-19, 2.5275137489666997e-19, 7.15782024299304e-20, -1.5803998491906717e-19, -4.5201408286725e-19, -8.33550017781474e-19, -1.335665766170538e-18, -2.00236831364052e-18, -2.89244152089288e-18, -4.097550719688659e-18, -5.778554444081459e-18, -8.2317432189969e-18, -1.198910377398834e-17, -1.73220928961544e-17, -2.5025678587753198e-17, -3.7200458611855797e-17, -5.859208015837019e-17]
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: 0.018927043823578005
Energy: 0.110896302876705
Energy: 0.5622479503147731
Energy: 0.019745207440779414
Energy: 0.11089630287827552
Energy: 0.5736608164558576
Energy: 0.019745207440779414
Energy: 0.5736608164631474
Energy: 0.5622479503153066
Energy: 0.01974520744027566
Energy: 0.018927043823578005
Energy: 0.11089630287774213
Energy: 0.019745207440779414
Energy: 0.5736608164621102
Energy: 0.110896302876705
Energy: 0.5736608164558576

minimum gb energy = 0.018927043823578005 eV
minimum distance =  2.67640753128195 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.1835298654277466
Energy: 0.9197785541917392
Energy: 0.9217993385423212
Energy: 0.8573440812220229
Energy: 0.8480181940170849
Energy: 0.933758647819726
Energy: 0.8471615731992224
Energy: 0.933758647819726
Energy: 0.9217633581093017
Energy: 0.9185690595089806
Energy: 1.2982588330398974
Energy: 0.9185690595089806
Energy: 0.851243560249074
Energy: 0.848269946787547
Energy: 0.8475425360487129
Energy: 0.8482699467881938
Energy: 1.0993994691372584
Energy: 0.8484848929426062
Energy: 0.8490766748531571
Energy: 0.8484848929439
Energy: 0.8670490430506838
Energy: 0.8632153974078198
Energy: 0.8481739926172754
Energy: 0.8632153974084666
Energy: 0.8718240199721137
Energy: 0.860318151943547
Energy: 1.0968482891530291
Energy: 0.8603181519461346
Energy: 0.86818002139698
Energy: 0.8717418551852695
Energy: 0.9043910764631505
Energy: 0.8717418551833288
Energy: 0.953233332539409
Energy: 0.8642491381232925
Energy: 0.9014068803695856
Energy: 0.8642491381245863
Energy: 0.9188023267296433
Energy: 0.8666718772895489
Energy: 0.883545226816056
Energy: 0.8666718772908427
Energy: 0.8790140995353244
Energy: 0.8638734399958623
Energy: 0.9543252379578405
Energy: 0.8638734399958623
Energy: 0.8676226662318736
Energy: 0.8627120768404807
Energy: 0.9014432723112211
Energy: 0.8627120768391869
Energy: 0.8695357581881954
Energy: 0.8598064910521853
Energy: 0.8406093193887643
Energy: 0.8598064910495977
Energy: 0.8667951594197394
Energy: 0.8629871257485559
Energy: 0.8423605273493276
Energy: 0.8629871257504966
Energy: 0.8398068739240502
Energy: 0.848170026557221
Energy: 0.8493086598903371
Energy: 0.8481700265559272
Energy: 0.86838050509865
Energy: 0.8480450247810665
Energy: 0.8471167865986606
Energy: 0.8480450247823603
Energy: 0.9192494523823362
Energy: 0.9184808142898848
Energy: 0.8531440319962785
Energy: 0.918480814289238
Energy: 0.84796532200804
Energy: 0.8486089410685514
Energy: 0.8407632713614465
Energy: 0.8486089410698452
Energy: 0.8472561426309766
Energy: 0.9175582784239266
Energy: 0.92036169813236
Energy: 0.9175582784226327
Energy: 0.8663591207217579
Energy: 0.8478301597876595
Energy: 0.8513620613235334
Energy: 0.8478301597870127
Energy: 0.8523538450956386
Energy: 0.8508040067441751
Energy: 0.8665828819041017
Energy: 0.850804006745469
Energy: 0.8479884501264635
Energy: 0.8483386128102844
Energy: 0.8671864758801389
Energy: 0.8483386128109314
Energy: 0.8659522962050008
Energy: 0.8629430612675709
Energy: 0.8741613193788971
Energy: 0.8629430612662771
Energy: 0.9058946271273164
Energy: 0.8684199305570601
Energy: 0.8719257990939544
Energy: 0.8684199305544726
Energy: 0.9001019722265328
Energy: 0.8646836227341591
Energy: 0.9532983088038979
Energy: 0.8646836227373934
Energy: 0.8861876549978722
Energy: 0.8610213211677527
Energy: 0.9196115573688443
Energy: 0.861021321164518
Energy: 0.9544671789791812
Energy: 0.8614349812975328
Energy: 0.8795287531947386
Energy: 0.8614349812955923
Energy: 0.8993234256756513
Energy: 0.8620042565617498
Energy: 0.8673670524593675
Energy: 0.862004256560456
Energy: 0.8401123141240021
Energy: 0.8601684581613641
Energy: 0.8690233952819845
Energy: 0.8601684581626579
Energy: 0.8426517189142716
Energy: 0.864841329238724
Energy: 0.8680474720941366
Energy: 0.8648413292400178
Energy: 0.8486210145375437
Energy: 0.847925822801931
Energy: 0.839745785141153
Energy: 0.8479258228025779
Energy: 0.8469741153823788
Energy: 0.8483388339856933
Energy: 0.8682926208158462
Energy: 0.8483388339831058
Energy: 0.852484213042655
Energy: 0.8507050656225859
Energy: 0.9183415319251717
Energy: 0.850705065621939

minimum gb energy = 0.839745785141153 eV
minimum distance =  2.39527416678956 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.364506445269611
Energy: 0.9524706663749691
Energy: 0.9524475973948614
Energy: 0.8780692985840852
Energy: 0.8728109438373646
Energy: 0.9605030095906518
Energy: 0.8725072479831207
Energy: 0.9605030095773758
Energy: 0.9529919187966664
Energy: 0.9512043052777343
Energy: 1.239290306050213
Energy: 0.9512043052880601
Energy: 0.8758856762081666
Energy: 0.8721279417912455
Energy: 0.8719294556096775
Energy: 0.8721279417853451
Energy: 0.8706176364004298
Energy: 0.8718896208113118
Energy: 0.872971435295196
Energy: 0.8718896208164747
Energy: 0.8984163473672827
Energy: 0.9006694732631031
Energy: 0.8711931974210905
Energy: 0.9006694732645781
Energy: 0.9082409727553885
Energy: 0.8946078024991836
Energy: 1.034053964810945
Energy: 0.8946078024954958
Energy: 0.900606316252289
Energy: 0.901384248735152
Energy: 0.9354276852813445
Energy: 0.9013842487299892
Energy: 0.899006426857022
Energy: 0.8996216426992523
Energy: 0.9482862097192709
Energy: 0.8996216426853055
Energy: 0.9338367034505343
Energy: 0.9022901964979075
Energy: 0.900076319752501
Energy: 0.9022901964986451
Energy: 0.8680420479302273
Energy: 0.8943212052541613
Energy: 0.911130503594261
Energy: 0.8943212052408851
Energy: 0.8702943463095867
Energy: 0.9008671836238548
Energy: 0.8983505815001888
Energy: 0.9008671836223797
Energy: 0.8725044650825309
Energy: 0.871865269901949
Energy: 0.8693401886507304
Energy: 0.8718652699048993
Energy: 0.8715727540746181
Energy: 0.8718153069802617
Energy: 0.8928802600358327
Energy: 0.8718153069868997
Energy: 0.8728509755189415
Energy: 0.9497275929298984
Energy: 0.9493516167970498
Energy: 0.9497275929284232
Energy: 0.8702602734295525
Energy: 0.8716913433425238
Energy: 0.8721005681601911
Energy: 0.8716913433358858
Energy: 0.95443895359387
Energy: 0.9501072263672031
Energy: 0.8721930991472139
Energy: 0.9501072263635153
Energy: 0.8755841542191809
Energy: 0.8720975553799747
Energy: 0.8977375602108483
Energy: 0.8720975553784996
Energy: 0.8707726764589768
Energy: 0.8755935858519326
Energy: 0.8775268062286017
Energy: 0.8755935858482448
Energy: 0.8987890670695209
Energy: 0.8713113750439838
Energy: 0.8710800147513607
Energy: 0.8713113750417713
Energy: 0.9052135903974217
Energy: 0.8991839757126179
Energy: 0.8991579257551985
Energy: 0.8991839757222062
Energy: 0.9024260694749424
Energy: 0.9048826791131814
Energy: 0.9373001106660764
Energy: 0.9048826791080183
Energy: 0.8989022588956909
Energy: 0.9004671165205761
Energy: 0.9430429516345639
Energy: 0.9004671165213136
Energy: 0.9339368416965821
Energy: 0.9000526840071897
Energy: 0.8990392800062063
Energy: 0.900052684015303
Energy: 0.8680334820271338
Energy: 0.8942984421780358
Energy: 0.9106366089250972
Energy: 0.894298442191312
Energy: 0.8676434686903168
Energy: 0.8970048445723344
Energy: 0.9000177876654127
Energy: 0.8970048445701218
Energy: 0.8715496504289234
Energy: 0.8712927058462132
Energy: 0.8676528974825127
Energy: 0.8712927058425255
Energy: 0.8714391772562569
Energy: 0.8712290198115538
Energy: 0.8731246429405144
Energy: 0.8712290198093412
Energy: 0.872400596081229
Energy: 0.875638516748537
Energy: 0.9495425905516668
Energy: 0.8756385167536999

