Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Ni__MO_937008984446_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.450350014603218
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018148555516989674
Energy: 0.018503756554289492
Energy: 1.0427019962896318
Energy: 0.018503756553627963
Energy: 0.018503756554289492
Energy: 0.9508186062586128
Energy: 0.018503756554289492
Energy: 0.9508186062586128
Energy: 1.0427019962896318
Energy: 0.018503756553627963
Energy: 0.018148555516989674
Energy: 0.018503756554289492
Energy: 0.018503756553627963
Energy: 0.9508186062586128
Energy: 0.018503756554289492
Energy: 0.9508186062586128

minimum gb energy = 0.018148555516989674 eV
minimum distance =  2.43313590824236 Angstroms
sigma value = 1


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

Energy: 1.2341346035926837
Energy: 1.3283117758802123
Energy: 1.2705365675986386
Energy: 1.3283117758794099
Energy: 1.2357660001921973
Energy: 1.2834170444924131
Energy: 1.2314099545589106
Energy: 1.2834170444924131
Energy: 1.165856243800541
Energy: 1.3112788650911005
Energy: 1.2174158735935332
Energy: 1.3112788650919027
Energy: 1.2062742383527074
Energy: 1.258793676830486
Energy: 1.180775154068414
Energy: 1.2587936768352996
Energy: 1.2040898765872496
Energy: 1.3300059902899986
Energy: 1.2220741323339368
Energy: 1.3300059902899986
Energy: 1.1801523949361357
Energy: 1.4534393178013798
Energy: 1.123169726084939
Energy: 1.4534393178021823
Energy: 1.2519317995423154
Energy: 1.316097262943795
Energy: 1.1821604390247054
Energy: 1.316097262943795
Energy: 1.1412888110011479
Energy: 1.3295766540788554
Energy: 1.1181342629644242
Energy: 1.3295766540788554
Energy: 1.182651862767852
Energy: 1.2044138825929926
Energy: 1.2616817657448027
Energy: 1.2044138825929926
Energy: 1.122747907971816
Energy: 1.3111902227966858
Energy: 1.1329303848321095
Energy: 1.3111902227958836
Energy: 1.2397989991957585
Energy: 1.2826749056064937
Energy: 1.182355455668681
Energy: 1.2826749056064937
Energy: 1.2194632056944896
Energy: 1.328992096503119
Energy: 1.1397256126568314
Energy: 1.328992096503119
Energy: 1.2220103383254188
Energy: 1.314896156091052
Energy: 1.25140243634876
Energy: 1.314896156091052
Energy: 1.2171191147800067
Energy: 1.2759521699964367
Energy: 1.1622896878878126
Energy: 1.275952169994832
Energy: 1.2343324430339526
Energy: 1.3288287390491222
Energy: 1.200117345759932
Energy: 1.3288287390491222
Energy: 1.2213698085442743
Energy: 1.329354376981588
Energy: 1.234891982996611
Energy: 1.3293543769807858
Energy: 1.2170187654308409
Energy: 1.3109624462977945
Energy: 1.157900902439902
Energy: 1.3109624462977945
Energy: 1.2320554952423224
Energy: 1.2733946637830902
Energy: 1.2529605108429807
Energy: 1.2733946637838924
Energy: 1.1815124515942619
Energy: 1.3301726140719183
Energy: 1.1381618758590653
Energy: 1.3301726140711159
Energy: 1.2649722169932849
Energy: 1.2109543613247087
Energy: 1.1867101379927796
Energy: 1.210954361325511
Energy: 1.126265406797522
Energy: 1.3119653516376228
Energy: 1.1266326402418765
Energy: 1.3119653516368206
Energy: 1.1811449305540276
Energy: 1.2120634850589267
Energy: 1.3309887006649037
Energy: 1.212063485054113
Energy: 1.3168318368690493
Energy: 1.3299821089768713
Energy: 1.1665097381750957
Energy: 1.3299821089768713
Energy: 1.273845306913938
Energy: 1.3121907648951119
Energy: 1.180297520625794
Energy: 1.3121907648951119
Energy: 1.1822508368017832
Energy: 1.4515383546444527
Energy: 1.336434832794088
Energy: 1.4515383546436504
Energy: 1.2079254878709835
Energy: 1.3295713164283753
Energy: 1.1897686376229781
Energy: 1.3295713164283753
Energy: 1.2255442929985827
Energy: 1.3760872353183324
Energy: 1.182198377405295
Energy: 1.376087235319135
Energy: 1.3145552322195821
Energy: 1.3103177188216522
Energy: 1.2096185910026847
Energy: 1.3103177188216522
Energy: 1.2343344551076518
Energy: 1.2765678713840634
Energy: 1.2198538900125495
Energy: 1.2765678713840634
Energy: 1.2350812184635607
Energy: 1.3293353637802838
Energy: 1.2247068123620015
Energy: 1.3293353637794814
Energy: 1.212859635945717
Energy: 1.2766282206052117
Energy: 1.2215619850990238
Energy: 1.276628220603607
Energy: 1.1922451429236065
Energy: 1.310066830618052
Energy: 1.2168627624126624
Energy: 1.310066830618052
Energy: 1.2040087405647149
Energy: 1.302420006695307
Energy: 1.1751121709320185
Energy: 1.3024200066945049

minimum gb energy = 1.1181342629644242 eV
minimum distance =  2.23511894266067 Angstroms
sigma value = 1


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

Energy: 1.2927820281202884
Energy: 1.296275332908961
Energy: 1.2766957270818957
Energy: 1.2962753329144492
Energy: 1.2627179163818714
Energy: 1.344560678154565
Energy: 1.2717503197112703
Energy: 1.3445606781518205
Energy: 1.2358334953909653
Energy: 1.297510879073989
Energy: 1.2622065281393546
Energy: 1.2975108790730745
Energy: 1.1709604245976653
Energy: 1.2125403279781293
Energy: 1.2218025950393132
Energy: 1.212540327979959
Energy: 1.170820305584392
Energy: 1.2765391249002247
Energy: 1.362811120564648
Energy: 1.2765391249002247
Energy: 1.283430784956006
Energy: 1.276924447216114
Energy: 1.1685745827689638
Energy: 1.2769244472142847
Energy: 1.2549146096890698
Energy: 1.2130915976948913
Energy: 1.2132171956100681
Energy: 1.2130915976958059
Energy: 1.1712472112241328
Energy: 1.297980775741755
Energy: 1.1687165954384542
Energy: 1.2979807757435846
Energy: 1.2020686107825176
Energy: 1.2564744269312331
Energy: 1.3073476226590268
Energy: 1.256474426929404
Energy: 1.1697309000284384
Energy: 1.2988282777412774
Energy: 1.276828698819525
Energy: 1.2988282777367037
Energy: 1.2541195872270905
Energy: 1.2667381950583485
Energy: 1.2797170950734271
Energy: 1.2667381950583485
Energy: 1.1877885384635827
Energy: 1.3501750973926192
Energy: 1.2795158593712812
Energy: 1.3501750973889604
Energy: 1.285013473949249
Energy: 1.2812135203168877
Energy: 1.2479897375842781
Energy: 1.2812135203178026
Energy: 1.2842656151748657
Energy: 1.2803964962959085
Energy: 1.2719683713651648
Energy: 1.2803964962949934
Energy: 1.187870051434151
Energy: 1.3504290695101222
Energy: 1.264618200946901
Energy: 1.3504290695082923
Energy: 1.2542743817030255
Energy: 1.2665662844701493
Energy: 1.213512300520527
Energy: 1.2665662844628316
Energy: 1.1700084790666108
Energy: 1.2970325312188942
Energy: 1.2774401967592683
Energy: 1.2970325312216384
Energy: 1.2020416273690937
Energy: 1.2569083412268225
Energy: 1.3072790734874618
Energy: 1.2569083412066975
Energy: 1.171213494204783
Energy: 1.299919132109115
Energy: 1.1691160005482997
Energy: 1.299919132109115
Energy: 1.2549174534184193
Energy: 1.2144488568534046
Energy: 1.2217712578024011
Energy: 1.2144488568515752
Energy: 1.283630433830542
Energy: 1.2772126250165041
Energy: 1.2233219884906876
Energy: 1.2772126249689368
Energy: 1.171017465636978
Energy: 1.277368161240767
Energy: 1.2913859347529588
Energy: 1.2773681612398524
Energy: 1.1707517903725744
Energy: 1.2126281227547997
Energy: 1.2122680979979321
Energy: 1.2126281227538849
Energy: 1.2358037791821985
Energy: 1.2978679108901192
Energy: 1.2333674907337493
Energy: 1.2978679108901192
Energy: 1.2627677091513645
Energy: 1.3453357146383584
Energy: 1.2713726794103786
Energy: 1.3453357146365292
Energy: 1.2927820281202884
Energy: 1.2962753329107901
Energy: 1.3889968874585503
Energy: 1.2962753329107901
Energy: 1.2627179163818714
Energy: 1.34456067815365
Energy: 1.2717503197112703
Energy: 1.34456067815365
Energy: 1.235833495392795
Energy: 1.297510879073989
Energy: 1.2793275130152293
Energy: 1.297510879074904
Energy: 1.1709604245976653
Energy: 1.2125403279744706
Energy: 1.212850351564442
Energy: 1.2125403279781293

minimum gb energy = 1.1685745827689638 eV
minimum distance =  2.24063171539205 Angstroms
sigma value = 25


