Model name: model_name=EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.56200759857893
cohesive_energy=4.399993240679222
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[9.48533428273752e-20, 2.6078629071617996e-19, 3.6620791105674603e-19, 4.2384781764152996e-19, 4.57442257303242e-19, 4.84621581722418e-19, 5.1193548897885e-19, 5.405904180779399e-19, 5.68048521231432e-19, 5.926899978623519e-19, 6.140261840973299e-19, 6.32151608357772e-19, 6.47252123133222e-19, 6.5959208756829e-19, 6.6972585477834e-19, 6.78180540875958e-19, 6.8520288106278e-19, 6.909482864723041e-19, 6.955481355885179e-19, 6.99116182952436e-19, 7.01753365692e-19, 7.03546201345446e-19, 7.0457319656784e-19, 7.0490164277781e-19, 7.045507660949639e-19, 7.03341122736294e-19, 7.00643057284638e-19, 6.95594598710904e-19, 6.871655474394299e-19, 6.741302383452059e-19, 6.55027486338024e-19, 6.28112521063458e-19, 5.91557258982114e-19, 5.43589692736788e-19, 4.824506323833479e-19, 4.06142163659196e-19, 3.12297871675914e-19, 1.98057871141812e-19, 5.8855157561673e-20, -1.124689544828784e-19, -3.2562317474089195e-19, -5.9527591094962795e-19, -9.465611488372978e-19, -1.413727016132286e-18, -2.0395067680166397e-18, -2.8771727775708595e-18, -3.98903529626784e-18, -5.43870073647738e-18, -7.29908415681282e-18, -9.749677405581179e-18, -1.3257306688631038e-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: 0.017477527411961832
Energy: 0.4271208869663668
Energy: 0.017735097699825085
Energy: 0.01764569167666355
Energy: 0.44665565918119265
Energy: 0.01797783268819251
Energy: 0.4492212134541421
Energy: 0.1032073769795192
Energy: 0.10355614276779915
Energy: 0.4183972220940241
Energy: 0.42610296182703283
Energy: 0.10293750401295206
Energy: 0.017735097696989784
Energy: 0.10355614277601792
Energy: 0.10303155917161393
Energy: 0.018140546424535317
Energy: 0.4207688045345018
Energy: 0.1029737975292741
Energy: 0.017645691676340537
Energy: 0.41839722258241335
Energy: 0.018140546424535317
Energy: 0.017678608869527563
Energy: 0.41904041750093346
Energy: 0.01789955106333446
Energy: 0.4472981609246294
Energy: 0.4261029617919685
Energy: 0.42076880437098757
Energy: 0.419040418830007
Energy: 0.7482632655121702
Energy: 0.4147617526800118
Energy: 0.01797783268944865
Energy: 0.10293750401295206
Energy: 0.10297379753494469
Energy: 0.01789955106333446
Energy: 0.4147617530130697
Energy: 0.01870923068111377

minimum gb energy = 0.017477527411961832 eV
minimum distance =  2.51208067851038 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.4898483064965247
Energy: 1.5360540824690707
Energy: 1.2339443602460078
Energy: 1.4916349805500069
Energy: 1.5437133942916217
Energy: 1.324623216178784
Energy: 1.331994714986111
Energy: 0.8729514143562048
Energy: 0.8709275319357013
Energy: 1.2777573758375271
Energy: 0.8723518182114357
Energy: 0.871311845670989
Energy: 1.337891917332058
Energy: 0.8715093578310152
Energy: 0.8709734874242873
Energy: 1.3383915292911828
Energy: 0.8713037935263566
Energy: 0.8711379866180956
Energy: 1.643261118202839
Energy: 1.254186646146229
Energy: 1.234694684012247
Energy: 1.6258342074742824
Energy: 1.3055665907852219
Energy: 1.2289288507774228
Energy: 1.2976637500585664
Energy: 0.8798593798159781
Energy: 0.8713675035195833
Energy: 1.3494489752504337
Energy: 1.022643478400079
Energy: 0.8720690166926026
Energy: 1.2971374048964328
Energy: 1.0898084857829944
Energy: 1.092932413101973
Energy: 1.3252854147863156
Energy: 1.0565439610073886
Energy: 1.0791901472206011
Energy: 1.236112390655505
Energy: 1.1755364589683948
Energy: 1.1309559107704414
Energy: 1.2656032408456592
Energy: 1.217884808530575
Energy: 1.0572407290811172
Energy: 1.2577737900794728
Energy: 1.1444539421328424
Energy: 1.1483704500172631
Energy: 1.2598382880461543
Energy: 1.2233812629738985
Energy: 1.0904851467315904
Energy: 1.119245344126731
Energy: 1.0665778054410249
Energy: 1.0742478592370335
Energy: 1.1074806101066264
Energy: 1.0576762362297663
Energy: 1.07171860492096
Energy: 1.1116577012974842
Energy: 0.8657491561795666
Energy: 0.865471092356604
Energy: 1.1141523926417876
Energy: 1.0666374181410894
Energy: 0.8726547518618419
Energy: 1.2710906354300013
Energy: 1.2239853360550361
Energy: 1.2323524275124689
Energy: 1.2728363654309947
Energy: 1.4603929169563468
Energy: 1.2837795329721393
Energy: 0.8789785765477728
Energy: 0.8668750376174401
Energy: 0.8720494793178415
Energy: 0.8813071996146655
Energy: 1.220824717106376
Energy: 0.8716003928689225
Energy: 0.8724858162733431
Energy: 0.8719255226980328
Energy: 0.8713119651097726
Energy: 0.8726559927461133
Energy: 1.278939416250796
Energy: 0.8704000100614843
Energy: 1.5516357385049668
Energy: 1.2661671152824525
Energy: 1.2250470828374052
Energy: 1.5466799042953474
Energy: 1.365062621590627
Energy: 1.3551362916455214
Energy: 0.9537969684900243
Energy: 0.8739516091040218
Energy: 0.8719605706901008