minimum gb energy = 0.8676434686903168 eV
minimum distance =  2.38959979865084 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.2963210672868162
Energy: 0.9860131228313794
Energy: 0.9864709109207134
Energy: 0.8953007216114099
Energy: 0.8945195462734091
Energy: 0.9846093475827149
Energy: 0.8945816486172393
Energy: 0.9846093475844298
Energy: 0.9873236693574152
Energy: 0.9849035797361939
Energy: 1.1638781846084167
Energy: 0.9849035797344792
Energy: 0.9011682035809323
Energy: 0.8953013760728865
Energy: 0.8944585500536119
Energy: 0.8953013760711716
Energy: 0.8928491981731513
Energy: 0.8946251186776049
Energy: 0.8981449799606435
Energy: 0.8946251186784622
Energy: 0.9366141581092516
Energy: 0.9789159114905729
Energy: 0.8953789448293831
Energy: 0.9789159114905729
Energy: 0.9388571165274437
Energy: 0.9410393953728192
Energy: 0.9660049906682294
Energy: 0.9410393953711433
Energy: 0.9412682489704892
Energy: 0.9454132842199051
Energy: 0.9122729693611686
Energy: 0.9454132842199051
Energy: 0.9671023192558836
Energy: 0.9401734484440217
Energy: 0.9018425875118946
Energy: 0.9401734484448792
Energy: 0.9370869065279985
Energy: 0.9414084449862624
Energy: 0.8958931594539193
Energy: 0.941408444985405
Energy: 0.8895110426747345
Energy: 0.8950409659150673
Energy: 0.895037391199185
Energy: 0.8950409659159247
Energy: 0.8883888489010312
Energy: 0.8955768074718353
Energy: 0.8940424568175128
Energy: 0.8955768074709779
Energy: 0.9824539942160444
Energy: 0.9818514660614923
Energy: 0.8875249336268152
Energy: 0.9818514660589199
Energy: 0.893937836754783
Energy: 0.8949528391336891
Energy: 0.9003806037393358
Energy: 0.8949528391336891
Energy: 0.8928566974468152
Energy: 0.982971559955982
Energy: 0.988450510779623
Energy: 0.9829715599542672
Energy: 0.9329395204917702
Energy: 0.896970873284706
Energy: 0.900343298166541
Energy: 0.8969708732838487
Energy: 0.8944970350178273
Energy: 0.9013714663976784
Energy: 0.892801250546556
Energy: 0.9013714663959637
Energy: 0.8957051636001557
Energy: 0.8948592783034929
Energy: 0.9364414233701882
Energy: 0.8948592783052078
Energy: 0.9660506958067896
Energy: 0.9432983548591028
Energy: 0.9363734857299498
Energy: 0.9432983548582454
Energy: 0.9125643690626922
Energy: 0.943492738566965
Energy: 0.9346774866397288
Energy: 0.9434927385661075
Energy: 0.9035090527089761
Energy: 0.9395292292122606
Energy: 0.9679809850116786
Energy: 0.939529229213118
Energy: 0.8991503954445992
Energy: 0.9401411336691217
Energy: 0.937153610512127
Energy: 0.9401411336699791
Energy: 0.8938961986027716
Energy: 0.8956591293963927
Energy: 0.888936789243735
Energy: 0.8956591293955354
Energy: 0.8951266296100744
Energy: 0.895248941632814
Energy: 0.8880961686729985
Energy: 0.8952489416310992
Energy: 0.8873852374912061
Energy: 0.9015640459251704
Energy: 0.9815468755847744
Energy: 0.9015640459234555

minimum gb energy = 0.8873852374912061 eV
minimum distance =  2.39230144981381 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.1949443382862683
Energy: 1.015993057366391
Energy: 1.0171186542852941
Energy: 0.9010266967926361
Energy: 0.9210151670872508
Energy: 0.9977614719581771
Energy: 0.9210760714576228
Energy: 0.9977614719581771
Energy: 1.0173681002252624
Energy: 1.01432682487844
Energy: 1.0081859700978726
Energy: 1.0143268248815085
Energy: 0.9296466663146357
Energy: 0.9219384057472118
Energy: 0.921942956726098
Energy: 0.9219384057441433
Energy: 0.9188559599504287
Energy: 0.9226397525749429
Energy: 0.9266202621248261
Energy: 0.9226397525708516
Energy: 0.9308946773595046
Energy: 1.0119607392472092
Energy: 0.9231765791757114
Energy: 1.0119607392513006
Energy: 0.9518130453493302
Energy: 0.9914222615825605
Energy: 0.9231185991242141
Energy: 0.9914222615866517
Energy: 0.9227278906010159
Energy: 0.9919886104709333
Energy: 0.921682390524157
Energy: 0.9919886104688876
Energy: 0.9219571770539587
Energy: 0.9227858369687777
Energy: 0.8929655785850676
Energy: 0.9227858369728689
Energy: 0.9229384846270332
Energy: 0.9233210738035166
Energy: 0.8905859217785009
Energy: 0.9233210738014709
Energy: 0.8902817459796141
Energy: 1.0108920007367683
Energy: 1.0119908949879557
Energy: 1.0108920007306315
Energy: 0.9594188840700533
Energy: 0.9240398304744988
Energy: 0.9219406138896165
Energy: 0.9240398304734762
Energy: 1.0198991538102984
Energy: 1.0112139745113506
Energy: 1.0139881060348734
Energy: 1.0112139745123734
Energy: 0.9309696089489868
Energy: 0.9216934297465424
Energy: 0.925484566445805
Energy: 0.921693429748588
Energy: 0.9184808874885789
Energy: 0.9306208786242042
Energy: 0.9221377308598839
Energy: 0.9306208786221585
Energy: 0.9299482218511371
Energy: 0.9233663213934106
Energy: 0.9227165637188055
Energy: 0.9233663213923878
Energy: 0.9587408111600276
Energy: 0.9917737775357677
Energy: 0.9220885635360332
Energy: 0.9917737775307001
Energy: 0.9610011805298021
Energy: 0.9920364358298267
Energy: 0.9219281383525544
Energy: 0.9920364358257354
Energy: 0.9208344374044148
Energy: 0.923249588446474
Energy: 0.8909931508887844
Energy: 0.923249588446474
Energy: 0.923161629623973
Energy: 0.9241246521162483
Energy: 0.8909671538120476
Energy: 0.9241246521162483
Energy: 0.8895217290258446
Energy: 0.9319018842889542
Energy: 1.0102578818808365
Energy: 0.9319018842848629

minimum gb energy = 0.8895217290258446 eV
minimum distance =  2.39279200984301 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.0584940188692833
Energy: 1.0410509674260513
Energy: 1.0438441186675795
Energy: 0.8978808045182172
Energy: 0.923707785797333
Energy: 0.9684885952726444
Energy: 0.9180492327934093
Energy: 0.9684885952726444
Energy: 1.0417641442902696
Energy: 1.0396083179923798
Energy: 1.121101944724471
Energy: 1.0396083179936448
Energy: 0.8921334962586822
Energy: 0.9688745063209596
Energy: 0.9191806030463356
Energy: 0.9688745063209596
Energy: 0.9709476785187815
Energy: 0.9791734274901832
Energy: 0.9176295174443392
Energy: 0.9791734274889184
Energy: 0.89107673951247
Energy: 0.9791202028195614
Energy: 0.9179800169498803
Energy: 0.9791202028195614
Energy: 0.8856823690326755
Energy: 0.9817966565175672
Energy: 0.9726632219671782
Energy: 0.9817966565188321
Energy: 0.8847937247126044
Energy: 0.980100667258792
Energy: 0.9224548750439479
Energy: 0.9801006672600568
Energy: 1.038676118246348
Energy: 1.036689783191787
Energy: 1.1801652690219095
Energy: 1.036689783193052
Energy: 0.9214654542274086
Energy: 0.9802945995456485
Energy: 0.8854767422352499
Energy: 0.9802945995469133
Energy: 1.0425666914814664
Energy: 1.0377530758850186
Energy: 1.0498554004669838
Energy: 1.0377530758850186
Energy: 0.8889335943883838
Energy: 0.9714975452055475
Energy: 0.8916167451783201
Energy: 0.9714975452042826
Energy: 0.9193148622249441
Energy: 0.9914083230778528
Energy: 0.9709013263040248
Energy: 0.9914083230803825
Energy: 0.9199526440168085
Energy: 0.9789078648680303
Energy: 0.8934583194360519
Energy: 0.9789078648692952
Energy: 0.9744101441364774
Energy: 0.978989843440883
Energy: 0.8850442087885334
Energy: 0.9789898434383533
Energy: 0.9191604333807484
Energy: 0.9823559290702198
Energy: 0.8853405022667449
Energy: 0.9823559290689549
Energy: 0.8841522135283678
Energy: 0.8913310442692551
Energy: 1.035248628106474
Energy: 0.89133104426799