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

Energy: 1.3209560326788297
Energy: 1.3645092207891774
Energy: 1.4689590693709076
Energy: 1.3645092207891774
Energy: 1.3392791727235107
Energy: 1.268771310877428
Energy: 1.283209459594178
Energy: 1.2687713108806182
Energy: 1.293164420729705
Energy: 1.489211541290058
Energy: 1.2757775404977085
Energy: 1.489211541291121
Energy: 1.2665774580237918
Energy: 1.2604883595873015
Energy: 1.2783340068619633
Energy: 1.260488359586238
Energy: 1.2933163337340936
Energy: 1.4438011067818042
Energy: 1.420498032918304
Energy: 1.4438011067818042
Energy: 1.3624819943970417
Energy: 1.4217855320320363
Energy: 1.3262730192519383
Energy: 1.4217855320299095
Energy: 1.3203685311288422
Energy: 1.2814165017410313
Energy: 1.2831108367972681
Energy: 1.2814165017410313
Energy: 1.4081912613370478
Energy: 1.4498837327976024
Energy: 1.2404942371009886
Energy: 1.4498837327976024
Energy: 1.2831357707670392
Energy: 1.343536722345639
Energy: 1.3194425509249792
Energy: 1.3435367223467023
Energy: 1.2768221260049415
Energy: 1.421748329167003
Energy: 1.3005702257484024
Energy: 1.4217483291680666
Energy: 1.29934255902735
Energy: 1.4349776478267513
Energy: 1.2479529507654596
Energy: 1.4349776478267513
Energy: 1.3155299200770958
Energy: 1.359545342351022
Energy: 1.2516937236441625
Energy: 1.3595453423499586
Energy: 1.2791710359609325
Energy: 1.3722956476855694
Energy: 1.2702175444360913
Energy: 1.3722956476834427
Energy: 1.3229239789684923
Energy: 1.225780810885869
Energy: 1.3235479259891532
Energy: 1.2257808108848054
Energy: 1.2797675679247973
Energy: 1.4494492533765733
Energy: 1.240322035063581
Energy: 1.4494492533787
Energy: 1.2812409666428204
Energy: 1.2567108431095446
Energy: 1.2851042411748648
Energy: 1.2567108431095446
Energy: 1.213571710139014
Energy: 1.490274137669349
Energy: 1.2135527253447582
Energy: 1.490274137670412
Energy: 1.2473959326221895
Energy: 1.3243164063650736
Energy: 1.2710828505009761
Energy: 1.3243164063661372
Energy: 1.258432060632912
Energy: 1.363722606437467
Energy: 1.2486137206298493
Energy: 1.3637226064385306
Energy: 1.3763015837477806
Energy: 1.4713070049265184
Energy: 1.2788965432993447
Energy: 1.4713070049254549
Energy: 1.2744520361233613
Energy: 1.308787130328252
Energy: 1.2848740207901233
Energy: 1.308787130328252
Energy: 1.32299647116229
Energy: 1.3655533961366808
Energy: 1.4080445830213397
Energy: 1.365553396143061
Energy: 1.3400340174582157
Energy: 1.3942163003489931
Energy: 1.2814366386371785
Energy: 1.3942163003489931
Energy: 1.4710936135189228
Energy: 1.4874246139942997
Energy: 1.2768828151854124
Energy: 1.487424613995363
Energy: 1.2505210915760074
Energy: 1.2592303072405902
Energy: 1.2802876682771356
Energy: 1.2592303072405902

minimum gb energy = 1.2135527253447582 eV
minimum distance =  2.24317194768544 Angstroms
sigma value = 9


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

Energy: 1.3024204753030681
Energy: 1.3027817810014328
Energy: 1.423193127412911
Energy: 1.3027817810027016
Energy: 1.3181193911507885
Energy: 1.4095145544262622
Energy: 1.3104533089538348
Energy: 1.4095145544249936
Energy: 1.3408417764221752
Energy: 1.314010661593319
Energy: 1.2799944880375447
Energy: 1.314010661593319
Energy: 1.5272106167181785
Energy: 1.3234725397439573
Energy: 1.2763610690542877
Energy: 1.3234725397490312
Energy: 1.4399148135354467
Energy: 1.4060840060389888
Energy: 1.3020668759390288
Energy: 1.4060840060389888
Energy: 1.2289920776944625
Energy: 1.3136746367593364
Energy: 1.5971145827169606
Energy: 1.3136746367580678
Energy: 1.3107815121628525
Energy: 1.276189063048694
Energy: 1.2771339020959838
Energy: 1.2761890630499628
Energy: 1.3812769699923106
Energy: 1.3133907413391182
Energy: 1.26461694118425
Energy: 1.313390741340387
Energy: 1.3129892221411932
Energy: 1.408300327969483
Energy: 1.3066728330371975
Energy: 1.408300327969483
Energy: 1.3187950680052072
Energy: 1.302322852741288
Energy: 1.2784784285175501
Energy: 1.3023228527400197
Energy: 1.2713032008271932
Energy: 1.3925431206434924
Energy: 1.2799622536712412
Energy: 1.3925431206434924
Energy: 1.318850382375625
Energy: 1.303364983139898
Energy: 1.276298650479775
Energy: 1.3033649831462406
Energy: 1.2282505500566674
Energy: 1.313537322755872
Energy: 1.2524537098777058
Energy: 1.313537322755872
Energy: 1.3492856632777073
Energy: 1.3120432680250296
Energy: 1.3251393208336528
Energy: 1.3120432680250296
Energy: 1.228265807471212
Energy: 1.3140240940680021
Energy: 1.3812669060954632
Energy: 1.3140240940680021
Energy: 1.3184740826748114
Energy: 1.30271788250067
Energy: 1.2764424393223675
Energy: 1.30271788250067
Energy: 1.2711586460452118
Energy: 1.3925705009380842
Energy: 1.2631480060580098
Energy: 1.392570500939353
Energy: 1.3157046055358907
Energy: 1.3022866659053833
Energy: 1.2785777058600394
Energy: 1.3022866659053833
Energy: 1.3127004811484422
Energy: 1.4082608977006432
Energy: 1.2849493241583811
Energy: 1.4082608977006432
Energy: 1.381257420198127
Energy: 1.3135824470701465
Energy: 1.2648975434455134
Energy: 1.313582447068878
Energy: 1.3106127708667117
Energy: 1.2762127309132694
Energy: 1.2771670777418394
Energy: 1.2762127309132694

minimum gb energy = 1.2282505500566674 eV
minimum distance =  2.33941480560687 Angstroms
sigma value = 25


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

Energy: 1.292036847460039
Energy: 1.3941046086327897
Energy: 1.5239883641971905
Energy: 1.3941046086327897
Energy: 1.2616909969576304
Energy: 1.4847321534752331
Energy: 1.239598265331736
Energy: 1.4847321534768019
Energy: 1.2411322164453167
Energy: 1.5019832641960527
Energy: 1.2395417122158714
Energy: 1.5019832641960527
Energy: 1.2929060043176313
Energy: 1.4764637606835131
Energy: 1.4454504744434555
Energy: 1.4764637606835131
Energy: 1.4447855344333311
Energy: 1.2617935585991333
Energy: 1.3019811060491144
Energy: 1.2617935586007023
Energy: 1.239266136733202
Energy: 1.499533595395227
Energy: 1.699444111631662
Energy: 1.499533595395227
Energy: 1.3033898584725405
Energy: 1.4201312594176212
Energy: 1.2396049315852629
Energy: 1.4201312594191897
Energy: 1.4254821549307741
Energy: 1.3894633694582827
Energy: 1.290439113600793
Energy: 1.3894633694692642
Energy: 1.2394718473560453
Energy: 1.327275120556706
Energy: 1.2647742073011188
Energy: 1.3272751205582745
Energy: 1.4954730102333673
Energy: 1.4532482494240966
Energy: 1.2412156231776008
Energy: 1.4532482494366472
Energy: 1.3243228960771447
Energy: 1.4746174337125117
Energy: 1.628037461511845
Energy: 1.474617433710943
Energy: 1.2388765703327336
Energy: 1.3090549185112084
Energy: 1.4933944039940188
Energy: 1.3090549185096394
Energy: 1.4309570768358624
Energy: 1.4261921735186036
Energy: 1.2390818495342693
Energy: 1.4261921735186036
Energy: 1.2389213478873946
Energy: 1.473788853800242
Energy: 1.2912351382438736
Energy: 1.473788853800242
Energy: 1.3001340912831907
Energy: 1.3902711255771525
Energy: 1.4253857045072733
Energy: 1.3902711255771525
Energy: 1.2620328637456801
Energy: 1.3758708430397042
Energy: 1.2393835196172955
Energy: 1.3758708432043558
Energy: 1.2393241896458804
Energy: 1.3806317912303883
Energy: 1.4924973995284616
Energy: 1.3806317912303883

minimum gb energy = 1.2388765703327336 eV
minimum distance =  2.31921261121599 Angstroms
sigma value = 17


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

Energy: 1.3530629271691126
Energy: 1.3517954112797208
Energy: 1.747383806898939
Energy: 1.3517954112806092
Energy: 1.4560908294240902
Energy: 1.4031267047217153
Energy: 1.2610127386253756
Energy: 1.403126704722604
Energy: 1.4702437997698303
Energy: 1.3386618808457669
Energy: 1.2603554825610803
Energy: 1.3386618808555402
Energy: 1.2628332605977854
Energy: 1.3561435124757477
Energy: 1.3896377968011646
Energy: 1.356143512473971
Energy: 1.5100148801201239
Energy: 1.36208452811047
Energy: 1.3288313342592326
Energy: 1.3620845281095817
Energy: 1.2825253072340146
Energy: 1.3683529363811548
Energy: 1.750418607284755
Energy: 1.368352936380266
Energy: 1.2618759088438452
Energy: 1.4008737783363934
Energy: 1.262393503216862
Energy: 1.4008737783363934
Energy: 1.4681360158933285
Energy: 1.3703393145757181
Energy: 1.2803392111665788
Energy: 1.3703393145748295
Energy: 1.282706741704697
Energy: 1.4747424923758001
Energy: 1.5031687442218429
Energy: 1.4747424923766888
Energy: 1.6224799238136984
Energy: 1.352579311737834
Energy: 1.2617323755351681
Energy: 1.352579311737834
Energy: 1.2668813037325861
Energy: 1.3977408698834584
Energy: 1.7466455903943463
Energy: 1.3977408698879008
Energy: 1.2816128579220805
Energy: 1.4010381532065426
Energy: 1.2817689680279714
Energy: 1.4010381532065426
Energy: 1.7290491715550518
Energy: 1.3585838001401045
Energy: 1.3583199150331247
Energy: 1.3585838001392159
Energy: 1.2602492118131428
Energy: 1.4996882829879816
Energy: 1.4577487633669177
Energy: 1.4996882829888702
Energy: 1.4069965117115717
Energy: 1.4037544056264333
Energy: 1.2828730746058281
Energy: 1.4037544056264333
Energy: 1.4704305967781899
Energy: 1.3692636119980854
Energy: 1.469263092573837
Energy: 1.3692636119980854
Energy: 1.2623166274264457
Energy: 1.428748306401136
Energy: 1.583500165272994
Energy: 1.428748306401136
Energy: 1.7011754646463395
Energy: 1.3432159516599889
Energy: 1.2827725966149737
Energy: 1.3432159516608775
Energy: 1.3065627720020836
Energy: 1.4298141945703136
Energy: 1.3534337313478433
Energy: 1.4298141945703136
Energy: 1.3290127028548093
Energy: 1.3515495364795413
Energy: 1.263293199117562
Energy: 1.3515495364813184
Energy: 1.3633682448391677
Energy: 1.380958919774817
Energy: 1.4705833327670617
Energy: 1.3809589197739287
Energy: 1.2613293083102948
Energy: 1.461583279676827
Energy: 1.6218451469626627
Energy: 1.4615832802158961
Energy: 1.487045171502761
Energy: 1.3967923949722212
Energy: 1.2600278404182814
Energy: 1.3967923949731098
Energy: 1.3475137165507252
Energy: 1.4338926156510141
Energy: 1.4465922970897482
Energy: 1.4338926156510141
Energy: 1.3465421473842365
Energy: 1.3395834817957115
Energy: 1.445984477004859
Energy: 1.339583481774388
Energy: 1.492471588314776
Energy: 1.3957911680333392
Energy: 1.261897839518054
Energy: 1.3957911680333392
Energy: 1.3277133407065798
Energy: 1.5904092198909536
Energy: 1.656533488567083
Energy: 1.5904092198909536
Energy: 1.4680830979105548
Energy: 1.368743479994028
Energy: 1.4723364683675537
Energy: 1.368743479994028
Energy: 1.5536746586702368
Energy: 1.491308410425519
Energy: 1.2634974356825155
Energy: 1.4913084104237422
Energy: 1.2802736642892885
Energy: 1.4279105878513576
Energy: 1.5559323160992578
Energy: 1.4279105878513576