Energy: 0.9556197020136235
Energy: 1.0676937953083483
Energy: 0.8717237508763304
Energy: 0.9636773792924318
Energy: 0.9426919333020011
Energy: 0.9561698567153791
Energy: 0.9644832123897356
Energy: 1.1040555649013362
Energy: 0.9489894444579143
Energy: 1.252935875318171
Energy: 1.1120052801855365
Energy: 1.147586758855003
Energy: 1.255632381785279
Energy: 1.3223490399840814
Energy: 0.9896923957262687
Energy: 1.2074566950408245
Energy: 1.1415043276818573
Energy: 1.1349344037126654
Energy: 1.2075705960894811
Energy: 1.2528897974499316
Energy: 1.125820519240546
Energy: 1.2297157408827897
Energy: 1.06358287703277
Energy: 1.1032293213951103
Energy: 1.2670330586836709
Energy: 1.131367420895025
Energy: 1.1051701292683636
Energy: 1.2509231379840358
Energy: 0.9383663300985429
Energy: 0.8758330094782637
Energy: 1.3247921786564574
Energy: 1.1255964059990866
Energy: 0.9649259881312836
Energy: 1.528813514535766
Energy: 1.1402533042543168
Energy: 1.2253554705115959
Energy: 1.528540931938962
Energy: 1.2237706151489653
Energy: 1.2308935173201272
Energy: 1.2781386216421846
Energy: 0.9491803203475323
Energy: 0.9490179203299913
Energy: 1.2799037285161845
Energy: 0.9563951005698721
Energy: 0.9558167067769139
Energy: 1.3214522716475976
Energy: 0.871706329353698
Energy: 0.8717897966851191
Energy: 1.323510296013073
Energy: 0.9513883695259697
Energy: 0.87173850812049

minimum gb energy = 0.865471092356604 eV
minimum distance =  2.3845888390252 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.7371676848537223
Energy: 1.418625361205603
Energy: 1.41286841109229
Energy: 1.7404450699377176
Energy: 1.451899520187619
Energy: 1.4067716179218397
Energy: 1.354896847055029
Energy: 0.9002709338491873
Energy: 0.9006585926806503
Energy: 1.2545151510461934
Energy: 0.9007459907030919
Energy: 0.9008092285190035
Energy: 1.2439197401363455
Energy: 0.9010707179930664
Energy: 0.90310707255634
Energy: 1.2462651055735703
Energy: 0.9007418021359586
Energy: 0.9008073556556101
Energy: 1.462352286789114
Energy: 0.9678229986085924
Energy: 0.9666032549140605
Energy: 1.4653616844677289
Energy: 1.3050130607166643
Energy: 1.1329293434151615
Energy: 1.340957024534729
Energy: 0.9361742119788666
Energy: 0.9008638860573259
Energy: 1.341783882251013
Energy: 0.9515835263198261
Energy: 0.9017874743102235
Energy: 1.3129730611999595
Energy: 1.0553271228958483
Energy: 1.084968883611944
Energy: 1.2884482355364641
Energy: 1.0680444530159792
Energy: 1.0822855452184308
Energy: 1.2483543722195107
Energy: 1.2235575450366367
Energy: 1.028283739518784
Energy: 1.2685137430049427
Energy: 1.2270832184530645
Energy: 1.0290312750354575
Energy: 1.2328736856852154
Energy: 1.1622230595281677
Energy: 1.1336724399118372
Energy: 1.2740643863832952
Energy: 1.233184842291107
Energy: 1.1343143714454478
Energy: 1.089816196415053
Energy: 1.0732871740997507
Energy: 1.057769302789901
Energy: 1.0899390660807584
Energy: 1.2056593569952567
Energy: 1.057920348431563
Energy: 1.1011009876490916
Energy: 0.8771492070083114
Energy: 0.8763773739523197
Energy: 1.1034507130642957
Energy: 1.276473882552642
Energy: 0.8759891495735046
Energy: 1.08631284696731
Energy: 1.2838493824843529
Energy: 1.2824887957910869
Energy: 1.0864325655239837
Energy: 1.2837235193443253
Energy: 1.2901844147516144
Energy: 0.9168892398104488
Energy: 0.8635619384155522
Energy: 0.8767384885429083
Energy: 0.9166320404687678
Energy: 1.30236884599979
Energy: 0.8736595491974054
Energy: 0.9209592567542881
Energy: 0.9258576331299784
Energy: 0.9178678162364352
Energy: 0.9208804910004921
Energy: 1.1257960713093813
Energy: 0.9164080157395581
Energy: 1.6594180112392631
Energy: 1.2339674873090283
Energy: 1.2340156096861288
Energy: 1.6597111019118798
Energy: 1.4649668953771642
Energy: 1.1153823236571374
Energy: 1.0273285786718036
Energy: 0.9690873304273332
Energy: 0.9677743559515251
Energy: 1.0265542520493782
Energy: 0.9680759108737698
Energy: 0.9368047544547198
Energy: 1.1402602820560779
Energy: 1.016610810337008
Energy: 1.0844128569933131
Energy: 1.1422389697457955
Energy: 1.208827527626583
Energy: 1.0810975779779124
Energy: 1.2337370045589329
Energy: 1.0416344175706118
Energy: 1.0461971885167545
Energy: 1.2344309377412934
Energy: 0.9223529071660024
Energy: 1.0488222878222964
Energy: 1.2789129523327774
Energy: 1.1353352791522122
Energy: 1.1360881883153695
Energy: 1.2621155561592277
Energy: 1.213018801627864
Energy: 1.1340530425302617
Energy: 1.2444317380124894
Energy: 1.0812284925777484
Energy: 1.0817516895824428
Energy: 1.2460479305076941
Energy: 1.1017264912128593
Energy: 1.0758061540492452
Energy: 1.2540918798877787
Energy: 0.8822798440931137
Energy: 0.8829818972369842
Energy: 1.2855274144180973
Energy: 1.112613741363078
Energy: 0.8821935743490376
Energy: 1.6394399492562346
Energy: 1.0989553064255988
Energy: 1.2054738485867982
Energy: 1.6430441518512884
Energy: 1.0927325684083355
Energy: 1.2826889015437957