minimum gb energy = 0.8841522135283678 eV
minimum distance =  2.48604202537276 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.49844943186049
Energy: 1.1399786031562151
Energy: 1.1427259288221467
Energy: 1.0463781748477192
Energy: 0.9639015790663035
Energy: 0.9713245350768721
Energy: 0.9744689916045496
Energy: 0.9713245350754393
Energy: 0.9843508127672518
Energy: 0.9749873733105132
Energy: 1.1458954808775328
Energy: 0.9749873733105132
Energy: 0.9770085395590331
Energy: 1.0181089684347306
Energy: 0.9723073255534638
Energy: 1.0181089684347306
Energy: 0.9751899462947482
Energy: 1.0570116712915831
Energy: 1.0096700527651292
Energy: 1.0570116712915831
Energy: 0.9750504313748446
Energy: 1.0591709638936568
Energy: 0.975980246735883
Energy: 1.059170963895806
Energy: 1.0314200121615276
Energy: 0.9746928801816886
Energy: 0.9752737229195471
Energy: 0.9746928801831214
Energy: 1.029850026535277
Energy: 0.9760732953987177
Energy: 0.9655236448483532
Energy: 0.9760732954008667
Energy: 1.1472893054979296
Energy: 1.1359518783994769
Energy: 1.144814078672121
Energy: 1.1359518783980442
Energy: 1.1349663701062234
Energy: 1.0406897262305113
Energy: 0.9743798430847711
Energy: 1.0406897262283619
Energy: 1.0450587818097008
Energy: 0.9664535688609307
Energy: 0.9366577303314562
Energy: 0.9664535688580652
Energy: 1.0332460665636563
Energy: 0.9640730962103915
Energy: 0.9640166438482463
Energy: 0.964073096213257
Energy: 1.0331183471316536
Energy: 0.9640418455872937
Energy: 0.964354418121791
Energy: 0.9640418455865775
Energy: 1.0330801979151687
Energy: 0.9643924268819418
Energy: 0.9369887598498774
Energy: 0.9643924268819418
Energy: 1.1354156402443638
Energy: 1.0742092271631574
Energy: 1.028244635423821
Energy: 1.0742092271653065
Energy: 1.150035719244098
Energy: 1.0344062656548434
Energy: 1.0281983626958344
Energy: 1.0344062656562762
Energy: 1.03195072504527
Energy: 0.9727546384812409
Energy: 0.97366395432082
Energy: 0.972754638479808
Energy: 1.0355907813963188
Energy: 0.9728129563779792
Energy: 0.9723716099436699
Energy: 0.9728129563786956
Energy: 0.9729602144578139
Energy: 1.0572739374939364
Energy: 0.9758477758051709
Energy: 1.057273937494653
Energy: 1.0103433574935408
Energy: 1.0590993898196968
Energy: 0.9751183277495362
Energy: 1.059099389818264
Energy: 0.9787910583522924
Energy: 0.9670329471845953
Energy: 1.0315753082372174
Energy: 0.9670329471881773
Energy: 0.9736785825648229
Energy: 0.9761113774253192
Energy: 1.0322987580784064
Energy: 0.9761113774267519
Energy: 0.9727220365307543
Energy: 1.0193449664397118
Energy: 1.0757606280957113
Energy: 1.0193449664375627
Energy: 1.1431698979960847
Energy: 1.1343505595004104
Energy: 1.1391536878593853
Energy: 1.1343505594975452
Energy: 0.9647325679909036
Energy: 0.9640314001392434
Energy: 1.0371295338900606
Energy: 0.9640314001378106
Energy: 0.963712434942891
Energy: 0.9638198440403161
Energy: 0.9756399973762315
Energy: 0.9638198440410324
Energy: 0.9357965073300227
Energy: 0.966474330765582
Energy: 1.0311094504463227
Energy: 0.9664743307641492
Energy: 0.9649614154566996
Energy: 0.9636294804252052
Energy: 1.0328882179415906
Energy: 0.9636294804266382
Energy: 0.9645324892953925
Energy: 0.9653015317633281
Energy: 1.0359083382255883
Energy: 0.9653015317633281
Energy: 1.2336762063500404
Energy: 1.1356793046641969
Energy: 1.1401099732960778
Energy: 1.1356793046634805

minimum gb energy = 0.9357965073300227 eV
minimum distance =  2.4889218584161 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.3596192469059043
Energy: 1.0360389339008749
Energy: 1.0401577680481513
Energy: 0.8634805692195104
Energy: 1.0265278352438056
Energy: 0.915660261861282
Energy: 1.0280538392510787
Energy: 0.9156602618596327
Energy: 1.0377183615848347
Energy: 1.0281144394782866
Energy: 1.03513687321896
Energy: 1.0281144394749882
Energy: 1.0269146744579247
Energy: 0.9159957603385268
Energy: 1.0357083066505712
Energy: 0.9159957603352282
Energy: 1.0367880221968475
Energy: 0.9156180047387092
Energy: 0.8414270672177577
Energy: 0.9156180047436568
Energy: 1.0328790411991986
Energy: 0.9171495630356892
Energy: 0.8418193172287658
Energy: 0.9171495630356892
Energy: 1.1987969096758626
Energy: 1.0240407450963485
Energy: 1.027961809114939
Energy: 1.0240407450946993
Energy: 1.1968122686532134
Energy: 0.9174247078201369
Energy: 1.0234069340898917
Energy: 0.9174247078201369
Energy: 1.0245295503001535
Energy: 1.0257453028699053
Energy: 1.0439357373025087
Energy: 1.025745302861659
Energy: 1.0241033090465166
Energy: 0.9154930380624384
Energy: 1.0254965013024446
Energy: 0.9154930380607893
Energy: 1.0312659557988728
Energy: 0.915616566988832
Energy: 0.8613605605766154
Energy: 0.9156165669937798
Energy: 1.0269874088724527
Energy: 0.9160745913756371
Energy: 0.8465607842195995
Energy: 0.9160745913723385
Energy: 1.197019238006094
Energy: 0.9180207447962749
Energy: 1.022029516125709
Energy: 0.9180207447929764

minimum gb energy = 0.8414270672177577 eV
minimum distance =  2.47032290266578 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.3362877570068057
Energy: 1.1853238355579288
Energy: 1.1905137282104403
Energy: 1.0834941747858255
Energy: 0.9581299013504236
Energy: 0.9548741600261915
Energy: 1.1830367563661222
Energy: 0.9548741600243603
Energy: 0.9529500142940781
Energy: 0.9549398058611723
Energy: 1.19765713790631
Energy: 0.954939805856289
Energy: 0.9605704487540734
Energy: 0.9547859509088524
Energy: 1.2552503952290819
Energy: 0.9547859509106835
Energy: 0.9586721283677709
Energy: 0.9539358235065633
Energy: 1.243255985130376
Energy: 0.9539358235059527
Energy: 0.9535492883251918
Energy: 0.9539839740970615
Energy: 1.2435722042809187
Energy: 0.9539839740970615
Energy: 1.2717549179865673
Energy: 1.1543339708960794
Energy: 1.1754618826443883
Energy: 1.1543339708960794
Energy: 1.2430245126783501
Energy: 0.95952326578047
Energy: 1.1566762618525677
Energy: 0.9595232657798597
Energy: 1.011701949929657
Energy: 1.070321370281404
Energy: 1.0405722567438123
Energy: 1.0703213702826249
Energy: 0.9544614885848831
Energy: 1.047726570509511
Energy: 1.1588623577532446
Energy: 1.0477265705058487
Energy: 1.008195424279541
Energy: 1.0030720168588996
Energy: 1.1804167832850572
Energy: 1.0030720168558473
Energy: 1.023703534919903
Energy: 1.0089542265143165
Energy: 1.2407816702062042
Energy: 1.0089542265161477
Energy: 1.1732177505186356
Energy: 1.007690462353684
Energy: 1.0289632331073602
Energy: 1.0076904623573464
Energy: 1.2574245462751874
Energy: 1.0091866852038944
Energy: 1.011037334607214
Energy: 1.0091866852051155
Energy: 1.1560814886626152
Energy: 1.060843318869963
Energy: 1.0232076334516556
Energy: 1.060843318866301
Energy: 1.1226428636164103
Energy: 1.062992134723961
Energy: 1.0252543163252952
Energy: 1.062992134727013
Energy: 1.1585126985011625
Energy: 0.9536554353327904
Energy: 1.011667770916367
Energy: 0.9536554353346217
Energy: 1.1540571529255104
Energy: 1.1548348274005806
Energy: 1.3342238527068913
Energy: 1.1548348273999702
Energy: 1.1767906581629721
Energy: 0.9551160902121674
Energy: 0.9598182606906434
Energy: 0.9551160902115569
Energy: 1.2309737413166832
Energy: 0.9562457506435601
Energy: 0.963970365364705
Energy: 0.9562457506429497
Energy: 1.2554385393725516
Energy: 0.9544761316307143
Energy: 0.9572136245655832
Energy: 0.9544761316331558
Energy: 1.2437741242021154
Energy: 0.9530649204141346
Energy: 0.9557726021979875
Energy: 0.9530649204135241
Energy: 1.2434725922148278
Energy: 0.953963410787617
Energy: 0.9538845040131474
Energy: 0.9539634107851753
Energy: 1.1743621475596542
Energy: 1.1571877656439387
Energy: 1.1726434655261795
Energy: 1.157187765643328
Energy: 1.1578430148833057
Energy: 1.063733611198514
Energy: 1.2434857220345756
Energy: 1.0637336112009559
Energy: 1.041480639799071
Energy: 1.0573015468844604
Energy: 1.0094083144608572
Energy: 1.0573015468893436
Energy: 1.1618102166666517
Energy: 0.9548330156503256
Energy: 0.9535954845019364
Energy: 0.9548330156509361
Energy: 1.1023530894972584
Energy: 1.006897833623384
Energy: 1.0092707190882424
Energy: 1.0068978336246046
Energy: 1.2414549580297847
Energy: 1.029218323520003
Energy: 1.0073246871196109
Energy: 1.029218323521224
Energy: 1.0276924463083676
Energy: 1.0053259384483682
Energy: 1.2502775883308344
Energy: 1.0053259384489788
Energy: 1.0143836766133927
Energy: 1.0098792461452069
Energy: 1.1957142090564545
Energy: 1.0098792461507007
Energy: 1.0073711498612121
Energy: 1.0614173603016352
Energy: 1.1625971523495817
Energy: 1.061417360304077
Energy: 1.0265041079001533
Energy: 1.062235529049289
Energy: 1.1212155251381593
Energy: 1.0622355290529513
Energy: 1.009749077874223
Energy: 0.9561599965844843
Energy: 1.071421796977281
Energy: 0.9561599965857052
Energy: 1.2467168417906624
Energy: 1.1553029917001043
Energy: 1.154090388007138
Energy: 1.1553029916988835