minimum gb energy = 1.2600278404182814 eV
minimum distance =  2.22766056071155 Angstroms
sigma value = 53


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

Energy: 1.167973981194184
Energy: 1.1675347000766316
Energy: 1.6519984749443404
Energy: 1.1675347000766316
Energy: 1.485760731851367
Energy: 1.309613679368135
Energy: 1.3644444283042285
Energy: 1.3096136793701807
Energy: 1.168763007498633
Energy: 1.1672477380615167
Energy: 1.189839546273563
Energy: 1.1672477380615167
Energy: 1.1690814313204203
Energy: 1.1674162717250878
Energy: 1.1893399679977563
Energy: 1.1674162717250878
Energy: 1.4858668094841765
Energy: 1.3095513000097132
Energy: 1.4092289551120094
Energy: 1.3095513000097132
Energy: 1.167973981194184
Energy: 1.1675347000766316
Energy: 1.6519984749443404
Energy: 1.1675347000766316
Energy: 1.4857607318534123
Energy: 1.309613679368135
Energy: 1.4499612461955735
Energy: 1.3096136793701807
Energy: 1.168763007498633
Energy: 1.1672477380615167
Energy: 1.3325798148483634
Energy: 1.1672477380594715
Energy: 1.1690814313204203
Energy: 1.1674162717250878
Energy: 1.3542641381037732
Energy: 1.1674162717250878
Energy: 1.4858668094841765
Energy: 1.3095513000097132
Energy: 1.3919150730754704
Energy: 1.3095513000097132
Energy: 1.167973981194184
Energy: 1.1675347000766316
Energy: 1.740224198167484
Energy: 1.1675347000766316
Energy: 1.485760731851367
Energy: 1.309613679368135
Energy: 1.4499612461955735
Energy: 1.3096136793701807
Energy: 1.168763007498633
Energy: 1.1672477380594715
Energy: 1.4509997666667644
Energy: 1.1672477380594715

minimum gb energy = 1.1672477380594715 eV
minimum distance =  2.30322694221484 Angstroms
sigma value = 9


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

Energy: 1.3100440150452828
Energy: 1.4851268410690022
Energy: 1.8361950282488395
Energy: 1.4851268425566841
Energy: 1.614352337000113
Energy: 1.4015263065485735
Energy: 1.3319765731270583
Energy: 1.4015263065485735
Energy: 1.3344977933897593
Energy: 1.2905212764092013
Energy: 1.313009126714469
Energy: 1.2905212764061733
Energy: 1.5229871144663067
Energy: 1.5569663552718016
Energy: 1.333881847814406
Energy: 1.5569663552718016
Energy: 1.521496491094557
Energy: 1.3786705992820971
Energy: 1.3444563502633218
Energy: 1.3786705992820971
Energy: 1.291366613828329
Energy: 1.2913723159219892
Energy: 1.5462773451868972
Energy: 1.2913723159204753
Energy: 1.795775482830106
Energy: 1.4897323885676435
Energy: 1.3335000710994498
Energy: 1.4897323885691574
Energy: 1.3487248667122038
Energy: 1.5626066149607127
Energy: 1.5064397245432308
Energy: 1.5626066149591986
Energy: 1.3371837643844504
Energy: 1.5691719553110377
Energy: 1.2898673318516922
Energy: 1.5691719553110377
Energy: 1.3372517986674672
Energy: 1.3983693835015483
Energy: 1.3332687477427612
Energy: 1.3983693835023054
Energy: 1.346258105189843
Energy: 1.4121591393201678
Energy: 1.771286651934651
Energy: 1.4121591396289084
Energy: 1.559181222893395
Energy: 1.5204836184624206
Energy: 1.3436840282995999
Energy: 1.5204836184609067
Energy: 1.3349788763212744
Energy: 1.5022514099484823
Energy: 1.6613277995552298
Energy: 1.5022514099484823
Energy: 1.5290344253551138
Energy: 1.5934801517707198
Energy: 1.3177446053163941
Energy: 1.5934801517707198
Energy: 1.3359048977469377
Energy: 1.4934645782780633
Energy: 1.5253038741711467
Energy: 1.4934645782773064
Energy: 1.3392349562094312
Energy: 1.5671114539064075
Energy: 1.5396490020048539
Energy: 1.5671114539071644
Energy: 1.446450551233472
Energy: 1.4937109740710812
Energy: 1.3527896305858769
Energy: 1.4937109740710812
Energy: 1.3519520359018318
Energy: 1.3740512320804392
Energy: 1.5289978459109415
Energy: 1.3740512320796823
Energy: 1.5877409552038004
Energy: 1.3928102083433633
Energy: 1.2949288524460383
Energy: 1.3928102083486624
Energy: 1.3274467905103065
Energy: 1.4150207560818158
Energy: 1.4632541447241623
Energy: 1.4150207560803016
Energy: 1.5264173132452454
Energy: 1.554114718076348
Energy: 1.5338797641864153
Energy: 1.554114718076348
Energy: 1.4353756790312184
Energy: 1.4789114636114429
Energy: 1.3465508408671127
Energy: 1.478911463612957
Energy: 1.2906691835289612
Energy: 1.4732605711662257
Energy: 1.336143392562356
Energy: 1.4732605711654687
Energy: 1.7941827842088298
Energy: 1.4119998075931126
Energy: 1.3435577865523614
Energy: 1.411999807594627
Energy: 1.3332776473079164
Energy: 1.677763056793701
Energy: 1.7156676717496284
Energy: 1.677763056793701
Energy: 1.4321503672778473
Energy: 1.3959847639887057
Energy: 1.3350895787083548
Energy: 1.3959847639887057
Energy: 1.3991318490515448
Energy: 1.499643041266209
Energy: 1.5280437876218842
Energy: 1.499643041266209
Energy: 1.3101478480333295
Energy: 1.5579888783204636
Energy: 1.52224153321701
Energy: 1.5579888783197067
Energy: 1.4171417091512282
Energy: 1.3946328923737716
Energy: 1.3346031685980588
Energy: 1.3946328923722577
Energy: 1.3326448815097522
Energy: 1.6774119845472928
Energy: 1.7104620252930147
Energy: 1.6774119845480497
Energy: 1.691215587067917
Energy: 1.411185281072003
Energy: 1.342810220334982
Energy: 1.4111852810712457
Energy: 1.2914420383486342
Energy: 1.377060667292818
Energy: 1.3338487643756136
Energy: 1.377060667292818
Energy: 1.2925871728900495
Energy: 1.4758573202823473
Energy: 1.3337990206075259
Energy: 1.4758573202831042
Energy: 1.530272392451455
Energy: 1.5557509242500294
Energy: 1.5290886069734921
Energy: 1.5557509242485155
Energy: 1.325008339468275
Energy: 1.554065603687961
Energy: 1.8040753014571418
Energy: 1.5540656036872038

minimum gb energy = 1.2898673318516922 eV
minimum distance =  2.23821718041743 Angstroms
sigma value = 73