Energy: 1.313944861371069
Energy: 0.8809715835630844
Energy: 0.8813248838357742
Energy: 1.3027706785726587
Energy: 1.0103846757153285
Energy: 0.8807624359987465
Energy: 1.3236775565087877
Energy: 0.9250343749019926
Energy: 0.9221156976626926
Energy: 1.2694323525656261
Energy: 0.9314884899076932
Energy: 0.923207395418261
Energy: 1.458738036838089
Energy: 1.4858401795026421
Energy: 1.4351417806195128
Energy: 1.4608361952144058
Energy: 1.491015806030566
Energy: 1.1132729681117264
Energy: 1.3163701639415308
Energy: 0.9398502478551845
Energy: 0.9397004664689338
Energy: 1.3169783119324878
Energy: 1.0440681600265391
Energy: 0.9648086556602434
Energy: 1.2703549133132939
Energy: 1.0364017450878302
Energy: 1.1002611529697144
Energy: 1.2710322493318118
Energy: 1.073957505787694
Energy: 1.081612201566551
Energy: 1.3085045523446512
Energy: 1.1352884086857535
Energy: 1.2070534885896056
Energy: 1.2979614492606806
Energy: 1.1229958321390618
Energy: 1.235267459751465
Energy: 1.2034875424143372
Energy: 0.9757399511644417
Energy: 0.9823718204234423
Energy: 1.2821208945954066
Energy: 1.2054448369656086
Energy: 0.994205758843818
Energy: 1.1101642001724266
Energy: 1.1220338950350335
Energy: 1.1157374307401715
Energy: 1.1495224146007719
Energy: 1.210771525596442
Energy: 1.0787045301779064
Energy: 1.1032580569361203
Energy: 1.0572279167552627
Energy: 1.0557491633844025
Energy: 1.1060623652063417
Energy: 1.2854110851807097
Energy: 0.8768209663826588
Energy: 1.0785898081136713
Energy: 1.0745295380875337
Energy: 1.28463254781344
Energy: 1.079321072773555
Energy: 1.0280784433630799
Energy: 1.207054125938835
Energy: 1.013532003357888
Energy: 0.8647304043524453
Energy: 0.9362689740135729
Energy: 1.013464542017549
Energy: 1.3020290462988275
Energy: 0.9504309983557856
Energy: 0.9233274714659113
Energy: 0.8765302678141516
Energy: 0.9181724444168775
Energy: 0.9239810019870729
Energy: 0.9686531721348323
Energy: 0.9174305116453941
Energy: 1.6887459765345052
Energy: 1.2343146876804494
Energy: 1.2361339802996525
Energy: 1.6615858008322633
Energy: 1.4636303398080046
Energy: 1.1072433320618933
Energy: 1.03225241208231
Energy: 0.9162314306149607
Energy: 0.9156054329488212
Energy: 1.032602896333565
Energy: 0.9807605087974156
Energy: 0.9154340508232279
Energy: 1.1472835117337248
Energy: 1.0350599068807693
Energy: 1.0308546968387027
Energy: 1.0683457367399805
Energy: 1.2927325967956758
Energy: 1.0322245698054406
Energy: 1.1760096672742484
Energy: 1.240064030402126
Energy: 1.2436503619725021
Energy: 1.1696222124955427
Energy: 1.2653067269866043
Energy: 1.24265782629299
Energy: 1.2412582357787736
Energy: 1.0557722515786285
Energy: 1.0485283127187088
Energy: 1.2413182792703963
Energy: 1.3038277024574592
Energy: 0.9968360574483666
Energy: 1.23654637042054
Energy: 1.1222210080559671
Energy: 1.1100707602702753
Energy: 1.2225197818311562
Energy: 1.0827738685633925
Energy: 1.1302461901806489
Energy: 1.2909615454022954
Energy: 1.0431601948333697
Energy: 1.0439070407597646
Energy: 1.1929683116647234
Energy: 1.042137121589674
Energy: 1.0441357213792206
Energy: 1.4209030429750158
Energy: 1.083924171667838
Energy: 0.9981503957125675
Energy: 1.4224105513775183
Energy: 1.083182771043339
Energy: 0.9977833749942896

minimum gb energy = 0.8635619384155522 eV
minimum distance =  2.38790634545457 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.501628422091601
Energy: 1.8460585364186322
Energy: 1.4626238996124368
Energy: 1.505041185953397
Energy: 1.8705367184128667
Energy: 1.1620184127453972
Energy: 1.2959559360292305
Energy: 0.9028670948773972
Energy: 0.9041221817330677
Energy: 1.1923157475726986
Energy: 0.8966733528591293
Energy: 0.9038664457015845
Energy: 1.300969333668226
Energy: 0.9039022768499525
Energy: 0.9038302308336117
Energy: 1.2526182528607455
Energy: 0.9029582441479144
Energy: 0.9039337151741261
Energy: 1.388009477541075
Energy: 1.228199552988392
Energy: 1.0918106751658574
Energy: 1.3901778187090732
Energy: 1.276673884357365
Energy: 1.1907303662576172
Energy: 1.3109017595848045
Energy: 0.9033243774582448
Energy: 0.9040751890796306
Energy: 1.3108188617501857
Energy: 1.0897632888310422
Energy: 0.9038550780168736
Energy: 1.2253041704252974
Energy: 1.1676842873146913
Energy: 1.1534015316172674
Energy: 1.227848909893329
Energy: 1.1052460045902783
Energy: 1.108287784523119
Energy: 1.235987046671662
Energy: 1.011343516694752
Energy: 1.0006639290668076
Energy: 1.157114860555628
Energy: 1.2395644303045474
Energy: 1.0530935900489484
Energy: 1.208737134940557
Energy: 1.1908322878891207
Energy: 1.0272697138937315
Energy: 1.2098754127119684
Energy: 0.9324632462459843
Energy: 1.0264901996136315
Energy: 0.9667797052007567
Energy: 1.0578577923771533
Energy: 1.0952371987162095
Energy: 0.9666185341729706
Energy: 1.113351303250635
Energy: 0.9599389883093371
Energy: 0.9015914977014728
Energy: 0.9054878326049821