minimum gb energy = 0.9529500142940781 eV
minimum distance =  2.48557162082088 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.258018128135863
Energy: 1.129997810184044
Energy: 1.1292939892078366
Energy: 0.9817212091666674
Energy: 0.9570210994384912
Energy: 0.9603024219438984
Energy: 1.0888013267699648
Energy: 0.9603024219438984
Energy: 0.9702971966956507
Energy: 0.9594723765732033
Energy: 1.093216396090597
Energy: 0.9594723765722348
Energy: 0.9583790983697063
Energy: 0.9579561902079836
Energy: 1.2135013491828128
Energy: 0.9579561902070152
Energy: 0.9600861066480251
Energy: 0.9583060078208894
Energy: 1.2086008862925026
Energy: 0.9583060078199209
Energy: 0.9571136725941668
Energy: 0.9567653729617941
Energy: 1.2088617094186906
Energy: 0.9567653729608256
Energy: 1.0844611817989964
Energy: 1.0843958648630188
Energy: 1.1193855275516205
Energy: 1.0843958648630188
Energy: 1.0849560848895836
Energy: 1.0313591422021124
Energy: 1.0819737434378849
Energy: 1.031359142203081
Energy: 1.085950082670081
Energy: 1.0329542231755064
Energy: 1.1039886031492945
Energy: 1.0329542231774436
Energy: 0.9565416906423463
Energy: 1.051519942890389
Energy: 1.083755750858363
Energy: 1.051519942892326
Energy: 1.0814267569239522
Energy: 1.0319642545634575
Energy: 1.0847343573678714
Energy: 1.0319642545634575
Energy: 1.117979247780841
Energy: 1.0846685771930507
Energy: 1.2023277756866457
Energy: 1.0846685771930507
Energy: 1.077639919868727
Energy: 0.9571805991528337
Energy: 0.957085763793286
Energy: 0.9571805991528337
Energy: 1.0935610820352415
Energy: 0.9595824704132512
Energy: 0.9573302290514191
Energy: 0.9595824704113143
Energy: 1.2125926215903937
Energy: 0.9791317519642698
Energy: 0.9581046511267927
Energy: 0.9791317519642698
Energy: 1.2076313746247223
Energy: 0.9585098549926651
Energy: 0.9574503036510242
Energy: 0.9585098549926651
Energy: 1.2090792668412336
Energy: 0.9578525133479738
Energy: 0.9572594644052633
Energy: 0.9578525133518476
Energy: 1.1154563957429142
Energy: 1.113520366922811
Energy: 1.0857491020731396
Energy: 1.1135203669237794
Energy: 1.0842875962847525
Energy: 1.0331968966524376
Energy: 1.0845896552862442
Energy: 1.0331968966514693
Energy: 1.1113148538814683
Energy: 1.0480879550889632
Energy: 1.0845838910122774
Energy: 1.0480879550879947
Energy: 1.0835142145243817
Energy: 1.0403480474658127
Energy: 0.962107993613142
Energy: 1.0403480474658127
Energy: 1.2025365975284252
Energy: 1.0866236234886077
Energy: 1.0840397918656026
Energy: 1.0866236234876394

minimum gb energy = 0.9565416906423463 eV
minimum distance =  2.47347626310192 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.7104072498858642
Energy: 1.1639837761348335
Energy: 1.1661251600836766
Energy: 1.0297974117096227
Energy: 0.9945973553146513
Energy: 0.9879517100336298
Energy: 1.2193696127865985
Energy: 0.9879517100384233
Energy: 0.9982667033465176
Energy: 1.0090679270525322
Energy: 1.1105916473184494
Energy: 1.0090679270463692
Energy: 0.9924837295041217
Energy: 0.9895244555145163
Energy: 1.2078250439788976
Energy: 0.9895244555145163
Energy: 0.9899960117756306
Energy: 0.9868353840244662
Energy: 1.2007333487437717
Energy: 0.9868353840203574
Energy: 1.0966422539061302
Energy: 0.9875144196133772
Energy: 1.1982235538744577
Energy: 0.987514419598996
Energy: 1.1848245566615554
Energy: 0.9887802774225252
Energy: 0.9894451788588112
Energy: 0.988780277419786
Energy: 1.2089166709680752
Energy: 0.986861694421932
Energy: 0.9870245062645748
Energy: 0.9868616944267256
Energy: 1.2176435983391931
Energy: 0.9868886070510553
Energy: 0.9877988885176628
Energy: 0.9868886070613274
Energy: 1.21910358087032
Energy: 0.9908497586146368
Energy: 0.9893381515998804
Energy: 0.990849758613952
Energy: 1.2128461554103096
Energy: 1.0610383062913364
Energy: 1.0778898520060276
Energy: 1.0610383063002389
Energy: 1.1002088872234337
Energy: 1.1015099302278009
Energy: 1.1829442355300468
Energy: 1.1015099302127351
Energy: 1.1040800383011444
Energy: 1.0642907338724705
Energy: 1.1042936488108692
Energy: 1.0642907338854821
Energy: 1.1079980510536194
Energy: 1.0639932414960904
Energy: 1.0091779078399492
Energy: 1.0639932414954056
Energy: 1.103423379973919
Energy: 1.0648753777315447
Energy: 1.0122057769760349
Energy: 1.0648753777329145
Energy: 1.184338788705547
Energy: 1.100381536255128
Energy: 1.0980454182037311
Energy: 1.1003815362434863
Energy: 1.214082634399962
Energy: 1.0613263045659942
Energy: 1.212675868400189
Energy: 1.0613263045666788
Energy: 0.9897255364237825
Energy: 1.022968023316054
Energy: 1.110363282671057
Energy: 1.0229680233146845
Energy: 0.9846924069005772
Energy: 0.987537843425699
Energy: 1.2123024721099396
Energy: 0.9875378434373407
Energy: 0.9884843364027146
Energy: 0.9869458179396337
Energy: 1.1775117684634722
Energy: 0.9869458179362096
Energy: 0.989098794620129
Energy: 0.9887842216500468
Energy: 1.2092079670070992
Energy: 0.9887842216342961
Energy: 1.1834923593129616
Energy: 0.9869680851561043
Energy: 1.0959534833564022
Energy: 0.9869680851595284
Energy: 1.18710368640857
Energy: 0.9872554882659066
Energy: 0.9900099605579366
Energy: 0.9872554882679611
Energy: 1.2079457725897285
Energy: 0.9894445612593346
Energy: 0.9918478432423206
Energy: 0.9894445612696067
Energy: 1.2170904637756326
Energy: 0.9986500703442
Energy: 1.0204199554264601
Energy: 0.998650070343515
Energy: 1.1902322341472649
Energy: 0.9877049920264049
Energy: 0.9929068831637443
Energy: 0.9877049920161327
Energy: 1.1667349310143675
Energy: 1.163695288649979
Energy: 1.4647543978060893
Energy: 1.1636952886520333
Energy: 1.0973686013036907
Energy: 1.0645137941224307
Energy: 1.0987581715689387
Energy: 1.0645137941374965
Energy: 1.1132293415203862
Energy: 1.0739610784127747
Energy: 1.103066157383815
Energy: 1.0739610784134592
Energy: 1.099208362343299
Energy: 1.0645390169051328
Energy: 1.0090610839126661
Energy: 1.0645390168969149
Energy: 1.1779471512124116
Energy: 1.0989906386707353
Energy: 1.1032255557442852
Energy: 1.0989906386508759

minimum gb energy = 0.9846924069005772 eV
minimum distance =  2.45735362400523 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9308600091198727
Energy: 1.1337090446734017
Energy: 1.0739314537014553
Energy: 0.9341268868440147
Energy: 0.9761045363088794
Energy: 1.0421033781467646
Energy: 0.9560104214414947
Energy: 1.0421033781420999
Energy: 0.9740806406155679
Energy: 1.0140860458401582
Energy: 0.9445347205069603
Energy: 1.0140860458401582
Energy: 0.9617907624663167
Energy: 0.957526112424615
Energy: 0.9746382526607201
Energy: 0.9575261124152857
Energy: 0.9641427335086621
Energy: 0.9602609410760814
Energy: 0.9585815806937138
Energy: 0.9602609410737492
Energy: 0.973414901733465
Energy: 1.0343922925624789
Energy: 0.9620696064478483
Energy: 1.0343922925601465
Energy: 0.9458581748635118
Energy: 1.0147976695775685
Energy: 0.9741572087555495
Energy: 1.014797669575236
Energy: 0.9558970801573925
Energy: 0.957406326744433
Energy: 0.9584678708313181
Energy: 0.9574063267421007
Energy: 0.9569535348433563
Energy: 0.9597772848335159
Energy: 0.9527988506974449
Energy: 0.9597772848335159

minimum gb energy = 0.9308600091198727 eV
minimum distance =  2.44581817267154 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.4911385843546485
Energy: 0.9600640500406761
Energy: 1.1216522311411348
Energy: 0.9364988799078418
Energy: 1.1371276105692105
Energy: 0.9640348403390191
Energy: 1.1178441035309008
Energy: 0.9640348403474285
Energy: 1.1132873222282331
Energy: 1.0471700105366395
Energy: 1.110533638388583
Energy: 1.0471700105321111
Energy: 1.0683849838510675
Energy: 0.9596423502596158
Energy: 1.1253133072396766
Energy: 0.9596423502634971
Energy: 1.0887907807881585
Energy: 0.9600933982778423
Energy: 1.0593328837398492
Energy: 0.9600933982746078
Energy: 0.9623697485533468
Energy: 0.9623879294603501
Energy: 1.059496560793772
Energy: 0.9623879294506468
Energy: 0.9595283943274886
Energy: 0.9587007063876792
Energy: 1.1320251391842109
Energy: 0.9587007063773292
Energy: 0.983468355873725
Energy: 0.9665017898620335
Energy: 1.1765761775798176
Energy: 0.966501789876265
Energy: 1.1133592644786747
Energy: 0.9844014268390527
Energy: 1.1606157088167963
Energy: 0.9844014268371121
Energy: 1.2724894884824307
Energy: 0.9398875421860783
Energy: 0.9429301044626442
Energy: 0.9398875421796095
Energy: 1.1086852061125676
Energy: 0.9352624192965157
Energy: 0.9370131164315604
Energy: 0.9352624192932811
Energy: 1.162973378446805
Energy: 0.9424078908301722
Energy: 0.9423070767431945
Energy: 0.9424078908321128
Energy: 1.1675991903818115
Energy: 0.9369664324726794
Energy: 1.0508244474852515
Energy: 0.9369664324668575
Energy: 1.1033592529861886
Energy: 0.9221743943345493
Energy: 1.1720986332007761
Energy: 0.9221743943371369
Energy: 1.0088370840889087
Energy: 0.9189328142086721
Energy: 1.1728186069851005
Energy: 0.9189328142054377
Energy: 1.0069563793935807
Energy: 0.9217653039262763
Energy: 1.0770828949635645
Energy: 0.9217653039269232
Energy: 0.9975492907044786
Energy: 0.9187659730167588
Energy: 0.9806740250282197
Energy: 0.9187659730180525
Energy: 1.1285412896959048
Energy: 0.9227187435714197
Energy: 1.0867151332824154
Energy: 0.9227187435681854
Energy: 1.1185949112262008
Energy: 1.0094322998775447
Energy: 1.0226189284148315
Energy: 1.0094322998762508
Energy: 1.118535584791878
Energy: 1.0726802217708953
Energy: 1.0690329921720556
Energy: 1.072680221772189
Energy: 1.0715341509870493
Energy: 0.9900790460967673
Energy: 0.9874121504479002
Energy: 0.9900790460831828
Energy: 1.0603094758218963
Energy: 0.9648657171019653
Energy: 0.9663741423877774
Energy: 0.964865717093556
Energy: 1.1587682871456029
Energy: 0.9652704847808067
Energy: 0.9700547465723214
Energy: 0.9652704847833943
Energy: 1.1712599716445167
Energy: 0.9710253361442852
Energy: 0.9871061423097416
Energy: 0.9710253361462258
Energy: 1.1656502392128536
Energy: 1.0403997313968822
Energy: 1.0558823346730133
Energy: 1.040399731392354
Energy: 0.9356817261527647
Energy: 0.9343478687022398
Energy: 1.2730340189555944
Energy: 0.9343478687093557
Energy: 0.9317959793921218
Energy: 0.9294466322677365
Energy: 1.0641651728539132
Energy: 0.9294466322722647
Energy: 0.9338166657687942
Energy: 0.9323759783373259
Energy: 1.0357607946982645
Energy: 0.9323759783509105
Energy: 1.005716962212968
Energy: 0.9307012607031618
Energy: 1.1669911801937585
Energy: 0.9307012607057492
Energy: 1.1684256072195205
Energy: 0.980865694620124
Energy: 1.0784097377386022
Energy: 0.9808656946175365
Energy: 1.1725926723676887
Energy: 0.9604160069291188
Energy: 0.9696678539841196
Energy: 0.9604160069317064
Energy: 1.1333504699559687
Energy: 0.9604437614071003
Energy: 0.9700874834211205
Energy: 0.9604437614000435
Energy: 0.9716932092611802
Energy: 0.9576313525386555
Energy: 0.9580072281172171
Energy: 0.957631352536068