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

Energy: 1.2970030191833644
Energy: 1.296175318682068
Energy: 1.7594541754015585
Energy: 1.296175318682068
Energy: 1.3660840018003684
Energy: 1.4411340994856765
Energy: 1.296446633787746
Energy: 1.4411340994856765
Energy: 1.369495490387106
Energy: 1.461832179674461
Energy: 1.3134222140446206
Energy: 1.4618321796756624
Energy: 1.3680235194147974
Energy: 1.4424709257425816
Energy: 1.2960811141887756
Energy: 1.4424709257425816
Energy: 1.366635673029559
Energy: 1.4157809655575593
Energy: 1.3154343783079716
Energy: 1.4157809655575593
Energy: 1.3823593929468625
Energy: 1.3398702110138345
Energy: 1.7532647177482952
Energy: 1.3398702110150353
Energy: 1.7392762176980703
Energy: 1.634966366961374
Energy: 1.3693270831369793
Energy: 1.634966366961374
Energy: 1.3654993404555207
Energy: 1.4621422463048495
Energy: 1.7174950984573183
Energy: 1.4621422463048495
Energy: 1.7112804439275835
Energy: 1.2965340821513955
Energy: 1.296461369370494
Energy: 1.2965340821513955
Energy: 1.3716364892037018
Energy: 1.4090476140541675
Energy: 1.2959985824239972
Energy: 1.4090476140529666
Energy: 1.3575383798873206
Energy: 1.4624988939910428
Energy: 1.7090135215698519
Energy: 1.4624988939910428
Energy: 1.4779740315273104
Energy: 1.4419120261567604
Energy: 1.3465966068880517
Energy: 1.4419120261555594
Energy: 1.3681675311961743
Energy: 1.4094205727815456
Energy: 1.4839948828927771
Energy: 1.4094205727815456
Energy: 1.8221655794523555
Energy: 1.4101536815312272
Energy: 1.383052446496002
Energy: 1.4101536815312272
Energy: 1.313402356815562
Energy: 1.3942152133885566
Energy: 1.4769872401289401
Energy: 1.3942152133897578
Energy: 1.7145474551706146
Energy: 1.4628150664673107
Energy: 1.3657423475525126
Energy: 1.4628150664685116
Energy: 1.2956619040641302
Energy: 1.2959483105468537
Energy: 1.3710266997686398
Energy: 1.2959483105468537
Energy: 1.2962840521547159
Energy: 1.2967716927291841
Energy: 1.3856851553860483
Energy: 1.2967716927291841
Energy: 1.2859288350846463
Energy: 1.4619387107145467
Energy: 1.3672200849240486
Energy: 1.4619387107145467
Energy: 1.295397363051397
Energy: 1.4003882045870888
Energy: 1.771956394402752
Energy: 1.4003882045870888
Energy: 1.8194196446806776
Energy: 1.3407491929724469
Energy: 1.3864147096228814
Energy: 1.3407491929724469
Energy: 1.2956108175716445
Energy: 1.4101788946373335
Energy: 1.4851405280608239
Energy: 1.4101788946385347

minimum gb energy = 1.2859288350846463 eV
minimum distance =  2.24588410013587 Angstroms
sigma value = 7


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

Energy: 1.3322681660746947
Energy: 1.3333784253057077
Energy: 1.7583279084961054
Energy: 1.3333784253057077
Energy: 1.6790305860490014
Energy: 1.4015995700430153
Energy: 1.3524068520997372
Energy: 1.4015995700438644
Energy: 1.3522432777516236
Energy: 1.5406633585526346
Energy: 1.3362045993802623
Energy: 1.5406633585509364
Energy: 1.388420542340621
Energy: 1.437255756709625
Energy: 1.3517358863507682
Energy: 1.4372557567087756
Energy: 1.350133378435088
Energy: 1.4271443085186108
Energy: 1.3364201101906947
Energy: 1.42714430851946
Energy: 1.3505572727889066
Energy: 1.4556380657917718
Energy: 1.6485297564727843
Energy: 1.4556380657917718
Energy: 1.4766486762626354
Energy: 1.5287829487835427
Energy: 1.4136526861961707
Energy: 1.5287829487843922
Energy: 1.3505803159208705
Energy: 1.4589014668075413
Energy: 1.8042648829551595
Energy: 1.4589014668083908
Energy: 1.4944418008318792
Energy: 1.4191497230805132
Energy: 1.365688288590136
Energy: 1.4191497230805132
Energy: 1.3467721333264617
Energy: 1.4386777258367778
Energy: 1.4621348866054031
Energy: 1.4386777258367778
Energy: 1.3298819745286417
Energy: 1.5378029921249936
Energy: 1.3216984928229032
Energy: 1.5378029921249936
Energy: 1.3341599302154314
Energy: 1.4267821928597633
Energy: 1.3221085787994902
Energy: 1.426782192857215
Energy: 1.3353252138403755
Energy: 1.3339392584261738
Energy: 1.3226462904494838
Energy: 1.3339392584227765
Energy: 1.3366115505844378
Energy: 1.4466570035510098
Energy: 1.3825451524352876
Energy: 1.4466570035493498
Energy: 1.3433736909891543
Energy: 1.5798261598491095
Energy: 1.5191097498380945
Energy: 1.5798261598499586
Energy: 1.82896410073365
Energy: 1.3229823882938005
Energy: 1.3666452332655599
Energy: 1.3229823882938005
Energy: 1.3422290111579684
Energy: 1.4275261197375968
Energy: 1.5329207068438149
Energy: 1.4275261197367475
Energy: 1.3417551417539129
Energy: 1.4042660682594401
Energy: 1.3815689796848818
Energy: 1.4042660682628374
Energy: 1.341659198598443
Energy: 1.456416014555464
Energy: 1.3898725846784707
Energy: 1.4564160145563132
Energy: 1.3423772676174732
Energy: 1.4316329589306012
Energy: 1.323831769917211
Energy: 1.4316329589297518
Energy: 1.4095722836272
Energy: 1.5398515654965503
Energy: 1.3658246421494091
Energy: 1.5398515654973997
Energy: 1.350477503089875
Energy: 1.54322923208875
Energy: 1.4585117602868851
Energy: 1.5432292320904488
Energy: 1.7119791433406981
Energy: 1.568914403670933
Energy: 1.3605075315640662
Energy: 1.5689144039052314
Energy: 1.3380189880841593
Energy: 1.3338095075217176
Energy: 1.6837599933984537
Energy: 1.3338095075217176
Energy: 1.359803538028758
Energy: 1.4320900944421175
Energy: 1.3364079984638524
Energy: 1.4320900944421175
Energy: 1.3289535325020367
Energy: 1.536431483207069
Energy: 1.3223252660363227
Energy: 1.536431483207069
Energy: 1.350854636627187
Energy: 1.4375237743563347
Energy: 1.337935672180814
Energy: 1.437523774354636
Energy: 1.3293709478301698
Energy: 1.4272136379084226
Energy: 1.352633105755626
Energy: 1.427213637906724
Energy: 1.3518444979892417
Energy: 1.4572651608169005
Energy: 1.5027716845805312
Energy: 1.4572651608185991
Energy: 1.336102581687261
Energy: 1.5456422081088597
Energy: 1.3531799212794358
Energy: 1.5456422081054622
Energy: 1.351760804017482
Energy: 1.457965716047764
Energy: 1.6453166900963994
Energy: 1.457965716047764

minimum gb energy = 1.3216984928229032 eV
minimum distance =  2.22943854996129 Angstroms
sigma value = 29


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

Energy: 1.2708953708963684
Energy: 1.2437728544547006
Energy: 1.8925087890560877
Energy: 1.2437728544547006
Energy: 1.3084176717507006
Energy: 1.273405113702153
Energy: 1.2686499364787536
Energy: 1.2734051137033036
Energy: 1.2944020292894225
Energy: 1.342022849774502
Energy: 1.4356170824140522
Energy: 1.342022849774502
Energy: 1.2687075769476144
Energy: 1.2122494364379237
Energy: 1.2685651446495392
Energy: 1.212249436437332
Energy: 1.2707611809236525
Energy: 1.3061442891356705
Energy: 1.2090961580514148
Energy: 1.3061442891350785
Energy: 1.2942061749334333
Energy: 1.3445989294804779
Energy: 1.2944029519573186
Energy: 1.3445989294801821
Energy: 1.2095043638296257
Energy: 1.3063185677932025
Energy: 1.270763180164126
Energy: 1.3063185677932025
Energy: 1.2689104837535514
Energy: 1.2117776120183184
Energy: 1.2685495849543844
Energy: 1.211777612019469
Energy: 1.208956472769022
Energy: 1.3421693930111958
Energy: 1.294434354305056
Energy: 1.3421693930111958

minimum gb energy = 1.208956472769022 eV
minimum distance =  2.28640044974954 Angstroms
sigma value = 5


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

Energy: 1.2960097251716174
Energy: 1.3736467670227248
Energy: 1.6102042743528358
Energy: 1.3736467670243295
Energy: 1.4462364075316356
Energy: 1.5223763384258298
Energy: 1.2627346051996025
Energy: 1.522376338427434
Energy: 1.2463877442569467
Energy: 1.388075630533302
Energy: 1.4949609420690781
Energy: 1.3880756305316972
Energy: 1.2894803422820489
Energy: 1.4468581467859325
Energy: 1.2704457349567728
Energy: 1.4468581467859325
Energy: 1.2835893288892735
Energy: 1.364262264111081
Energy: 1.5223081137559895
Energy: 1.3642622641126856
Energy: 1.3262185159736086
Energy: 1.3952871894620806
Energy: 1.2574023520256457
Energy: 1.3952871894628829
Energy: 1.2524321782485002
Energy: 1.3737522517208651
Energy: 1.2490021546070784
Energy: 1.3737522517216674
Energy: 1.251296096798298
Energy: 1.3457274012608422
Energy: 1.2464245028195473
Energy: 1.3457274012608422
Energy: 1.26427881582164
Energy: 1.3621877095668489
Energy: 1.267132310622038
Energy: 1.3621877095788832
Energy: 1.2635225431703643
Energy: 1.3632207763746236
Energy: 1.253279468550704
Energy: 1.3632207763738213
Energy: 1.276164409187399
Energy: 1.2932099106245079
Energy: 1.2471384181612566
Energy: 1.2932099106269148
Energy: 1.280539243921205
Energy: 1.3960558262862233
Energy: 1.3821487842550766
Energy: 1.3960558262870255
Energy: 1.3499927753617198
Energy: 1.2925901659138423
Energy: 1.2944772871224404
Energy: 1.292590165915447
Energy: 1.2626364067134066
Energy: 1.3950870070078751
Energy: 1.33565237441054
Energy: 1.3950870070054682
Energy: 1.5913655073388617
Energy: 1.5482043872462985
Energy: 1.2470417178740922
Energy: 1.5482043872462985
Energy: 1.2672267493198754
Energy: 1.3637660002040066
Energy: 1.4880386100240823
Energy: 1.3637660002056111
Energy: 1.453154794875705
Energy: 1.437217499413988
Energy: 1.2578301327626094
Energy: 1.4372174994147902
Energy: 1.2607185823657865
Energy: 1.3946291087327976
Energy: 1.441426966568791
Energy: 1.3946291087335998
Energy: 1.26633310399176
Energy: 1.3752544020654034
Energy: 1.2510451110297138
Energy: 1.3752544020621944
Energy: 1.2764703808270688
Energy: 1.4261148160866288
Energy: 1.277874406976213
Energy: 1.4261148160834196
Energy: 1.2707033019696499
Energy: 1.4458013624005326
Energy: 1.2637635642504894
Energy: 1.4458013624005326
Energy: 1.2721990780913546
Energy: 1.3620557563871258
Energy: 1.264025740889871
Energy: 1.3620557563871258
Energy: 1.2512813391288895
Energy: 1.2940419398517367
Energy: 1.2797556330096842
Energy: 1.2940419398517367
Energy: 1.3762509705359203
Energy: 1.2970708537968916
Energy: 1.2813140013113442
Energy: 1.297070853797694
Energy: 1.380283821088944
Energy: 1.277067807592313
Energy: 1.256739976487633
Energy: 1.2770678075955224
Energy: 1.2702468097945578
Energy: 1.344251530833725
Energy: 1.264699065076247
Energy: 1.3442515308329228
Energy: 1.2468333048864135
Energy: 1.2372678780798032
Energy: 1.3845177912101345
Energy: 1.2372678780830122
Energy: 1.3592026319013353
Energy: 1.3318608244766925
Energy: 1.2655669526587612
Energy: 1.3318608244766925
Energy: 1.253432190575145
Energy: 1.5827013544601751
Energy: 1.369750270379441
Energy: 1.5827013544593724
Energy: 1.519715436641352
Energy: 1.395112747313557
Energy: 1.2595517264245544
Energy: 1.395112747313557
Energy: 1.247386969501849
Energy: 1.2793800181910011
Energy: 1.4922121211632162
Energy: 1.2793800181918031
Energy: 1.4492305104334782
Energy: 1.4872233139217028
Energy: 1.2709356950355228
Energy: 1.487223313922505
Energy: 1.2717973851050708
Energy: 1.4483309137934663
Energy: 1.2711455481015428
Energy: 1.4483309137926643