Energy: 0.9028305626951173
Energy: 0.9019158910549032
Energy: 1.0668882568438705
Energy: 0.9027167950863786
Energy: 1.805446370807225
Energy: 1.3897163661121164
Energy: 1.5528266273939129
Energy: 1.8040155652110894
Energy: 1.1671166162729703
Energy: 1.4950313960416577
Energy: 1.010119008149505
Energy: 0.9065945358545111
Energy: 0.9045299213017628
Energy: 1.0102130763744703
Energy: 1.2397709019203502
Energy: 0.9029069101738795
Energy: 1.1034162349933512
Energy: 1.1067652307808387
Energy: 1.046696953199261
Energy: 1.1035543904986924
Energy: 1.1953239229448185
Energy: 1.0445796620697696
Energy: 1.0826072670078788
Energy: 1.2500612962388302
Energy: 1.249664233847067
Energy: 1.082306859112541
Energy: 1.3075312142877582
Energy: 1.2525734426524087
Energy: 1.3176350578239746
Energy: 1.247207216608727
Energy: 1.1122994514598497
Energy: 1.3118813050497757
Energy: 1.2981547997237373
Energy: 1.0561177154842456
Energy: 1.2593948046228836
Energy: 1.08042390222025
Energy: 1.0634010196791412
Energy: 1.2614542031825753
Energy: 1.0756290430597324
Energy: 1.2042937290661204
Energy: 1.3128455436414266
Energy: 0.9035162199916783
Energy: 0.9056954290563722
Energy: 1.2598836852070474
Energy: 1.011490264327447
Energy: 0.9002839556892946
Energy: 1.5657195506010182
Energy: 0.9933280983252208
Energy: 0.9927233990054438
Energy: 1.2535030415014117
Energy: 1.1489188209056764
Energy: 0.8632665580356848

minimum gb energy = 0.8632665580356848 eV
minimum distance =  2.38297186842967 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.2499928299502752
Energy: 0.8806187810236631
Energy: 1.1693702864617923
Energy: 1.248439915054531
Energy: 1.6474130369230524
Energy: 1.1681740838772645
Energy: 1.022550445176056
Energy: 0.9301152443108553
Energy: 0.9567505655469738
Energy: 1.0967524877546426
Energy: 0.9342913207765211
Energy: 0.9548328891946518
Energy: 1.2950364952642466
Energy: 0.9277025131751452
Energy: 0.9247343134184904
Energy: 1.2961484587359582
Energy: 0.999081896496825
Energy: 0.8925339263799273
Energy: 1.1070049100907073
Energy: 0.9265901222972764
Energy: 0.9262723450302534
Energy: 1.1082556415275897
Energy: 0.9038937844795364
Energy: 0.9254204811534692
Energy: 1.1783467377198311
Energy: 0.9544519858625602
Energy: 0.9548832386856462
Energy: 1.1780043742367163
Energy: 0.9549205169077645
Energy: 0.9485712628502394
Energy: 1.125705246540117
Energy: 0.922153435475487
Energy: 0.9134828330000382
Energy: 1.1282007644194365
Energy: 0.9207245769943659
Energy: 0.9130893353597472
Energy: 1.1122682053380795
Energy: 0.9394717434511268
Energy: 0.918756625318166
Energy: 1.1135529408373628
Energy: 1.0808730180922912
Energy: 0.9325893747378168
Energy: 0.9399561474017515
Energy: 1.171202212724446
Energy: 1.1711386820909089
Energy: 0.9277979761054405
Energy: 1.2615530659974736
Energy: 1.0204809153971126
Energy: 0.956277209978597
Energy: 0.9832532358985547
Energy: 0.9798074055867425
Energy: 0.9559633482949204
Energy: 1.0713847600130306
Energy: 0.9849534191711629
Energy: 1.0062507852845872
Energy: 0.9020610096100723
Energy: 0.892700967727003
Energy: 1.0070768784379793
Energy: 1.0847882177296169
Energy: 0.8925795918028551
Energy: 0.8783878683319731
Energy: 1.0841450286640366
Energy: 1.0959640866916809
Energy: 0.9232248003319262
Energy: 1.1063150586705774
Energy: 1.0479447314400951
Energy: 1.1069072366989616
Energy: 0.9384485413858024
Energy: 0.9316633764710726
Energy: 1.1110691440495426
Energy: 1.0595458815842282
Energy: 0.8826810274551681
Energy: 0.9742375735218181
Energy: 0.9706277157711029
Energy: 1.1002367020948314
Energy: 0.9771903711543892
Energy: 0.9707858276897245
Energy: 1.0979252172405702
Energy: 1.0253277000631789
Energy: 1.1005410996699734
Energy: 1.1019660181966207
Energy: 0.9424441898846999
Energy: 1.1302968592002984
Energy: 1.0667838647698404
Energy: 1.1695534673544552
Energy: 1.0574533515211406
Energy: 0.9616441535970266
Energy: 1.1914487802807872
Energy: 1.0537551632256612
Energy: 0.9795801872092817
Energy: 1.2596428404316338
Energy: 0.9168866164450808
Energy: 1.020435375204201
Energy: 1.2605278414209304
Energy: 0.9167189386015866
Energy: 1.1705796832152853
Energy: 1.1833146600044402
Energy: 0.9979368451815852
Energy: 0.9503772030815514
Energy: 1.0846629594835089
Energy: 1.0077464804229501
Energy: 0.9479507733581357
Energy: 1.046721849314548
Energy: 0.9317875198675771
Energy: 0.9262469095949207
Energy: 1.0473699687800744
Energy: 0.9255581127885741
Energy: 0.9261119235619182
Energy: 1.1173969698830029
Energy: 0.9401248224713549
Energy: 0.9394058662281366
Energy: 1.1167954433159035
Energy: 1.0456759348956832
Energy: 0.9394736888597786
Energy: 1.0366758428393579
Energy: 0.9208788190846161
Energy: 1.1059456116505662
Energy: 1.0272062932277077
Energy: 0.9202712518435556
Energy: 1.1050098515427553
Energy: 1.123103267494566
Energy: 0.8913794294869631
Energy: 0.8920885317351561
Energy: 1.1351766224830546