minimum gb energy = 0.9187659730167588 eV
minimum distance =  2.41483934721205 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.4759843372467947
Energy: 0.9036399236858673
Energy: 1.084509537563886
Energy: 0.86321390755424
Energy: 0.9161221551420636
Energy: 0.908262588728283
Energy: 1.1051900311748142
Energy: 0.9082625887255997
Energy: 1.1064778351288571
Energy: 1.0147141639839012
Energy: 1.1048224568010676
Energy: 1.0147141639740627
Energy: 0.9336451255340011
Energy: 0.9078412510052996
Energy: 1.0858171481547785
Energy: 0.9078412510061938
Energy: 1.0823848599887216
Energy: 0.9011352228585504
Energy: 1.097317649188535
Energy: 0.9011352228621281
Energy: 0.9015950862749615
Energy: 0.901023969372434
Energy: 1.0981715104446086
Energy: 0.9010239693688563
Energy: 0.9013404513940958
Energy: 0.9024685655232123
Energy: 1.15976566868934
Energy: 0.9024685655187401
Energy: 0.922150654230158
Energy: 0.9088994005561831
Energy: 1.2274149842244118
Energy: 0.9088994005579719
Energy: 1.1117596372844032
Energy: 0.9395494874321826
Energy: 1.2259962002184783
Energy: 0.9395494874259217
Energy: 1.0965931535518172
Energy: 0.9109270913568049
Energy: 0.9291668309472565
Energy: 0.910927091352333
Energy: 1.0866794912849314
Energy: 0.9017510167097558
Energy: 0.8995586743401249
Energy: 0.9017510167079669
Energy: 1.2219819732392452
Energy: 0.9186077111644976
Energy: 0.9042683555607448
Energy: 0.9186077111618142
Energy: 1.2217733045410255
Energy: 0.9017257032249378
Energy: 0.9009830082210137
Energy: 0.9017257032347764
Energy: 1.1592307723171087
Energy: 0.905875224993903
Energy: 1.1018124750351024
Energy: 0.9058752249867477
Energy: 0.9383465259155389
Energy: 1.0134016959097616
Energy: 1.1035640307245174
Energy: 1.013401695902606
Energy: 0.9312320400295211
Energy: 0.9062500217834564
Energy: 1.1165718715724886
Energy: 0.9062500217834564
Energy: 0.9057960732034679
Energy: 0.9017649022394414
Energy: 1.0995206349776696
Energy: 0.9017649022483857
Energy: 0.9236979782659347
Energy: 0.9110122246138694
Energy: 1.1088110089422942
Energy: 0.911012224611186
Energy: 0.9007989646909098
Energy: 0.9020027550844071
Energy: 1.2383056470423979
Energy: 0.9020027550879848
Energy: 0.9095066795373532
Energy: 0.9072318131465349
Energy: 1.2266205048593866
Energy: 0.9072318131402739
Energy: 1.096580370679341
Energy: 0.9383683779105751
Energy: 1.1152600517812612
Energy: 0.9383683779087864
Energy: 1.098179165649238
Energy: 0.9068115984958383
Energy: 0.9154741485182847
Energy: 0.9068115984922606
Energy: 1.1591636229760927
Energy: 0.901499609877796
Energy: 0.9046136739276203
Energy: 0.9014996098751127
Energy: 1.2223949272141144
Energy: 0.9020775928522166
Energy: 0.9013573785568441
Energy: 0.902077592857583

minimum gb energy = 0.86321390755424 eV
minimum distance =  2.41885611380249 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.600338727936157
Energy: 0.9056973341507288
Energy: 1.0959854180774613
Energy: 0.8788522829487678
Energy: 0.9282573073373745
Energy: 0.9047737817438302
Energy: 1.0324722833548863
Energy: 0.9047737817410159
Energy: 1.11493182058912
Energy: 0.9017437239304957
Energy: 1.028907143940068
Energy: 0.9017437240167367
Energy: 1.1292447421344598
Energy: 0.9542583440756647
Energy: 1.016042892831286
Energy: 0.9542583440767703
Energy: 0.9954897403327788
Energy: 0.8800241505114609
Energy: 1.1245488856196515
Energy: 0.8800241505114609
Energy: 0.8797086472756462
Energy: 0.8799736477799469
Energy: 1.147457597436797
Energy: 0.8799736477788415
Energy: 0.8830057843608333
Energy: 0.879783673859094
Energy: 0.9277039004992097
Energy: 0.879783673859094
Energy: 0.8899619672907978
Energy: 0.8832872799366164
Energy: 1.137455428367599
Energy: 0.8832872799344051
Energy: 1.1372132952313
Energy: 0.8838807653917233
Energy: 1.113537697967493
Energy: 0.8838807653900145
Energy: 1.0598030803624914
Energy: 0.9591726852083924
Energy: 1.0406873462759012
Energy: 0.9591726852100005
Energy: 1.1317120706374746
Energy: 0.9024038275322401
Energy: 0.921712513559089
Energy: 0.9024038275327428
Energy: 1.1438239601022375
Energy: 0.910915921934212
Energy: 1.0182311388620964
Energy: 0.910915921934212
Energy: 1.1464389570468732
Energy: 0.9015771282640086
Energy: 0.9018995117146303
Energy: 0.9015771282645112
Energy: 1.0356468453627163
Energy: 0.9019608116118003
Energy: 0.9059723388443399
Energy: 0.9019608116146145
Energy: 1.123494268065077
Energy: 0.9035232822782739
Energy: 0.9200625780363038
Energy: 0.9035232822804852
Energy: 1.138428589029475
Energy: 0.9241149921081874
Energy: 1.038758188410426
Energy: 0.9241149921148215
Energy: 0.9012906430937363
Energy: 0.9101129923633722
Energy: 1.1270721356965996
Energy: 0.9101129923633722
Energy: 0.9032478710516788
Energy: 0.9011865357288673
Energy: 1.1366154474890513
Energy: 0.901186535729973
Energy: 0.9374450063758656
Energy: 0.9106580764645268
Energy: 1.1098142117089593
Energy: 0.9106580764650293
Energy: 0.9037394053284273
Energy: 0.901693515841347
Energy: 1.1370829899751511
Energy: 0.9016935158375275
Energy: 1.0277069575232398
Energy: 0.9033670929112663
Energy: 0.9031040174587383
Energy: 0.9033670929101606
Energy: 1.0290844921690467
Energy: 0.9010948335589282
Energy: 1.118168831128215
Energy: 0.9010948335578226
Energy: 0.9272917830901056
Energy: 0.9519122839909996
Energy: 1.1228616149669188
Energy: 0.9519122839882856
Energy: 1.170508872221559
Energy: 0.8811097223670347
Energy: 0.994576375156718
Energy: 0.8811097223676376
Energy: 1.1461174603714597
Energy: 0.8792195400988425
Energy: 0.878128128411849
Energy: 0.8792195401005513
Energy: 0.9303909825466175
Energy: 0.8807041737915838
Energy: 0.8874330806744023
Energy: 0.880704173790478
Energy: 1.1380155349244583
Energy: 0.8806282713972406
Energy: 0.8804116016739386
Energy: 0.880628271396135
Energy: 1.1092996829102453
Energy: 0.8816097225033072
Energy: 1.1442337051632037
Energy: 0.8816097225044128
Energy: 1.0343995266158075
Energy: 0.9550972513085485
Energy: 1.0559301661826173
Energy: 0.955097251309654
Energy: 0.9236274602620631
Energy: 0.9020692580095073
Energy: 1.1281472312311598
Energy: 0.9020692580066928
Energy: 1.0163353070559928
Energy: 0.9019241992942365
Energy: 1.1445738208231897
Energy: 0.9019241992953421
Energy: 0.9008255648036108
Energy: 0.9021573461228561
Energy: 1.1469665996965663
Energy: 0.9021573461211474
Energy: 0.9025536698026804
Energy: 0.9012925216932896
Energy: 1.0365175972824192
Energy: 0.9012925216921839
Energy: 0.9270936727107215
Energy: 0.9058881945682153
Energy: 1.1092103630689765
Energy: 0.9058881945676124
Energy: 1.037757600671649
Energy: 0.9232576668474632
Energy: 1.1372195065215631
Energy: 0.923257666845252
Energy: 1.1397836256619636
Energy: 0.9123569809588058
Energy: 0.9275043084493497
Energy: 0.9123569809605145
Energy: 1.1321411684004061
Energy: 0.9010923347499207
Energy: 0.9019503897467307
Energy: 0.9010923347510261
Energy: 1.1139424407237297
Energy: 0.9104202402477324
Energy: 0.9047365566261978
Energy: 0.9104202402488382