minimum gb energy = 1.2372678780798032 eV
minimum distance =  2.22406164269244 Angstroms
sigma value = 1


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

Energy: 1.2434173145428329
Energy: 1.2443715651014597
Energy: 1.4363112053446134
Energy: 1.244371565099241
Energy: 1.2379415196785708
Energy: 1.6744923319213436
Energy: 1.2177191460055046
Energy: 1.6744923319224527
Energy: 1.1918496017474864
Energy: 1.3923983641070778
Energy: 1.666987228173305
Energy: 1.3923983641081874
Energy: 1.289936043206835
Energy: 1.3352625063296202
Energy: 1.2010665476711961
Energy: 1.3352625063296202
Energy: 1.214484684364435
Energy: 1.2386285724249557
Energy: 1.4428556253584328
Energy: 1.2386285724249557
Energy: 1.1920608293695287
Energy: 1.574642269756035
Energy: 1.2006861253909262
Energy: 1.5746422697549256
Energy: 1.1924873788931887
Energy: 1.3750547868670124
Energy: 1.2318038500250323
Energy: 1.3750547868681218
Energy: 1.1870859140138723
Energy: 1.3929768450531643
Energy: 1.251378971960205
Energy: 1.3929768450520548
Energy: 1.2433193280453754
Energy: 1.2418694514681143
Energy: 1.2657017187002917
Energy: 1.2418694514670052
Energy: 1.2427197772188368
Energy: 1.2420763715025005
Energy: 1.2505112555700661
Energy: 1.2420763715036098
Energy: 1.1922973371273975
Energy: 1.3928342194008407
Energy: 1.267014852692641
Energy: 1.3928342194008407
Energy: 1.1869093532263548
Energy: 1.3753405628752857
Energy: 1.2114254462015166
Energy: 1.3753405628752857
Energy: 1.1919804925918969
Energy: 1.5754836445269427
Energy: 1.2010398176397237
Energy: 1.5754836445258336
Energy: 1.2143913321273203
Energy: 1.2389290427595154
Energy: 1.3717616928129945
Energy: 1.2389290427573472
Energy: 1.2894741833649634
Energy: 1.3360867241296046
Energy: 1.200779944535072
Energy: 1.3360867241296046
Energy: 1.1919229745695026
Energy: 1.3920503303128766
Energy: 1.3574956587059168
Energy: 1.3920503303139862
Energy: 1.2381769843980872
Energy: 1.673826065714893
Energy: 1.2176629905345693
Energy: 1.673826065714893
Energy: 1.2434173145428329
Energy: 1.2443715651003506
Energy: 1.5537108207501207
Energy: 1.244371565099241
Energy: 1.2379415196652588
Energy: 1.6744923319224527
Energy: 1.2177191460055046
Energy: 1.6744923319224527
Energy: 1.1918496017474864
Energy: 1.3923983641070778
Energy: 1.666987228173305
Energy: 1.3923983641070778
Energy: 1.2899360432046165
Energy: 1.3352625063285113
Energy: 1.2010665476711961
Energy: 1.3352625063307295
Energy: 1.214484684364435
Energy: 1.2386285724249557
Energy: 1.4428560438903628
Energy: 1.2386285724249557
Energy: 1.1920608293695287
Energy: 1.5746422697571443
Energy: 1.2006861253909262
Energy: 1.574642269756035
Energy: 1.1924873788920796
Energy: 1.3750547868670124
Energy: 1.2116956065879532
Energy: 1.3750547868681218

minimum gb energy = 1.1869093532263548 eV
minimum distance =  2.25056044332502 Angstroms
sigma value = 17


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

Energy: 1.2457421503171175
Energy: 1.2450760720276894
Energy: 1.6382412578809646
Energy: 1.2450760720270038
Energy: 1.378959817421516
Energy: 1.3763293073555267
Energy: 1.2097457467010901
Energy: 1.3763293073555267
Energy: 1.2059353039789185
Energy: 1.3276405332931034
Energy: 1.469976838831447
Energy: 1.327640533291732
Energy: 1.3112310246698407
Energy: 1.1960114150790742
Energy: 1.2040729245093693
Energy: 1.196011415081131
Energy: 1.206940580905317
Energy: 1.4457115667047888
Energy: 1.4926062042173764
Energy: 1.4457115667047888
Energy: 1.22784152216685
Energy: 1.3566424755708049
Energy: 1.2202449080329085
Energy: 1.3566424693240342
Energy: 1.2257587685822438
Energy: 1.3126129235780932
Energy: 1.2308286192526947
Energy: 1.3126129235767219
Energy: 1.2216661452716033
Energy: 1.3006071092669926
Energy: 1.201720059941653
Energy: 1.3006071092669926
Energy: 1.2444853202547317
Energy: 1.2975767704221925
Energy: 1.2724816973296713
Energy: 1.297576770417393
Energy: 1.2313459483206757
Energy: 1.4297127469088111
Energy: 1.2171871998193378
Energy: 1.429712746906754
Energy: 1.2109694167446674
Energy: 1.2730683881047236
Energy: 1.21063473378759
Energy: 1.273068388104038
Energy: 1.1985149525930416
Energy: 1.3053212977505786
Energy: 1.1944259186043236
Energy: 1.305321297751264
Energy: 1.2243841237405766
Energy: 1.4323184217391614
Energy: 1.207883815006864
Energy: 1.4323184217336762
Energy: 1.2244795948214438
Energy: 1.332421329206386
Energy: 1.245127541609241
Energy: 1.3324213292057003
Energy: 1.2109284952826418
Energy: 1.3357282032858067
Energy: 1.2565622974339776
Energy: 1.3357282032885491
Energy: 1.2120749407850258
Energy: 1.4341692809311417
Energy: 1.4871142268973228
Energy: 1.4341692809318272
Energy: 1.257434803816024
Energy: 1.2025513054913788
Energy: 1.2077648608869662
Energy: 1.2025513054858934
Energy: 1.198824959421194
Energy: 1.3395350658766996
Energy: 1.4479870815187188
Energy: 1.3395350658766996
Energy: 1.375642235871145
Energy: 1.3542837318719292
Energy: 1.209533644701361
Energy: 1.3542837318705578
Energy: 1.2144337619323857
Energy: 1.231505778883966
Energy: 1.3296529933012107
Energy: 1.231505778881909
Energy: 1.3548088051423648
Energy: 1.3528805942862283
Energy: 1.2237748557001027
Energy: 1.3528805942848567
Energy: 1.224499947034174
Energy: 1.4471601013570263
Energy: 1.4456870275845182
Energy: 1.4471601013577118
Energy: 1.3590213105823847
Energy: 1.2107761608118897
Energy: 1.216738492070154
Energy: 1.2107761608105185
Energy: 1.2098708825404838
Energy: 1.220438551404637
Energy: 1.3774571998708278
Energy: 1.220438551403951
Energy: 1.2899437363997743
Energy: 1.3394620515724465
Energy: 1.201169947915212
Energy: 1.3394620515731326
Energy: 1.210958036609672
Energy: 1.3343118862700891
Energy: 1.2123708891370277
Energy: 1.3343118862707746
Energy: 1.360972500392661
Energy: 1.5817078234255684
Energy: 1.2150721903190724
Energy: 1.5817078234255684
Energy: 1.258380949602653
Energy: 1.5994137416556944
Energy: 1.2284659585385493
Energy: 1.5994137416570655
Energy: 1.2452042959152232
Energy: 1.3320339379047579
Energy: 1.2192516896685734
Energy: 1.3320339379020156
Energy: 1.2117915985745036
Energy: 1.4343710326220427
Energy: 1.248849124075674
Energy: 1.4343710326206716
Energy: 1.194793233243738
Energy: 1.3315450278836296
Energy: 1.1983279270145015
Energy: 1.331545027882944
Energy: 1.2109585824616595
Energy: 1.2723417126450836
Energy: 1.2071136183981888
Energy: 1.2723417126416552
Energy: 1.2150019711048223
Energy: 1.4281977335838982
Energy: 1.387503210481128
Energy: 1.4281977335832128
Energy: 1.2732812474903377
Energy: 1.481115255311016
Energy: 1.221816204295704
Energy: 1.4811152553123876
Energy: 1.2011493980520973
Energy: 1.4436039955984576
Energy: 1.25507989548759
Energy: 1.443603995597086
Energy: 1.2313531024514628
Energy: 1.314469125403195
Energy: 1.2232572839636022
Energy: 1.3144691254038805
Energy: 1.2163418354363342
Energy: 1.35506473847214
Energy: 1.2312241519528315
Energy: 1.3550647387387276
Energy: 1.4871968071854302
Energy: 1.2398447990394907
Energy: 1.212535684164978
Energy: 1.239844798993553

minimum gb energy = 1.1944259186043236 eV
minimum distance =  2.24769926975443 Angstroms
sigma value = 89