Energy: 0.8781859374108533
Energy: 1.1017813029408343
Energy: 1.0353255589257075
Energy: 0.903302311280614
Energy: 0.9118803819198027
Energy: 1.0365221014843402
Energy: 1.0846635107532552
Energy: 0.9110994561005948
Energy: 0.9021882637975498
Energy: 1.1689504548888263
Energy: 1.168745199850681
Energy: 0.9049205121615121
Energy: 1.2519492326094779
Energy: 1.16904699447289
Energy: 0.9331916694944036
Energy: 0.9491153247067989
Energy: 0.9497408294328714
Energy: 0.9337673856282318
Energy: 1.171004662890889
Energy: 0.9565961236285108
Energy: 1.0002083445389542
Energy: 0.9265244326987279
Energy: 0.8928938549966048
Energy: 1.0090243510988444
Energy: 1.1573661864411504
Energy: 0.8930739805265889
Energy: 0.9042052486625656
Energy: 1.1060972860148384
Energy: 0.9466528073854947
Energy: 0.9031846214043663
Energy: 1.1075404136491034
Energy: 0.9262309304143581
Energy: 1.105151951503057
Energy: 0.9487674897433199
Energy: 0.948722953950412
Energy: 1.108798711737576
Energy: 1.188328418252184
Energy: 0.9480626240095992
Energy: 0.9184669235724483
Energy: 1.106235594727297
Energy: 0.9141244262395759
Energy: 0.9195145763763909
Energy: 0.965132105283351
Energy: 0.9131379876960792
Energy: 1.1758029239306662
Energy: 0.9723092077492698
Energy: 0.9319734218385026
Energy: 1.081396580869073
Energy: 0.9691658136582644
Energy: 0.9220978288845495
Energy: 1.2596941759462066
Energy: 0.9290498906565071
Energy: 1.0204429867888598
Energy: 1.261042675306517
Energy: 0.9389466881183165
Energy: 1.0207576176389512

minimum gb energy = 0.8781859374108533 eV
minimum distance =  2.37800586518833 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.031084832233842
Energy: 1.3622617739617462
Energy: 1.528636918588484
Energy: 1.0320266495946768
Energy: 1.3637141125963226
Energy: 1.5311702662511484
Energy: 1.087439250370792
Energy: 0.8898076028796442
Energy: 0.8898836174123782
Energy: 1.0910049432254116
Energy: 0.8837699435928978
Energy: 0.8908501352880892
Energy: 1.0646151317729373
Energy: 0.911555506214003
Energy: 0.911867799428351
Energy: 1.0712565788988282
Energy: 0.9064719418554035
Energy: 0.8957374554097043
Energy: 1.262556620571477
Energy: 0.8997216572521637
Energy: 1.0957230448491597
Energy: 1.259386842386746
Energy: 1.0916553952708519
Energy: 1.0962510137217334
Energy: 1.0944916616932705
Energy: 1.0325847873232183
Energy: 0.9968214826670561
Energy: 1.0911562007262552
Energy: 1.0321893942171696
Energy: 1.0022801602665037
Energy: 1.0482185716370322
Energy: 1.0297629105835517
Energy: 1.0315048243574847
Energy: 1.0442804519425883
Energy: 1.0456004696526946
Energy: 0.896320735390264
Energy: 0.8949988964443644
Energy: 0.8313943264480209
Energy: 0.8290055227221574
Energy: 0.8960547329620143
Energy: 0.9187876719239316
Energy: 0.9060887657849711
Energy: 1.1570738316796418
Energy: 0.9843356025348936
Energy: 0.9842145066654185
Energy: 1.1567340737592602
Energy: 0.9559719437976023
Energy: 1.1698761082004099
Energy: 1.188987471933472
Energy: 0.9768459595384752
Energy: 0.9060527136913189
Energy: 1.188925294782737
Energy: 0.9198149976112036
Energy: 0.9809268782845542
Energy: 0.9285870851430015
Energy: 0.9402947702200559
Energy: 0.9588863362441338
Energy: 0.9328548012317578
Energy: 0.9305638701139213
Energy: 0.9590587114166755
Energy: 0.9258448666889717
Energy: 0.972342450997627
Energy: 0.9738461023746661
Energy: 0.9345885564935593
Energy: 0.9690208393225239
Energy: 0.9568796146337607
Energy: 1.0865990311493874
Energy: 0.8885853115328705
Energy: 0.8891259232881104
Energy: 1.0645609333116455
Energy: 0.9983265653872253
Energy: 0.8898535033952858

minimum gb energy = 0.8290055227221574 eV
minimum distance =  2.36338600763875 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.7382581193045071
Energy: 1.299285879443025
Energy: 0.7235691703319185
Energy: 0.7394627138984251
Energy: 1.2889831814946882
Energy: 0.893578898972847
Energy: 0.9596357168584098
Energy: 0.8868475398026157
Energy: 0.8869271156123283
Energy: 0.7356882885241638
Energy: 0.7934009524142619
Energy: 0.8713414323685879
Energy: 0.7426650222261358
Energy: 0.7210553773518248
Energy: 0.7285923693386968
Energy: 0.7894564733050637
Energy: 0.724805458504662
Energy: 0.7307242158959313
Energy: 1.1512957403509814
Energy: 0.783377952636512
Energy: 0.9524270783054682
Energy: 1.1368371433722835
Energy: 0.8908537520167983
Energy: 0.9528050453440989
Energy: 1.057752105934665
Energy: 0.9754733549083479
Energy: 0.9129554829032452
Energy: 1.0572081109846914
Energy: 0.8951049391011596
Energy: 0.9347907074866106
Energy: 0.8101612675773917
Energy: 0.7555750572774179
Energy: 0.8642592986477371
Energy: 0.809902200632079
Energy: 0.7135473838725254
Energy: 0.7054852933468483
Energy: 0.9501916934618174
Energy: 0.9127382866006423
Energy: 0.8689327990976797
Energy: 0.9522517666603275
Energy: 0.929381908585455
Energy: 0.8700973282668946
Energy: 0.845574348315418
Energy: 0.9688519964329493