minimum gb energy = 0.878128128411849 eV
minimum distance =  2.41468117744595 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.7085397984920032
Energy: 0.819129825766344
Energy: 0.8179720883873
Energy: 0.8691400495800603
Energy: 0.8195090536926907
Energy: 0.9018495848875774
Energy: 0.8149146402735755
Energy: 0.9018495848890239
Energy: 0.8076955313650894
Energy: 0.9035961171446873
Energy: 0.8464410082754178
Energy: 0.9035961171446873
Energy: 0.8111886286940496
Energy: 0.9087184909031323
Energy: 0.8174630005737163
Energy: 0.9087184909031323
Energy: 0.8171112530101484
Energy: 0.8161666855694052
Energy: 0.839607145730759
Energy: 0.8161666855679587
Energy: 0.8170081351282463
Energy: 0.8158007551104614
Energy: 0.8391912675685628
Energy: 0.8158007551104614
Energy: 0.8164404517695485
Energy: 0.8163005514979255
Energy: 0.8186858730238862
Energy: 0.8163005514979255
Energy: 0.8150445442920866
Energy: 0.8204000945833082
Energy: 0.8075909407097263
Energy: 0.8204000945818617
Energy: 0.8194115590473603
Energy: 0.8171535265244847
Energy: 0.8076516885155663
Energy: 0.8171535265230382
Energy: 0.8458775808189642
Energy: 0.9124391499329362
Energy: 0.819948693912494
Energy: 0.9124391499343826
Energy: 0.819859575254012
Energy: 0.8884897687527911
Energy: 0.8076341668459167
Energy: 0.8884897687527911
Energy: 0.8386478492526525
Energy: 0.8151827667632552
Energy: 0.8195350145207052
Energy: 0.8151827667632552
Energy: 0.8390390079453037
Energy: 0.8187871735212577
Energy: 0.8389630315391596
Energy: 0.8187871735227042
Energy: 0.8173829212523538
Energy: 0.8158913643782556
Energy: 0.8164936295258455
Energy: 0.8158913643782556
Energy: 0.8077248794433838
Energy: 0.8174235945759212
Energy: 0.8189247521393207
Energy: 0.8174235945744747

minimum gb energy = 0.8075909407097263 eV
minimum distance =  2.4525202866803 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.6008163695521402
Energy: 0.8078062064676815
Energy: 1.0366272700198271
Energy: 0.7998285886333469
Energy: 0.9295155179877063
Energy: 0.8033292808679249
Energy: 0.942889955206401
Energy: 0.8033292808842943
Energy: 0.9484505404738649
Energy: 0.8019896461051269
Energy: 0.9572302165782324
Energy: 0.8019896461099771
Energy: 1.0222030767247992
Energy: 0.8050178335496283
Energy: 0.9361520750018493
Energy: 0.8050178335520534
Energy: 1.076968525117589
Energy: 0.9299414415133854
Energy: 0.892291264523183
Energy: 0.9299414415158106
Energy: 0.9568491792720848
Energy: 0.805493744476158
Energy: 0.8925196304784198
Energy: 0.8054937444725203
Energy: 0.9546431532954295
Energy: 0.8055010014939507
Energy: 0.9314594769526967
Energy: 0.8055010014933444
Energy: 0.9103127026814571
Energy: 0.8086758341529584
Energy: 0.9830923150270018
Energy: 0.8086758341468958
Energy: 0.8047975437183579
Energy: 0.8130746721086861
Energy: 0.9010662229056907
Energy: 0.8130746721032296
Energy: 0.8100291301356781
Energy: 0.8046123180368219
Energy: 1.079183900312122
Energy: 0.804612318037428
Energy: 0.8081769941386043
Energy: 0.8058218219972793
Energy: 1.6016588853299762
Energy: 0.8058218219748472
Energy: 0.8306250238395164
Energy: 0.8041992565035873
Energy: 0.9345167430740239
Energy: 0.8041992565035873
Energy: 0.8322237319506717
Energy: 0.9267124448569162
Energy: 0.9297124259081748
Energy: 0.9267124448635852
Energy: 1.0180356423438353
Energy: 0.9260869082725185
Energy: 1.019444117997481
Energy: 0.9260869082719121
Energy: 0.9835329556401977
Energy: 0.7881972153329889
Energy: 0.9310586127004601
Energy: 0.7881972153269261
Energy: 0.9832959606679886
Energy: 0.7857907889811961
Energy: 0.8650983280849085
Energy: 0.7857907889775585
Energy: 1.0838172869416507
Energy: 0.7846212529714889
Energy: 0.8624405272810901
Energy: 0.7846212529708826
Energy: 0.8366694751989207
Energy: 0.7870190336254815
Energy: 0.8543655088291826
Energy: 0.787019033621844
Energy: 1.0396130899296554
Energy: 0.7892556630395153
Energy: 0.9774806741134247
Energy: 0.7892556630431529
Energy: 0.8051532262139627
Energy: 0.7855823411890045
Energy: 1.0195026215655931
Energy: 0.785582341192642
Energy: 1.2146069600787721
Energy: 0.7858660094312733
Energy: 0.9811697296094141
Energy: 0.7858660094300607
Energy: 0.8053470660193219
Energy: 0.9289548399602279
Energy: 0.8923297368488724
Energy: 0.9289548399511338
Energy: 0.8251104186256426
Energy: 0.8052598563790775
Energy: 0.8925851269900881
Energy: 0.8052598563899902
Energy: 0.8849444053435094
Energy: 0.9147222320763214
Energy: 0.9360154742654361
Energy: 0.9147222320866281
Energy: 0.879833289418353
Energy: 0.8048598944893869
Energy: 0.9835087184550748
Energy: 0.8048598944863555
Energy: 0.8057859995665828
Energy: 0.80526444415648
Energy: 0.9823013275121301
Energy: 0.8052644441589052
Energy: 0.8041406103697937
Energy: 0.8035635717369021
Energy: 0.9368119317542968
Energy: 0.8035635717308395
Energy: 0.8286899619262956
Energy: 0.8133541827083091
Energy: 0.971628562215091
Energy: 0.8133541827089152
Energy: 0.9296589336216358
Energy: 0.8088476164372413
Energy: 1.0345919900352545
Energy: 0.8088476164148092
Energy: 1.0410010871237207
Energy: 0.852465098094746
Energy: 1.0659258449919733
Energy: 0.8524650980953522
Energy: 1.0696054129018515
Energy: 0.8469427499783316
Energy: 1.2152503370478744
Energy: 0.8469427499971262
Energy: 0.983112930255578
Energy: 0.8026042463164076
Energy: 1.0651706939615897
Energy: 0.8026042463290842
Energy: 0.9833092922873115
Energy: 0.8049158828756856
Energy: 0.8129871656593259
Energy: 0.8049158828817483
Energy: 1.0728970486520226
Energy: 0.8007411834942987
Energy: 0.8007512612086588
Energy: 0.8007411834967239
Energy: 1.018303190293659
Energy: 0.8015959987501874
Energy: 0.8088715114695464
Energy: 0.8015959987544314

minimum gb energy = 0.7846212529708826 eV
minimum distance =  2.44245299407564 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.2815124353676886
Energy: 0.7337376948540603
Energy: 0.7314352017639836
Energy: 0.736205512077382
Energy: 0.9521398996141381
Energy: 0.732546231264599
Energy: 0.9528178891144667
Energy: 0.732546231262513
Energy: 1.1677382140684178
Energy: 0.7329781259116595
Energy: 0.960111434092044
Energy: 0.7329781259095733
Energy: 1.1674049534144975
Energy: 0.8180143765786824
Energy: 0.9521383889581684
Energy: 0.8180143765786824
Energy: 1.1851810016973723
Energy: 0.8194349960934763
Energy: 0.9560909683972667
Energy: 0.8194349960955623
Energy: 0.8797274086032152
Energy: 0.7317995698927063
Energy: 0.9521743938152316
Energy: 0.7317995698916634
Energy: 0.7266383196376814
Energy: 0.732206833693339
Energy: 1.187731193863459
Energy: 0.732206833693339
Energy: 0.7475195178912051
Energy: 0.7320820084778142
Energy: 0.9460814948772223
Energy: 0.7320820084767712
Energy: 0.7317979934450585
Energy: 0.7344279671252497
Energy: 0.9469742108287303
Energy: 0.7344279671231635
Energy: 0.7312889427642869
Energy: 0.7343650147638806
Energy: 0.8591270996908317
Energy: 0.7343650147628374
Energy: 0.7314352017848449
Energy: 0.736205512076339
Energy: 1.2815124353666454
Energy: 0.733737695111604
Energy: 0.9528178891134237
Energy: 0.732546231262513
Energy: 1.0958760237749892
Energy: 0.732546231265642
Energy: 0.960111434092044
Energy: 0.7329781259074871
Energy: 1.1677382140673749
Energy: 0.7329781259095733
Energy: 0.9521383889581684
Energy: 0.8180143765797255
Energy: 1.1674049534155404
Energy: 0.8180143765786824
Energy: 0.9560909683993528
Energy: 0.8194349960934763
Energy: 1.1851810016952864
Energy: 0.8194349960924332
Energy: 0.8561336336133831
Energy: 0.7317995698916634
Energy: 0.9629944994892728
Energy: 0.7317995698927063
Energy: 1.1877311938645023
Energy: 0.732206833693339
Energy: 0.7266383196376814
Energy: 0.7322068336954253
Energy: 0.9460814948605332
Energy: 0.7320820084778142
Energy: 0.7475195178932912
Energy: 0.7320820084788573
Energy: 0.9469742108433333
Energy: 0.7344279671210774
Energy: 0.7317979934440154
Energy: 0.7344279671210774
Energy: 1.1905611920955195
Energy: 0.7343650147638806
Energy: 0.7312889427642869
Energy: 0.7343650147638806