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

Energy: 1.1106856725938727
Energy: 1.1109141258412074
Energy: 1.2059589059905889
Energy: 1.1109141258430013
Energy: 1.1115537110318061
Energy: 1.14588641399644
Energy: 1.129860533777251
Energy: 1.14588641399644
Energy: 1.126812961941796
Energy: 1.3645971770872307
Energy: 1.8058882304599801
Energy: 1.3645971770854368
Energy: 1.1456036892282526
Energy: 1.1462466321923424
Energy: 1.1294566649246407
Energy: 1.1462466321923424
Energy: 1.126458781161004
Energy: 1.5068468478581305
Energy: 1.2576121080958003
Energy: 1.5068468478581305
Energy: 1.1265596369198365
Energy: 1.1121256100323165
Energy: 1.1141477676719882
Energy: 1.1121256100323165
Energy: 1.1267087644937919
Energy: 1.3300740025697275
Energy: 1.1108414389622656
Energy: 1.3300740025697275
Energy: 1.1430045415724157
Energy: 1.4842943591463393
Energy: 1.1297438364253518
Energy: 1.4842943591481332
Energy: 1.1262154400870705
Energy: 1.239926927454841
Energy: 1.1152857731126808
Energy: 1.239926927454841
Energy: 1.1453852553563435
Energy: 1.1106954065167884
Energy: 1.1262973834398982
Energy: 1.1106954065167884
Energy: 1.110283081264895
Energy: 1.1468732280497886
Energy: 1.1264267491992122
Energy: 1.1468732280497886
Energy: 1.1103970043208076
Energy: 1.3319695285501152
Energy: 1.12966596809766
Energy: 1.3319695285501152
Energy: 1.1261892459610492
Energy: 1.177829078376502
Energy: 1.1573489896012599
Energy: 1.177829078376502
Energy: 1.1262004651799549
Energy: 1.2359093881388374
Energy: 1.1262123719244497
Energy: 1.2359093881388374
Energy: 1.1146237952391136
Energy: 1.1777042495785384
Energy: 1.1262164689501588
Energy: 1.1777042495785384

minimum gb energy = 1.110283081264895 eV
minimum distance =  2.2681206234326 Angstroms
sigma value = 13


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

Energy: 1.1199947761142939
Energy: 1.352698083197986
Energy: 1.1331575684107889
Energy: 1.3526980832002415
Energy: 1.2564134323463332
Energy: 1.3727996299687593
Energy: 1.071855285548261
Energy: 1.3727996299665035
Energy: 1.0807386834111155
Energy: 1.3824038168899968
Energy: 1.3046146076763823
Energy: 1.3824038168884931
Energy: 1.077337790268771
Energy: 1.3714605084559746
Energy: 1.0696459953337034
Energy: 1.3714605084559746
Energy: 1.0870334684733558
Energy: 1.494538035250402
Energy: 1.155681918517441
Energy: 1.4945380352458904
Energy: 1.0759877627976357
Energy: 1.2383600626160425
Energy: 1.0947274907495717
Energy: 1.2383600626190503
Energy: 1.0874349745801566
Energy: 1.3465770490916233
Energy: 1.5023290201107873
Energy: 1.3465770490953832
Energy: 1.07245375689879
Energy: 1.40190110914745
Energy: 1.0947029205260825
Energy: 1.401901109148202
Energy: 1.0868556342434506
Energy: 1.3064605205695095
Energy: 1.2896169346374995
Energy: 1.3064605205665019
Energy: 1.2644525801798572
Energy: 1.5128149593851747
Energy: 1.069856236134208
Energy: 1.5128149593904383
Energy: 1.0870315833902258
Energy: 1.1991253822221586
Energy: 1.071108006157145
Energy: 1.1991253822229107
Energy: 1.373647731464583
Energy: 1.5841904063841377
Energy: 1.0784937649091035
Energy: 1.5841904063848895
Energy: 1.12709715168231
Energy: 1.3845740580702364
Energy: 1.0894080238671844
Energy: 1.3845740580687327
Energy: 1.3502738817173774
Energy: 1.471780781087995
Energy: 1.0776048244326666
Energy: 1.471780781088747
Energy: 1.087214572354411
Energy: 1.3843178071870614
Energy: 1.0910819840429282
Energy: 1.3843178071863096
Energy: 1.0778386718570667
Energy: 1.3299822651053335
Energy: 1.0668302786226334
Energy: 1.3299822651075892
Energy: 1.0921385613325154
Energy: 1.4206409004126126
Energy: 1.0671604162145518
Energy: 1.4206409004156204
Energy: 1.103834545796213
Energy: 1.3079226436421705
Energy: 1.0905243905504043
Energy: 1.3079226436391629
Energy: 1.0925532462269718
Energy: 1.307434174207441
Energy: 1.090593745928692
Energy: 1.3074341741924025
Energy: 1.0924292558126185
Energy: 1.3075020032936124
Energy: 1.0905996868132737
Energy: 1.3075020032936124
Energy: 1.1042393057948297
Energy: 1.3076048701429939
Energy: 1.0906768679315089
Energy: 1.3076048701407381
Energy: 1.0927289102210156
Energy: 1.4203565076592117
Energy: 1.067627838999674
Energy: 1.4203565076584599
Energy: 1.078160429111916
Energy: 1.3293010665585079
Energy: 1.0669595574051571
Energy: 1.3293010665585079
Energy: 1.0873126377461326
Energy: 1.3840653556808244
Energy: 1.0865991302542684
Energy: 1.384065355685336
Energy: 1.3515240138376337
Energy: 1.471796675719539
Energy: 1.0786793917459092
Energy: 1.4717966757202907
Energy: 1.1271529218943381
Energy: 1.3850409280349607
Energy: 1.0759280178430224
Energy: 1.3850409280507512
Energy: 1.3736827404809826
Energy: 1.5839116558874553
Energy: 1.0778861971260976
Energy: 1.5839116558867032
Energy: 1.0868596541948867
Energy: 1.1983885570731534
Energy: 1.0716733503289022
Energy: 1.1983885570739055
Energy: 1.266029187569684
Energy: 1.5106690455355047
Energy: 1.0697772212596075
Energy: 1.5106690455370089
Energy: 1.0869115849268836
Energy: 1.3071506340635424
Energy: 1.2153112437604354
Energy: 1.3071506340627905
Energy: 1.0753155604047393
Energy: 1.401569125122029
Energy: 1.0949479108871323
Energy: 1.4015691251197733
Energy: 1.087021380979408
Energy: 1.3471309633529123
Energy: 1.3514172324914602
Energy: 1.3471309633687027
Energy: 1.0764831912443062
Energy: 1.2381147904040206
Energy: 1.0947603559680408
Energy: 1.2381147904318417
Energy: 1.086704672595354
Energy: 1.4945444820554572
Energy: 1.3684309681791247
Energy: 1.4945444820532012
Energy: 1.077476738617488
Energy: 1.3711321809559225
Energy: 1.0696472194586588
Energy: 1.371132180956674

minimum gb energy = 1.0668302786226334 eV
minimum distance =  2.23677489247373 Angstroms
sigma value = 37


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

Energy: 1.027868586001535
Energy: 1.0272073822236156
Energy: 1.0364234153020861
Energy: 1.0272073822236156
Energy: 1.4996263520297026
Energy: 1.2432610417092738
Energy: 0.9881439317957136
Energy: 1.2432610417079801
Energy: 0.9978845619587564
Energy: 1.5084767825706427
Energy: 1.7025243033213293
Energy: 1.508476782569349
Energy: 0.9780384739095402
Energy: 1.2434190414743698
Energy: 0.98800135965674
Energy: 1.2434190414743698
Energy: 0.9863390417956845
Energy: 1.2440460595167968
Energy: 0.9775240862630498
Energy: 1.2440460595167968
Energy: 0.9997583080875803
Energy: 1.2432230297190714
Energy: 0.9809104573504861
Energy: 1.2432230297190714
Energy: 1.0160098296057425
Energy: 1.4939222718656129
Energy: 1.221431914627367
Energy: 1.4939222718656129
Energy: 0.9865076185787692
Energy: 1.0278245455363426
Energy: 1.0292970952251048
Energy: 1.0278245455363426
Energy: 0.9863339993666098
Energy: 1.2442905945917235
Energy: 1.2206620012389036
Energy: 1.2442905945917235
Energy: 1.3494646319757722
Energy: 1.5077372081353446
Energy: 0.9810213763087967
Energy: 1.5077372081353446
Energy: 1.016140356235918
Energy: 1.4961248631170758
Energy: 0.9776798382202485
Energy: 1.4961248631170758
Energy: 1.2833143621634093
Energy: 1.2457476612367537
Energy: 0.9882714618977809
Energy: 1.2457476612367537
Energy: 0.9773407117954332
Energy: 1.244405764984217
Energy: 1.001913490270969
Energy: 1.244405764984217
Energy: 1.2209188637713821
Energy: 1.496675292549793
Energy: 0.9861763126682239
Energy: 1.496675292549793
Energy: 1.026670951561746
Energy: 1.0802430810901198
Energy: 0.9862024574254898
Energy: 1.0802430810901198
Energy: 1.0273841990691288
Energy: 1.245974839368847
Energy: 0.9880133007143062
Energy: 1.245974839368847
Energy: 0.9770948233100486
Energy: 1.3771349045167818
Energy: 1.014194983633725
Energy: 1.3771349045167818
Energy: 0.9784286359553045
Energy: 1.2817892771487909
Energy: 0.9861388979085189
Energy: 1.2817892771500845
Energy: 0.9863045739847187
Energy: 1.2491915986207391
Energy: 0.9861891745538575
Energy: 1.2491915986220328
Energy: 0.9864755704818943
Energy: 1.027696698327977
Energy: 0.9773542079906286
Energy: 1.027696698327977

minimum gb energy = 0.9770948233100486 eV
minimum distance =  2.28247892886946 Angstroms
sigma value = 25