Energy: 0.9969114509506527
Energy: 0.8466834977911891
Energy: 0.7862672437743413
Energy: 0.8431568125938645
Energy: 0.9911516600588025
Energy: 0.883347320061461
Energy: 0.9476562049021514
Energy: 0.992811149248067
Energy: 0.8415956540891424
Energy: 0.898466318320285
Energy: 1.4962901129489656
Energy: 0.7885405717334926
Energy: 0.8654541075440767
Energy: 1.4648159209662093
Energy: 0.9929018735390068
Energy: 1.094674231389922
Energy: 0.6872983299106936
Energy: 0.7350161432945941
Energy: 0.7347483030862328
Energy: 0.7289102883048315
Energy: 0.7360760135282226
Energy: 0.73580186822172
Energy: 0.9200594816801427
Energy: 0.8292128990499387
Energy: 0.8286496989020598
Energy: 0.920358278185651
Energy: 0.8332618293164684
Energy: 0.8294163765862755
Energy: 1.0509368693451935
Energy: 1.2605753942475153
Energy: 0.9341605571557912
Energy: 1.0521177212313917
Energy: 1.2582172689427624
Energy: 1.0382029984661356
Energy: 0.9177553424884386
Energy: 0.7570261022287686
Energy: 0.9144330421115561
Energy: 0.9179116341288499
Energy: 1.0480311895681813
Energy: 0.9199675556600942
Energy: 0.882099234689298
Energy: 0.820979531009076
Energy: 0.8244012978439441
Energy: 0.8775983992190167
Energy: 0.818025822065287
Energy: 1.0138576747792918
Energy: 0.8330683324092981
Energy: 0.802285909443367
Energy: 0.7232345671983555
Energy: 0.8234610454219313
Energy: 0.801942637968697
Energy: 0.7223530520864974
Energy: 0.7937915036323224
Energy: 1.006140356058867
Energy: 0.7894413310398796
Energy: 0.7936661413577402
Energy: 0.9085689428720655
Energy: 0.789984587056311
Energy: 0.886874448675378
Energy: 0.8167022617041104
Energy: 0.8835086708362809
Energy: 0.9174153305972237
Energy: 0.7403931129047777
Energy: 0.7998924864983737
Energy: 0.7385996749916992
Energy: 0.8631263375299704
Energy: 0.8400420587078352
Energy: 0.7384463599313559
Energy: 0.7605092099163346
Energy: 0.7256546051617488
Energy: 0.7540543357608497
Energy: 0.7624395333440158
Energy: 0.7610841278216393
Energy: 0.7540352718967744
Energy: 0.7560926470259873
Energy: 0.761591286681971
Energy: 0.7463542712696715
Energy: 0.7233777527302762
Energy: 0.7241201775391207
Energy: 0.7574777967075621
Energy: 0.747180818444617
Energy: 0.7512287818847645
Energy: 0.7288989153976397
Energy: 0.7253620551680228
Energy: 0.8871218026382144
Energy: 0.7315665229246702
Energy: 0.8995782231424596
Energy: 0.8633679341714984
Energy: 0.99805354401722
Energy: 0.7935285747602294
Energy: 0.7278286982187496
Energy: 0.8952482343300471
Energy: 0.7933728479001301
Energy: 0.8869307671714408
Energy: 0.7434324462267768
Energy: 0.7212260322316528
Energy: 0.7301226943806431
Energy: 0.7430897562831897
Energy: 0.7220853194552822
Energy: 0.7230876208151069
Energy: 1.091731905455721
Energy: 0.8769944269406249
Energy: 1.036187012644524
Energy: 1.0945308316054343
Energy: 0.877362194307893
Energy: 1.0073304467592457
Energy: 1.0023407576038483
Energy: 0.8653269098623065
Energy: 0.898904960113333
Energy: 1.0038909831166023
Energy: 0.9380001854678108
Energy: 0.9072563097799384
Energy: 1.0600004343556824
Energy: 1.1789299535478612
Energy: 1.1753109971664701
Energy: 1.061594174221981
Energy: 1.1797319558310169
Energy: 0.8495545804716834
Energy: 0.8298975006352813
Energy: 0.9038800317238823
Energy: 0.9028335058333401
Energy: 0.8311615824349567
Energy: 0.9095805638483151
Energy: 0.8286434534440082
Energy: 0.8399775614892407
Energy: 0.8254991297077052
Energy: 0.7349052431450852
Energy: 0.8414436018000432
Energy: 0.8065802889507431
Energy: 0.734369771538633
Energy: 0.95431531865471
Energy: 0.7912529901325261
Energy: 0.9975862962849521
Energy: 0.9552019435979336
Energy: 0.7870710283213072
Energy: 0.8936796380635158
Energy: 0.6848597351188916
Energy: 0.7558191813355444
Energy: 0.8642557860185509
Energy: 0.6855246251647448
Energy: 0.9946796044287987
Energy: 0.9844337556362452
Energy: 1.4958403206249968
Energy: 0.8439036503943813
Energy: 0.8452424860713709
Energy: 1.4652456170141614
Energy: 0.8443102714343685
Energy: 1.0883875866851125
Energy: 0.8258167105821538
Energy: 0.828651224219457
Energy: 0.8209754739455366
Energy: 0.9216518476530247
Energy: 0.8565691724908887
Energy: 0.818948106440323
Energy: 1.1183177019316046
Energy: 0.8094411964896091
Energy: 0.8085480929425857
Energy: 1.1051156772487927
Energy: 0.8109997919486885
Energy: 0.8174171728952457
Energy: 0.7146219489022112
Energy: 0.8073178932760874
Energy: 0.8074788429487754
Energy: 0.7140470456795774
Energy: 1.084891678181764
Energy: 0.8886040663185475
Energy: 0.9796898853461941
Energy: 0.8243561425859374
Energy: 0.9860407928681427
Energy: 0.9803045191443057
Energy: 0.8260100616844412
Energy: 0.9474137200780269
Energy: 0.8318650679463891
Energy: 0.799990851986333
Energy: 0.798327228940541
Energy: 0.833977473710507
Energy: 0.7928650141801297
Energy: 0.7284105014227665
Energy: 0.792173119412007
Energy: 0.8289828882029746