minimum gb energy = 0.7266383196376814 eV
minimum distance =  2.46374345885627 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.5763859183347708
Energy: 0.6732209121472763
Energy: 0.9402848735006011
Energy: 0.683938673681643
Energy: 1.2003529338295462
Energy: 0.6712949739250469
Energy: 0.8556246505891502
Energy: 0.6712949739250469
Energy: 1.3573963091987071
Energy: 0.6709200037950236
Energy: 0.86043495262778
Energy: 0.6709200037909511
Energy: 1.072116279355683
Energy: 0.6725219053809831
Energy: 1.0604666649807117
Energy: 0.6725219053834266
Energy: 1.0612094635639941
Energy: 0.7416370156517403
Energy: 1.1993981902702773
Energy: 0.7416370156509258
Energy: 1.0367000758567355
Energy: 0.7389778824546138
Energy: 1.2018244342640323
Energy: 0.7389778824546138
Energy: 1.042190131294507
Energy: 0.7409442282096478
Energy: 1.061930011961597
Energy: 0.7409442282112768
Energy: 1.0606451830042172
Energy: 0.6723781301038835
Energy: 1.1960438184516764
Energy: 0.6723781301030689
Energy: 0.8597941032690392
Energy: 0.6712627335852681
Energy: 1.1993372166342964
Energy: 0.6712627335852681
Energy: 0.8620846748030458
Energy: 0.6714381964294076
Energy: 1.200244786332864
Energy: 0.6714381964277787
Energy: 0.6732022137405049
Energy: 0.6756969471419836
Energy: 1.3254309467713867
Energy: 0.6756969471403546
Energy: 0.6786803624712839
Energy: 0.6725296992866462
Energy: 1.200411543004347
Energy: 0.6725296992858317
Energy: 0.6753053451040667
Energy: 0.6715275867286092
Energy: 1.042699739882981
Energy: 0.6715275867286092
Energy: 0.8552741900518293
Energy: 0.676243200670051
Energy: 1.3487856487286918
Energy: 0.6762432006733089
Energy: 0.8600580320122702
Energy: 0.6709833763588313
Energy: 1.0632113814790003
Energy: 0.6709833763596458
Energy: 0.8632787938098564
Energy: 0.6716786540940192
Energy: 1.3504847729550085
Energy: 0.6716786540940192
Energy: 1.0640813271675718
Energy: 0.6715352387369364
Energy: 1.350484343252579
Energy: 0.671535238736122
Energy: 0.8579961131260728
Energy: 0.7440450761596722
Energy: 1.0616198872280465
Energy: 0.7440450761596722
Energy: 1.1985898034160045
Energy: 0.7396664284204794
Energy: 1.0402082787489824
Energy: 0.7396664284693495
Energy: 1.2002907282650137
Energy: 0.7390897432067957
Energy: 1.0372737205406475
Energy: 0.7390897432051666
Energy: 1.3273508339310296
Energy: 0.6718742346617108
Energy: 0.8551043989883277
Energy: 0.6718742346625254
Energy: 1.2004383505348246
Energy: 0.670505195880635
Energy: 0.6721547351755698
Energy: 0.670505195880635
Energy: 1.19619620349984
Energy: 0.6732805316546907
Energy: 0.8550302359136169
Energy: 0.6732805316563196
Energy: 1.1950658208880556
Energy: 0.6721017151209424
Energy: 0.6730394349127572
Energy: 0.6721017151233859
Energy: 1.0636426410922213
Energy: 0.6715683214472665
Energy: 0.6723027736192296
Energy: 0.6715683214472665
Energy: 1.3484184989158507
Energy: 0.6732892365499121
Energy: 0.6805644186151097
Energy: 0.6732892365490977

minimum gb energy = 0.670505195880635 eV
minimum distance =  2.46838881168619 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.7693511617046662
Energy: 0.6282926670220914
Energy: 0.9076055471468238
Energy: 0.6416399134304931
Energy: 1.2250596076807498
Energy: 0.6244299416066574
Energy: 0.778640631796589
Energy: 0.6244299416026509
Energy: 1.2081425785170194
Energy: 0.623159413472019
Energy: 0.7827778172533202
Energy: 0.6231594134726868
Energy: 1.207903869743057
Energy: 0.6259059177405962
Energy: 0.9611535040922695
Energy: 0.625905917738593
Energy: 1.2220734115214036
Energy: 0.6238052378098268
Energy: 1.07803395094637
Energy: 0.6238052378191753
Energy: 1.2124709364203796
Energy: 0.7738431200564667
Energy: 1.07398319441728
Energy: 0.773843120055799
Energy: 1.218108019641108
Energy: 0.7764452949281518
Energy: 1.221815447005876
Energy: 0.7764452949294873
Energy: 1.0747688414650094
Energy: 0.6803017277966106
Energy: 1.0795179913353703
Energy: 0.6803017273640855
Energy: 0.9344136713117362
Energy: 0.6235206914127908
Energy: 1.346158791499379
Energy: 0.6235206914154617
Energy: 0.9342961756309056
Energy: 0.6236251261374064
Energy: 1.2236205795052177
Energy: 0.6236251261380743
Energy: 0.7789380417067268
Energy: 0.6259286416523889
Energy: 1.2193967477460659
Energy: 0.6259286416483824
Energy: 0.7811391138332487
Energy: 0.6224702609048833
Energy: 1.2248182310436246
Energy: 0.6224702609035478
Energy: 0.7802849465198579
Energy: 0.6257917653019394
Energy: 1.3428586997779595
Energy: 0.6257917653012716
Energy: 0.6239436776121539
Energy: 0.6260668668598133
Energy: 1.2189070156640762
Energy: 0.6260668668611488
Energy: 0.6257260103167753
Energy: 0.6235705483624442
Energy: 1.2213356530992059
Energy: 0.6235705483617764
Energy: 0.6335603038023124
Energy: 0.6254981385517986
Energy: 1.208735836194891
Energy: 0.6254981385511308
Energy: 0.7783366459485928
Energy: 0.6273814727096635
Energy: 1.2079795582886652
Energy: 0.6273814727143378
Energy: 0.7859054083069192
Energy: 0.6234578173431716
Energy: 1.2210256830913655
Energy: 0.623457817353188
Energy: 0.782403346847707
Energy: 0.6242434822761924
Energy: 1.2155947404013445
Energy: 0.6242434822788634
Energy: 1.076420368048116
Energy: 0.6273072308775672
Energy: 1.2117407539343772
Energy: 0.6273072308775672
Energy: 1.0901022540138616
Energy: 0.6243323049044376
Energy: 1.2227532307748596
Energy: 0.6243323049091118
Energy: 1.077732584225461
Energy: 0.6256452042753828
Energy: 1.2075591194962654
Energy: 0.6256452042733797
Energy: 1.3464384139445227
Energy: 0.8838760826680873
Energy: 1.2095105292869288
Energy: 0.8838760826640808
Energy: 1.0812976126449556
Energy: 0.7744355418508878
Energy: 1.0793016764667676
Energy: 0.7744355418542266
Energy: 1.2242617203675468
Energy: 0.6241184231461199
Energy: 0.9462909887576922
Energy: 0.6241184231554685
Energy: 1.350659897731625
Energy: 0.6261441974569689
Energy: 1.0753845647670288
Energy: 0.6261441974583045
Energy: 1.218045195313451
Energy: 0.6244840593223935
Energy: 0.7825818764921325
Energy: 0.6244840593223935
Energy: 1.2204703948477025
Energy: 0.6229147139062832
Energy: 0.7841373578856663
Energy: 0.6229147139102896
Energy: 1.219179599387561
Energy: 0.6267482042291738
Energy: 0.7917720490515447
Energy: 0.6267482042272311
Energy: 1.34999428546047
Energy: 0.6258933870025134
Energy: 0.6352875841720768
Energy: 0.625893387003849
Energy: 1.2210641002854867
Energy: 0.6239486225223599
Energy: 0.6232653437256243
Energy: 0.6239486225216923
Energy: 1.208372477008901
Energy: 0.6248629752381452
Energy: 0.6248742579139254
Energy: 0.6248629752408161