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

Energy: 0.9618418498813383
Energy: 1.2383304236644264
Energy: 1.5921540276316444
Energy: 1.2383304236644264
Energy: 1.2523497969623743
Energy: 1.2538842113722606
Energy: 0.9095963942212861
Energy: 1.2538842113722606
Energy: 0.9039337421831593
Energy: 0.9044316282183459
Energy: 1.230305424551556
Energy: 0.9044316282193561
Energy: 1.0728831589256846
Energy: 1.2540121335295462
Energy: 0.9092254937043186
Energy: 1.254012133528536
Energy: 0.9109286412376629
Energy: 1.2543151909899337
Energy: 0.8867874454209181
Energy: 1.2543151909889234
Energy: 0.8820285646020097
Energy: 1.254889020556479
Energy: 0.9092843042796728
Energy: 1.254889020556479
Energy: 0.9113663187342478
Energy: 1.0723060178572072
Energy: 0.9775766956415326
Energy: 1.0723060178572072
Energy: 0.8950918106951935
Energy: 1.1179193171929025
Energy: 0.9058804033629047
Energy: 1.1179193171929025
Energy: 0.9085570887922388
Energy: 1.2535953556308297
Energy: 1.2578757662098614
Energy: 1.2535953556308297
Energy: 0.8862123858421065
Energy: 1.2402069816102463
Energy: 0.9635781425971129
Energy: 1.2402069816102463
Energy: 0.9115190088208296
Energy: 1.0719593675137273
Energy: 1.2533847202491504
Energy: 1.0719593675117067
Energy: 1.175410631453154
Energy: 1.3250498560647495
Energy: 0.9059997211875531
Energy: 1.3250498560647495
Energy: 0.9112855042819736
Energy: 1.2534961269050693
Energy: 1.0618938367365842
Energy: 1.2534961269050693
Energy: 1.1497283636648241
Energy: 1.2908444912781312
Energy: 0.9094389806076957
Energy: 1.2908444912771668
Energy: 0.911651104294666
Energy: 1.0716667147618886
Energy: 0.8822359836417752
Energy: 1.0716667147628987
Energy: 1.1482493803868825
Energy: 1.229798514376302
Energy: 0.9100556930323083
Energy: 1.2297985143752919
Energy: 0.911119945802995
Energy: 1.1181288527076563
Energy: 0.8951429622155401
Energy: 1.1181288527086664
Energy: 1.0892501394217349
Energy: 1.2547958249506692
Energy: 0.9095681805545619
Energy: 1.2547958249496591
Energy: 0.9689147007772149
Energy: 1.241682441746049
Energy: 0.8862202148557277
Energy: 1.241682441745039
Energy: 1.2388729260533047
Energy: 1.2305089254790333
Energy: 0.9097396081686887
Energy: 1.2305089254800436
Energy: 0.9082124465709723
Energy: 1.32465978621945
Energy: 0.8937926390577408
Energy: 1.32465978621945
Energy: 0.904363075640589
Energy: 1.2553625513782747
Energy: 0.9094434008489721
Energy: 1.2553625513772646
Energy: 0.9122771731553035
Energy: 1.289946202739233
Energy: 1.1500317432413074
Energy: 1.289946202739233
Energy: 0.8813133290913971
Energy: 1.3943335652141176
Energy: 0.9100421989109703
Energy: 1.3943335652141176
Energy: 0.9098207977204514
Energy: 1.2277355397454457
Energy: 1.1482722750622445
Energy: 1.2277355397444356
Energy: 0.8869318994011621
Energy: 1.1188239439014336
Energy: 0.9034944873089634
Energy: 1.1188239439014336

minimum gb energy = 0.8813133290913971 eV
minimum distance =  2.2598043060378 Angstroms
sigma value = 41


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

Energy: 1.1090024356399517
Energy: 1.111513667238271
Energy: 1.498891649514304
Energy: 1.1115136672697419
Energy: 1.4346914160576936
Energy: 1.0993079991754295
Energy: 0.8224315326371796
Energy: 1.0993079991754295
Energy: 0.8489202847773506
Energy: 1.0937066146583372
Energy: 1.4506116664073558
Energy: 1.0937066146583372
Energy: 1.1041363096593502
Energy: 1.100850718996534
Energy: 0.8227130668665684
Energy: 1.1008507189990187
Energy: 0.8169257215721918
Energy: 1.128492433660512
Energy: 0.8862081141793144
Energy: 1.1284924336596838
Energy: 0.9597136308719088
Energy: 1.0985923596200686
Energy: 0.8225672244069533
Energy: 1.0985923596208969
Energy: 0.8214347461354695
Energy: 1.0980183646935946
Energy: 0.8809562629346605
Energy: 1.098018364694423
Energy: 0.8056701662229627
Energy: 0.9806960334481561
Energy: 0.8179791505490139
Energy: 0.9806960334489844
Energy: 0.8255870947817359
Energy: 0.9794366264624634
Energy: 1.2479167155143969
Energy: 0.979436626459979
Energy: 0.8149118608410831
Energy: 1.0934072011407483
Energy: 0.8501731033994001
Energy: 1.0934072011407483
Energy: 0.8216473941540295
Energy: 1.0991630876734533
Energy: 1.2675600047478992
Energy: 1.0991630876751095
Energy: 0.8113539372309214
Energy: 1.1109219908694774
Energy: 1.1094760831442487
Energy: 1.1109219908678212
Energy: 0.8258788011362568
Energy: 0.9825952461259363
Energy: 1.358348086324342
Energy: 0.9825952458105509
Energy: 1.0469495499412445
Energy: 0.9450579083523429
Energy: 0.8502052624106343
Energy: 0.9450579083515148
Energy: 0.821603425142722
Energy: 1.0999124388876735
Energy: 1.0892143103878933
Energy: 1.0999124388876735
Energy: 1.031253353391303
Energy: 1.1555146785614312
Energy: 0.8180162148314617
Energy: 1.1555146785614312
Energy: 0.8257440892932588
Energy: 0.9829428126239622
Energy: 1.036623227698838
Energy: 0.982942812656261
Energy: 1.0287474397394138
Energy: 0.9450592292427407
Energy: 0.8229316854279595
Energy: 0.9450592292460533
Energy: 0.8215008301249039
Energy: 0.9813361556950378
Energy: 0.8060224102929732
Energy: 0.9813361556942096
Energy: 1.030642013688434
Energy: 0.9786483579155656
Energy: 0.8256468931461968
Energy: 0.9786483579139095
Energy: 0.8535508137661554
Energy: 0.8498244477176855
Energy: 0.8089320874230517
Energy: 0.8498244477176855
Energy: 1.2684418564303874
Energy: 0.8739987418379309
Energy: 0.8227912383085006
Energy: 0.8739987418371028
Energy: 1.112955165390358
Energy: 1.111036309110456
Energy: 0.8108931350630529
Energy: 1.111036309110456
Energy: 1.1114765576191523
Energy: 0.9822562317067504
Energy: 0.8254772458073444
Energy: 0.982256231705094
Energy: 0.8535754206450331
Energy: 0.9452435821776197
Energy: 0.8194612020332717
Energy: 0.9452435821759633
Energy: 1.0903975609381242
Energy: 0.8728614777806022
Energy: 0.8225974415157051
Energy: 0.8728614777806022
Energy: 0.8217041509721997
Energy: 1.1557564080707456
Energy: 1.0315725230850834
Energy: 1.1557564080715734
Energy: 0.8173046210885786
Energy: 0.9864265070690386
Energy: 0.8259854426031208
Energy: 0.9864265070698668
Energy: 0.8255897311817806
Energy: 0.9452495872409605
Energy: 1.028146880434796
Energy: 0.9452495872401324
Energy: 0.8055085760405802
Energy: 1.0266895015736837
Energy: 0.8260833615722003
Energy: 1.0266895011257897
Energy: 0.8297445276966584
Energy: 0.9785638629896874
Energy: 1.0307225605754515
Energy: 0.9785638629905158
Energy: 0.8094696672531908
Energy: 0.8500155294029178
Energy: 0.858934806768871
Energy: 0.850015529403746

minimum gb energy = 0.8055085760405802 eV
minimum distance =  2.27772205192174 Angstroms
sigma value = 15