Energy: 0.8698349949090343
Energy: 0.7920389892980763
Energy: 0.9162202952159846
Energy: 0.7924634364973439
Energy: 1.0997141740390546
Energy: 1.0363176030074972
Energy: 1.0311924070842429
Energy: 1.1003053089624135
Energy: 1.0420452967127944
Energy: 0.8970639239556354
Energy: 0.885726934079449
Energy: 0.8239526180867417
Energy: 0.8704601037666504
Energy: 0.8854307816865159
Energy: 0.8690602927159832
Energy: 0.8684042480435157
Energy: 0.7539804040907293
Energy: 0.7609539815686182
Energy: 0.7835228218727296
Energy: 0.7610468993299874
Energy: 0.7590847956066845
Energy: 0.7657726320003343
Energy: 0.7441772676530711
Energy: 0.7632235294680689
Energy: 0.7674687066058106
Energy: 0.7448642266278281
Energy: 0.7566506756271991
Energy: 0.7672433340761552
Energy: 0.9964653801403746
Energy: 0.7266385061173453
Energy: 0.7278076990574238
Energy: 0.9980913421893653
Energy: 0.9172651635783896
Energy: 0.8827815282826282

minimum gb energy = 0.6848597351188916 eV
minimum distance =  2.34239706395534 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.3193108493822275
Energy: 0.37778296749519685
Energy: 0.3316520265926943
Energy: 0.3215983026171586
Energy: 1.7017076885159819
Energy: 0.32579412603850005
Energy: 0.3873249310522343
Energy: 0.3662547584091318
Energy: 0.38670528331797277
Energy: 0.3702941723376923
Energy: 0.37188288800319347
Energy: 0.38649228732356417
Energy: 0.3986435660315636
Energy: 0.3652797569003203
Energy: 0.3654950422302375
Energy: 0.3961019096655996
Energy: 0.3653680662147223
Energy: 0.36533180283229366
Energy: 0.3967136307450845
Energy: 0.41843233074985575
Energy: 0.3655930224039678
Energy: 0.3983045978009028
Energy: 0.4089208949106508
Energy: 0.36930371500797843
Energy: 0.40107973932085716
Energy: 0.32754857866454934
Energy: 0.3566852231221687
Energy: 0.4018555902654604
Energy: 0.3242964916890882
Energy: 0.36464988558106487
Energy: 0.36929508764643987
Energy: 0.31941609220797224
Energy: 0.3208961208964297
Energy: 0.3710116666525869
Energy: 0.32331362859918356
Energy: 0.34922548216678917
Energy: 0.3558347454343276
Energy: 0.3934653840189623
Energy: 0.381451647887196
Energy: 0.3578066697059321
Energy: 0.41841339264780986
Energy: 0.3802462445119607
Energy: 0.36560907983622154
Energy: 0.41047539536646843
Energy: 0.4108756670173298
Energy: 0.3676468442046454
Energy: 0.4171335733717437
Energy: 0.37157474945300034
Energy: 0.4014340087160279
Energy: 0.4093085763380268
Energy: 0.36527881307094534
Energy: 0.40298378852207917
Energy: 0.3988252503256113
Energy: 0.3650304340831084
Energy: 0.32823101827001105
Energy: 0.36668563632005247
Energy: 0.35223390471050164
Energy: 0.31972914589327045
Energy: 0.4067306977244831
Energy: 0.3508181354342636
Energy: 0.3237808685529743
Energy: 0.35549422309927015
Energy: 0.3914310191756362
Energy: 0.3281437383480494
Energy: 0.3642154671095165
Energy: 0.35489984797004753
Energy: 0.4047242371894501
Energy: 0.3747057440472548
Energy: 0.3654961296955636
Energy: 0.40539075926170215
Energy: 0.37454917137335547
Energy: 0.3944134942754564
Energy: 0.4036164409788427
Energy: 0.39582449038590234
Energy: 0.4110238257100154
Energy: 0.4039251503949304
Energy: 0.39621502040980905
Energy: 0.4096445792019591
Energy: 0.4031832480716659
Energy: 0.3640047664481592
Energy: 0.3676598185776599
Energy: 0.40452798235221626
Energy: 0.37288962327289177
Energy: 0.3653848463803365
Energy: 0.40365069509031204
Energy: 0.3234955255539893
Energy: 0.3205456610365658
Energy: 0.40309628102997935
Energy: 0.32466815583484937
Energy: 0.3237022071280395
Energy: 0.3715478272143895
Energy: 0.3732788723817659
Energy: 0.38507573848603754
Energy: 0.37178125778212845
Energy: 0.324643366491588
Energy: 0.3867132726268555
Energy: 0.365549757311583
Energy: 0.41173135621973417
Energy: 0.3663369535062204
Energy: 0.3649625775394017
Energy: 0.37309127294168215
Energy: 0.36590085044684534
Energy: 0.39587643502368375
Energy: 0.41372641686229794
Energy: 0.41660294043122875
Energy: 0.39565037116051877
Energy: 0.4167511011208589
Energy: 0.36535546100828825
Energy: 0.324871398982925
Energy: 0.36481520314816696
Energy: 0.3643876261076594
Energy: 0.3243597456372269
Energy: 0.4033648077142614
Energy: 0.3648412794173785

minimum gb energy = 0.3193108493822275 eV
minimum distance =  2.41883595072692 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 1.6077680596629842
Energy: 1.9237782363829072
Energy: 1.1564307009894366
Energy: 1.6092649332176694
Energy: 1.9213517820381076
Energy: 1.147756605467625
Energy: 0.5633952822022373
Energy: 0.5712191134910493
Energy: 0.6370405710951881
Energy: 0.5703676425995255
Energy: 0.5721354370836678
Energy: 0.6381626355985456
Energy: 0.60465325298915
Energy: 0.6148424374765131
Energy: 0.6146283736047671
Energy: 0.607287169552966
Energy: 0.6089582656505786
Energy: 0.6214858628487724
Energy: 0.5939809987931092
Energy: 0.6937654760339867
Energy: 0.7083844895463988