minimum gb energy = 0.6224702609035478 eV
minimum distance =  2.4699305019731 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.5191559924141425
Energy: 0.5892184659456235
Energy: 0.8788273656925788
Energy: 0.6075540317077408
Energy: 1.3463459118442973
Energy: 0.586876824397531
Energy: 0.7300504912755189
Energy: 0.586876824397531
Energy: 1.348684804435157
Energy: 0.588379725166891
Energy: 0.7256548790989797
Energy: 0.5883797251657596
Energy: 1.3314082846945434
Energy: 0.585420228838577
Energy: 0.9904861053522125
Energy: 0.5854202288380115
Energy: 1.344668944491085
Energy: 0.5915269998421342
Energy: 0.9787853356581744
Energy: 0.5915269998415686
Energy: 1.3402642079818967
Energy: 0.5911741436303117
Energy: 0.9767814352619608
Energy: 0.5911741436258376
Energy: 1.1004805355013318
Energy: 0.5887006802563279
Energy: 1.2200817296182072
Energy: 0.588700680254631
Energy: 1.2271001577270388
Energy: 0.6374748937704862
Energy: 0.9803578536937662
Energy: 0.6374748937738803
Energy: 1.097569412355484
Energy: 0.8353039640588273
Energy: 1.21588369819844
Energy: 0.8353039640593416
Energy: 1.0959821489117134
Energy: 0.8338240115282585
Energy: 1.4503097417199542
Energy: 0.8338240115271272
Energy: 0.9912284930314184
Energy: 0.585370548221848
Energy: 1.2139241663523843
Energy: 0.5853705482167568
Energy: 0.8562388121372656
Energy: 0.59156807252553
Energy: 1.4501814488467495
Energy: 0.5915680725249642
Energy: 0.9774366920135497
Energy: 0.5926113964736468
Energy: 1.454427901443538
Energy: 0.5926113964725154
Energy: 0.7339820103573719
Energy: 0.5859985433376519
Energy: 1.225789211785859
Energy: 0.5859985433382177
Energy: 0.7210451664168629
Energy: 0.586501011717025
Energy: 1.3449256409296813
Energy: 0.5865010117175907
Energy: 0.7263982948662052
Energy: 0.5861889855390001
Energy: 1.3453412690974837
Energy: 0.5861889855373031
Energy: 0.5980639337144996
Energy: 0.5882021807636363
Energy: 1.3371168784997607
Energy: 0.5882021807619392
Energy: 0.5848285856594512
Energy: 0.5837738537575777
Energy: 1.3439415436710214
Energy: 0.5837738537564463
Energy: 0.6011336615720698
Energy: 0.5873802780553325
Energy: 1.3447356466926874
Energy: 0.5873802780553325
Energy: 0.7285096875492052
Energy: 0.5864864840805493
Energy: 1.3316270032391917
Energy: 0.5864864840822464
Energy: 0.7198566709456057
Energy: 0.584452684993504
Energy: 1.344227688400255
Energy: 0.5844526849940695
Energy: 0.7322433553142084
Energy: 0.586501279888113
Energy: 1.3314151927480917
Energy: 0.5865012798858501
Energy: 0.9781247278545045
Energy: 0.5935259414937619
Energy: 1.336520356096942
Energy: 0.5935259414858423
Energy: 0.9789778804835859
Energy: 0.5841173887182489
Energy: 1.3450127701694488
Energy: 0.5841173887182489
Energy: 0.9877802080748047
Energy: 0.5856811805622344
Energy: 1.1050067767298617
Energy: 0.585681180557709
Energy: 1.2194229807310177
Energy: 0.8331418679375019
Energy: 1.3482827461608835
Energy: 0.8331418679386333
Energy: 0.976383072038204
Energy: 0.8303005836310424
Energy: 1.2167563722988382
Energy: 0.8303005836332537
Energy: 1.22548141061559
Energy: 0.6373617612761421
Energy: 1.104593318786492
Energy: 0.6373617612784049
Energy: 1.2216747701677415
Energy: 0.586699749012496
Energy: 1.2170317986755381
Energy: 0.5866997490006682
Energy: 1.217366173201706
Energy: 0.5883440192483992
Energy: 0.9771063335244621
Energy: 0.5883440192489648
Energy: 1.3433520153858691
Energy: 0.5913508714534217
Energy: 0.8565492715567364
Energy: 0.5913508714573816
Energy: 1.2253038592088994
Energy: 0.5859056112630756
Energy: 0.9893257005539341
Energy: 0.5859056112625101
Energy: 1.3432055138523422
Energy: 0.5843200190157821
Energy: 0.7238102470268111
Energy: 0.5843200190197418
Energy: 1.3446977166191671
Energy: 0.5864641548966779
Energy: 0.723903600933004
Energy: 0.5864641548961123
Energy: 1.3426653488161955
Energy: 0.5884955899636257
Energy: 0.6121087353230893
Energy: 0.5884955899675854
Energy: 1.34437535429688
Energy: 0.5861056010841454
Energy: 0.5914296638559461
Energy: 0.5861056010847111
Energy: 1.3323589223892198
Energy: 0.5865142362227622
Energy: 0.5887989813338118
Energy: 0.5865142362238936

minimum gb energy = 0.5837738537564463 eV
minimum distance =  2.47622004193579 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.6371781899899518
Energy: 0.5320842120151721
Energy: 0.5327951023019014
Energy: 0.5687123618585348
Energy: 1.413447108939964
Energy: 0.531916394708391
Energy: 0.6615780150315761
Energy: 0.5319163947093722
Energy: 1.4052231199485132
Energy: 0.5313186705121714
Energy: 0.656360849752401
Energy: 0.5313186705151154
Energy: 1.190361062446529
Energy: 0.5315481880266643
Energy: 0.875078054638322
Energy: 0.5315481880276455
Energy: 1.412508236613808
Energy: 0.5332541347111572
Energy: 0.8768158983129148
Energy: 0.5332541347111572
Energy: 1.1932374789926745
Energy: 0.5305360052420542
Energy: 0.8781474223670643
Energy: 0.5305360052396012
Energy: 1.1909598492568265
Energy: 0.5305407134266862
Energy: 1.088748834261523
Energy: 0.5305407134222706
Energy: 1.3008552828634286
Energy: 0.5306891815592688
Energy: 0.8759569263830356
Energy: 0.5306891815529354
Energy: 1.1929883447619467
Energy: 0.5334843823655837
Energy: 1.0900560820327894
Energy: 0.533484382348412
Energy: 1.1983939175859526
Energy: 0.7748548820264026
Energy: 1.2998623440073742
Energy: 0.7748548820264026
Energy: 1.0889505872179543
Energy: 0.6121912284078714
Energy: 1.0861156599372177
Energy: 0.6121912284108151
Energy: 0.9858995644692434
Energy: 0.5307388739402321
Energy: 1.300610978416884
Energy: 0.5307388739436664
Energy: 1.0883681153136038
Energy: 0.5304436879995014
Energy: 1.2993608678413562
Energy: 0.53044368799852
Energy: 0.8757515478365294
Energy: 0.5309673020681208
Energy: 1.0852451048061438
Energy: 0.5309673020637052
Energy: 0.7627142516841288
Energy: 0.5307085849351021
Energy: 1.4113231061250087
Energy: 0.5307085849331397
Energy: 0.8756212096404388
Energy: 0.5330811502386047
Energy: 1.2967909443610859
Energy: 0.5330811502390953
Energy: 0.6528081283204814
Energy: 0.5317153064478022
Energy: 1.2965883910956515
Energy: 0.5317153064482928
Energy: 0.6478933990627535
Energy: 0.5307807968708141
Energy: 1.411018178316275
Energy: 0.5307807968722861
Energy: 0.649826853212219
Energy: 0.533793702232782
Energy: 1.4055380509342335
Energy: 0.5337937022332726
Energy: 0.5309615576814208
Energy: 0.5346013860058387
Energy: 1.406180307893915
Energy: 0.5346013860073106
Energy: 0.5330044540337427
Energy: 0.5310594402915142
Energy: 1.4114559736500993
Energy: 0.531059440290533
Energy: 0.5311903238701381
Energy: 0.5337210045905039
Energy: 1.3997655362617965
Energy: 0.5337210045905039
Energy: 0.6500869028234542
Energy: 0.5321342043625453
Energy: 1.4016928362948853
Energy: 0.5321342043630359
Energy: 0.6509194060429446
Energy: 0.5308800837284159
Energy: 1.4132013886100674
Energy: 0.5308800837303783
Energy: 0.6504029012999211
Energy: 0.5329500191797322
Energy: 1.1903132041222462
Energy: 0.5329500191792417
Energy: 0.8760462194788173
Energy: 0.533322007439498
Energy: 1.4035501698929769
Energy: 0.5333220074399886
Energy: 0.8754495506255164
Energy: 0.5306596802730875
Energy: 1.404703995073659
Energy: 0.5306596802725969
Energy: 1.013441279392144
Energy: 0.5309375980724593
Energy: 1.1910417793055041
Energy: 0.5309375980739311
Energy: 1.0885761804467078
Energy: 0.5304587252477606
Energy: 1.412211466058767
Energy: 0.5304587252468239
Energy: 1.089320193847846
Energy: 0.5320848312095798
Energy: 1.1930873833674214
Energy: 0.5320848312100704
Energy: 1.3049474988643515
Energy: 0.6142710122865787
Energy: 0.9820742358280816
Energy: 0.6142710122826538
Energy: 1.0862748636333566
Energy: 0.6140009067295987
Energy: 1.21026502868273
Energy: 0.6140009067310704
Energy: 1.302524633507454
Energy: 0.530920892053437
Energy: 0.9790101789817445
Energy: 0.5309208920578526
Energy: 1.4145393234077739
Energy: 0.5304471104955842
Energy: 0.9801369174090697
Energy: 0.5304471105539681
Energy: 1.0856600876310105
Energy: 0.5329778252969225
Energy: 0.876331312109159
Energy: 0.5329778252983944
Energy: 1.4127688287162667
Energy: 0.5308264723981404
Energy: 0.8760747848152709
Energy: 0.530826472398631
Energy: 1.4085601415441207
Energy: 0.5322622390733419
Energy: 0.8768738236694268
Energy: 0.53226223907187
Energy: 1.2966063865336261
Energy: 0.5329189100092024
Energy: 0.6501449075314254
Energy: 0.5329189100082212
Energy: 1.4126890659272064
Energy: 0.5308838449091723
Energy: 0.6505200943919521
Energy: 0.530883844908191
Energy: 1.4072266284452544
Energy: 0.5324435202987218
Energy: 0.6495057446262629
Energy: 0.5324435202987218
Energy: 1.2962733024217477
Energy: 0.5327315660494302
Energy: 0.5314986070198949
Energy: 0.5327315660499208
Energy: 1.4112574154786137
Energy: 0.5313493764680945
Energy: 0.5322391281186716
Energy: 0.5313493764656414
Energy: 1.3998330285962948
Energy: 0.5353834426247382
Energy: 0.5313588197143418
Energy: 0.5353834426247382

minimum gb energy = 0.53044368799852 eV
minimum distance =  2.4871799600169 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.02141350554219024
Energy: 0.4366811465852597
Energy: 1.2330846759674547
Energy: 0.02232608703466884
Energy: 0.9202202592262444
Energy: 0.13017768129151552
Energy: 0.9206915826902684
Energy: 0.13017768129189267
Energy: 0.02202715050102229
Energy: 0.12895628692747882
Energy: 0.9191211284665468
Energy: 0.12895628693078948
Energy: 0.024009274768575433
Energy: 0.12860227230204005
Energy: 0.9176608689949108
Energy: 0.12860227230388396
Energy: 0.9185315561309761
Energy: 0.12853869421964095
Energy: 0.9177975310010372
Energy: 0.12853869421264247
Energy: 0.021914230940320408
Energy: 0.1282823146839817
Energy: 0.9190148760751161
Energy: 0.12828231468176063

minimum gb energy = 0.02141350554219024 eV
minimum distance =  2.73835976694218 Angstroms
sigma value = 1