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

Energy: 1.0175675245604325
Energy: 0.7781270702227386
Energy: 0.7693536404604492
Energy: 0.778127070224078
Energy: 1.4154715729320975
Energy: 0.8828885533145369
Energy: 0.774559102934063
Energy: 0.8828885531055926
Energy: 0.8023843926092799
Energy: 0.9937606177478647
Energy: 1.3676812854267753
Energy: 0.9937606177464614
Energy: 1.1379373079665105
Energy: 0.8865815806643664
Energy: 0.7743025815818582
Energy: 0.8865815808109337
Energy: 0.7708677201919707
Energy: 0.8614625783866482
Energy: 0.7540562782558756
Energy: 0.8614625783866482
Energy: 0.993395240729051
Energy: 0.8876903103409974
Energy: 0.7746752009721778
Energy: 0.887690310378883
Energy: 0.7736483073894772
Energy: 1.005316132786493
Energy: 0.8070651726539344
Energy: 1.0053161327885978
Energy: 0.8753150560747693
Energy: 1.0055507054505854
Energy: 0.7744047073408546
Energy: 1.0055507054491826
Energy: 0.7765907535581577
Energy: 0.790517265590303
Energy: 0.9846048769086555
Energy: 0.790517265590303
Energy: 0.7458217192244566
Energy: 0.7723331591906494
Energy: 0.7715385595193611
Energy: 0.772333159191351
Energy: 0.7738764814828021
Energy: 0.8830524537854262
Energy: 1.1722635249007443
Energy: 0.8830524537047443
Energy: 0.7500472599222516
Energy: 0.9953143850961753
Energy: 0.8029087912920365
Energy: 0.9953143850961753
Energy: 0.7765896379795301
Energy: 0.7896228637070839
Energy: 1.3537036124302488
Energy: 0.7896228636783827
Energy: 0.7490585075441446
Energy: 0.7733898480025645
Energy: 1.0171055188224702
Energy: 0.7733898480025645
Energy: 0.77391404897507
Energy: 0.8829761798599787
Energy: 1.294912545372331
Energy: 0.8829761777000583
Energy: 0.9541362026006154
Energy: 0.9952292324891127
Energy: 0.8033290648304172
Energy: 0.9952292324898143
Energy: 0.7763401195711488
Energy: 0.7882934059663363
Energy: 1.1362239734832187
Energy: 0.7882934059670379
Energy: 0.9397214125044128
Energy: 0.8589166185405208
Energy: 0.7716374062026146
Energy: 0.858916618538416
Energy: 0.7737088117330104
Energy: 0.8825586971395454
Energy: 0.9956078449328266
Energy: 0.8825586971416503
Energy: 0.9387011643142149
Energy: 1.035806403774408
Energy: 0.7747832255411108
Energy: 1.035806403774408
Energy: 0.7765888166118609
Energy: 0.9099939861188393
Energy: 0.877564342819523
Energy: 0.9099939861174362
Energy: 0.9371039130040141
Energy: 0.7867265277638698
Energy: 0.7800798643454787
Energy: 0.7867265277631682
Energy: 0.7737442723383622
Energy: 0.7720646125379483
Energy: 0.7453993637931998
Energy: 0.7720646125379483
Energy: 1.175737231353269
Energy: 0.884893188555236
Energy: 0.7747166552359439
Energy: 0.8848931892831609
Energy: 0.8050061268429992
Energy: 0.8037647029155817
Energy: 0.7519813450214242
Energy: 0.8037647029127752
Energy: 1.1731122705891588
Energy: 0.7869178512374088
Energy: 0.7800442367279812
Energy: 0.7869178512360055
Energy: 1.0191115738395415
Energy: 0.7721232098304234
Energy: 0.7491988358841732
Energy: 0.7721232098290203
Energy: 1.2896882037732935
Energy: 0.8823134488235284
Energy: 0.774562672583947
Energy: 0.8823134490436979
Energy: 0.8050065716619329
Energy: 0.8844048753474575
Energy: 0.7528715952273938
Energy: 0.8844048753481591
Energy: 1.0003329144325657
Energy: 0.7873587142401817
Energy: 0.7798572193143779
Energy: 0.7873587142408832
Energy: 0.7738623430982391
Energy: 0.8554316439102742
Energy: 0.9395155468216028
Energy: 0.8554316439095726
Energy: 0.9844317265592222
Energy: 0.8824492654093495
Energy: 0.7744889604901127
Energy: 0.8824492654079464
Energy: 0.7768584553133542
Energy: 0.8852962476681979
Energy: 0.9378054427198214
Energy: 0.8852962476703027
Energy: 0.7523786739649071
Energy: 0.910906828973145
Energy: 0.7799174986891632
Energy: 0.9109068289752498
Energy: 0.7633825246577981
Energy: 0.858711070045912
Energy: 0.9360302612899174
Energy: 0.8587110700473152
Energy: 0.7450854407233575
Energy: 0.7718137476711591
Energy: 0.7775700472075353
Energy: 0.7718137476739656
Energy: 0.7767912734912894
Energy: 0.8054527815364713
Energy: 1.1780592858947019
Energy: 0.8054527815315602

minimum gb energy = 0.7450854407233575 eV
minimum distance =  2.2732651168743 Angstroms
sigma value = 85


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

Energy: 0.9677509626856372
Energy: 0.755249477557009
Energy: 0.6891467323713525
Energy: 0.7552494775564005
Energy: 1.3894059830240284
Energy: 0.834519239024276
Energy: 0.7103803515153038
Energy: 0.8345192286955813
Energy: 0.9220717882710079
Energy: 0.9222446535959377
Energy: 0.856947650922829
Energy: 0.9222446535965462
Energy: 1.1447052963941846
Energy: 0.8346232797346474
Energy: 0.7100254142724148
Energy: 0.8346232797395151
Energy: 0.7482390345194196
Energy: 0.8917498233793334
Energy: 0.6725395444360451
Energy: 0.8917498233781164
Energy: 1.0144136690367327
Energy: 0.9569131940916931
Energy: 0.710158313235677
Energy: 0.9569131940916931
Energy: 0.7066794817399279
Energy: 0.943585528958699
Energy: 0.777555694170466
Energy: 0.9435855289580903
Energy: 0.8868173684109872
Energy: 0.8345177025187945
Energy: 0.7099570522353966
Energy: 0.8345177025267048
Energy: 0.7092868141652244
Energy: 0.9049836927635274
Energy: 0.8782530039134632
Energy: 0.9049836927635274
Energy: 0.784608659799058
Energy: 0.9436746465459667
Energy: 0.7075609538406678
Energy: 0.9436746465471836
Energy: 0.7118213470328454
Energy: 0.9546291856734646
Energy: 0.9794248060011854
Energy: 0.9546291856746816
Energy: 0.6725043175285944
Energy: 0.747976429294362
Energy: 0.7489035188958212
Energy: 0.7479764292937536
Energy: 0.7097749797487257
Energy: 0.9054683851534523
Energy: 1.1640045365296676
Energy: 0.9054683851540607
Energy: 0.6770626355960464
Energy: 0.9231127576350434
Energy: 0.9229893934330466
Energy: 0.9231127576344349
Energy: 0.7105908119742971
Energy: 0.8347411207817138
Energy: 1.2613489247293403
Energy: 0.8347411207823221
Energy: 0.6750177237177191
Energy: 0.7551074573678476
Energy: 0.9683048976745324
Energy: 0.7551074573678476
Energy: 0.7097458730420451
Energy: 0.9053793220901689
Energy: 1.2610009611301478
Energy: 0.9053793220901689
Energy: 0.8581258257778165
Energy: 0.923491855880658
Energy: 0.9228266079378291
Energy: 0.923491855880658
Energy: 0.7098996023915053
Energy: 0.8347235024072147
Energy: 1.1439807822837975
Energy: 0.8347235024011298
Energy: 0.8405626891543416
Energy: 0.8703919719110992
Energy: 0.7491376340001392
Energy: 0.8703919719092738
Energy: 0.7093818109683725
Energy: 0.9053726253203113
Energy: 1.0139820734139073
Energy: 0.9053726253203113
Energy: 0.8404653756184777
Energy: 0.9551491230311618
Energy: 0.7076978156223547
Energy: 0.9551491230311618
Energy: 0.7100348015860715
Energy: 0.8344292748158307
Energy: 0.8787360221693034
Energy: 0.8344292746193732
Energy: 0.8442081697582516
Energy: 1.0059504068549994
Energy: 0.7101564497163931
Energy: 1.0059504068537823
Energy: 0.7093891658378417
Energy: 0.8352395823610287
Energy: 0.7842736581536293
Energy: 0.8352395823592031
Energy: 1.0455806722011414
Energy: 0.8348057750307372
Energy: 0.710655058721439
Energy: 0.8348057750349964
Energy: 0.75118469616259
Energy: 0.7478403886307959
Energy: 0.6730294846032975
Energy: 0.7478403886314045
Energy: 1.04948048656077
Energy: 0.8885138185223989
Energy: 0.7102663124309283
Energy: 0.8885138185230074
Energy: 0.9245338137860329
Energy: 0.9236664345013558
Energy: 0.6769761877096833
Energy: 0.9236664345013558
Energy: 1.2612029013490755
Energy: 0.8345938038587917
Energy: 0.710659732402671
Energy: 0.8345938038594002
Energy: 0.9706262841392835
Energy: 0.8667203737318099
Energy: 0.6753096410933958
Energy: 0.8667203737318099
Energy: 1.1649465690350147
Energy: 0.8894886398887891
Energy: 0.7100007770730181
Energy: 0.8894886398887891
Energy: 0.9249544483085858
Energy: 0.9234911267312556
Energy: 0.6861667045968656
Energy: 0.9234911267318638
Energy: 1.1439688397060006
Energy: 0.8343627413592408
Energy: 0.7107309832212538
Energy: 0.8343627413598493
Energy: 0.7508951168315268
Energy: 0.7476003041312667
Energy: 0.840856014642615
Energy: 0.7476003041312667
Energy: 0.890967177824605
Energy: 0.7736320414682616
Energy: 0.7102253555567353
Energy: 0.7736320414676531
Energy: 0.7094062429294431
Energy: 0.9547153717393178
Energy: 0.8404399143377229
Energy: 0.9547153717393178
Energy: 0.8766211603340697
Energy: 0.8353267886598436
Energy: 0.7104286382972392
Energy: 0.8353267886604521
Energy: 0.7104192855958479
Energy: 0.7477299061195399
Energy: 0.8441569715174697
Energy: 0.7477299061195399
Energy: 0.68099670028866
Energy: 0.8846867510819889
Energy: 0.7065674179373108
Energy: 0.8846867510813805
Energy: 0.7090756378061664
Energy: 0.8344624575363364
Energy: 1.0444669145812582
Energy: 0.8344624575363364
Energy: 0.6742238164801331
Energy: 0.7476820149507195
Energy: 0.7507064898193441
Energy: 0.747682014951328
Energy: 0.7101069534099201
Energy: 0.7479226565005047
Energy: 1.0489330799630268
Energy: 0.7479226564998962

minimum gb energy = 0.6725043175285944 eV
minimum distance =  2.28795935251954 Angstroms
sigma value = 113


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

Energy: 0.02053841119522704
Energy: 0.021307807719264996
Energy: 0.9546793295555822
Energy: 0.021307807718329456
Energy: 0.95386761327882
Energy: 0.4282207611685292
Energy: 0.4284616564193915
Energy: 0.42822076116899693
Energy: 0.02053841119522704
Energy: 0.021307807719264996
Energy: 0.9546793295560501
Energy: 0.021307807717913657
Energy: 0.95386761327882
Energy: 0.4282207611685292
Energy: 0.4284616564198593
Energy: 0.42822076116899693
Energy: 0.02053841119522704
Energy: 0.021307807719264996
Energy: 0.9546793295560501
Energy: 0.021307807717913657
Energy: 0.95386761327882
Energy: 0.4282207611680614
Energy: 0.4284616564198593
Energy: 0.4282207611685292

minimum gb energy = 0.02053841119522704 eV
minimum distance =  2.48058605290114 Angstroms
sigma value = 1