Energy: 0.5953782314088086
Energy: 0.5582482323970547
Energy: 0.6188065690267526
Energy: 0.5717928313732069
Energy: 0.9162347839459677
Energy: 0.9342581605017257
Energy: 0.5724264095410867
Energy: 1.0317924328519794
Energy: 0.6788690014313983
Energy: 0.8500886686099647
Energy: 1.1048083981597738
Energy: 1.0056517126425075
Energy: 0.8467849061509005
Energy: 1.152209465581606
Energy: 1.105652771415348
Energy: 0.59695793891091
Energy: 0.6703772778702485
Energy: 0.8350916820184207
Energy: 0.5980385765759473
Energy: 0.5709745838338145
Energy: 0.6420641027086574
Energy: 0.6604618265584324
Energy: 0.770903345451227
Energy: 0.7611344366858109
Energy: 0.6628408859153602
Energy: 0.7652536535323109
Energy: 0.8536978580583323
Energy: 0.8190483390023929
Energy: 0.6878869767694095
Energy: 0.6921128234909467
Energy: 0.821106856143112
Energy: 0.7479773525626849
Energy: 0.7453750855754274
Energy: 1.1366093201886525
Energy: 1.1257430530564143
Energy: 1.1039005710402983
Energy: 1.1644426385650206
Energy: 1.1208518717447649
Energy: 1.0165653779601393
Energy: 1.0652191060128746
Energy: 0.8813199818462875
Energy: 0.7025452946129194
Energy: 1.0779685742646017
Energy: 1.1303926021209798
Energy: 0.911289626972894
Energy: 1.0874842943734653
Energy: 0.6843816434193069
Energy: 0.7417611733848155
Energy: 1.088040682430221
Energy: 0.5504003723946326
Energy: 0.9537713719148663
Energy: 0.9595923327764635
Energy: 0.569855925673656
Energy: 1.0066049761393732
Energy: 0.9614216622235936
Energy: 0.9861944531070176
Energy: 0.9378952321999926
Energy: 0.8845154173247355
Energy: 0.8425453142601136
Energy: 0.7977419505583067
Energy: 0.8861583695022257
Energy: 1.0484170774125185
Energy: 0.8794962826844565
Energy: 1.2659673813837413
Energy: 1.0730223259684755
Energy: 1.0746986726387409
Energy: 1.2675685008621524
Energy: 1.42855879990742
Energy: 1.10361543415705
Energy: 1.134492153292094
Energy: 0.8183275307763366
Energy: 0.8198321044496255
Energy: 1.136903435060242
Energy: 0.9690249721395929
Energy: 0.8711831162794041
Energy: 1.1593976737245257
Energy: 1.293094460713114
Energy: 1.0610649380410393
Energy: 1.1617818676027547
Energy: 1.3651531089285047
Energy: 1.066190100295207
Energy: 1.1199554166216985
Energy: 0.9757402426770977
Energy: 0.9660519821837079
Energy: 1.1277060020060967
Energy: 0.9762943898205921
Energy: 0.9297975868596251
Energy: 1.0958700508916486
Energy: 0.9555138250191525
Energy: 0.9658939893708234
Energy: 1.0979508866236691
Energy: 0.9486558413162718
Energy: 0.9116985751392519
Energy: 0.8925799522352886
Energy: 1.1710273505502877
Energy: 1.0372847186324528
Energy: 0.8949174448044862
Energy: 1.1699162134563728
Energy: 1.0337730933250113
Energy: 0.8986401479606306
Energy: 0.8175655637507205
Energy: 0.8090692223016117
Energy: 0.899024247362501
Energy: 1.0691591515505523
Energy: 0.8955749211555051
Energy: 1.4623398588016576
Energy: 1.190689060148605
Energy: 1.1175891711785835
Energy: 1.4637787866402339
Energy: 1.6673511424671326
Energy: 1.1313765084667156
Energy: 0.7976144243808484
Energy: 0.8335130274633358
Energy: 0.6933367288074461
Energy: 0.6921184576997311
Energy: 0.8248430949468797
Energy: 0.6865411243866366
Energy: 0.7463958027519387
Energy: 0.6213744309868697
Energy: 0.7783660421078935
Energy: 0.7488460730324783
Energy: 0.8187365013717051
Energy: 0.7409150844537724
Energy: 0.7916372173154828
Energy: 0.5737971820903102
Energy: 0.6142291101110331
Energy: 0.7936247113966367
Energy: 0.5670560175459072
Energy: 0.8180953186125186
Energy: 1.0039624814995551
Energy: 0.5679752508047559
Energy: 0.6329226704038432
Energy: 1.003662065353721
Energy: 0.6035396394851017
Energy: 0.6989052023097577

minimum gb energy = 0.5504003723946326 eV
minimum distance =  2.37520817537356 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.5561667774903478
Energy: 1.2078349366281447
Energy: 1.3352207123590307
Energy: 1.5583399184543467
Energy: 1.2236379042255183
Energy: 1.0167963248611893
Energy: 0.6286000068711809
Energy: 0.6325023662394786
Energy: 0.8459753158164407
Energy: 0.6273420356384166
Energy: 0.6330637659265405
Energy: 0.7282634048130162
Energy: 0.6736273404510937
Energy: 0.6720113296958666
Energy: 0.7024939613572664
Energy: 0.6732309261846889
Energy: 0.6727082997261902
Energy: 0.6968254150687652
Energy: 0.6717011505898057
Energy: 0.6510252275765284
Energy: 0.7930384498299384
Energy: 0.6726120723156824
Energy: 0.6349663856635307
Energy: 0.696675051491878
Energy: 0.6239681347080002
Energy: 0.9555890634038268
Energy: 0.8898655033423909
Energy: 0.6236580465618393
Energy: 0.9178126797051178
Energy: 0.6182976832375582
Energy: 1.1197845161327034
Energy: 0.7861057059495578
Energy: 0.9402119450306411
Energy: 1.1131032952854243
Energy: 0.7979809029077866
Energy: 1.0786311005299138
Energy: 0.6805315564872859
Energy: 0.7570531854060039
Energy: 0.8848527518632904
Energy: 0.6769565883459575
Energy: 0.6325966176853703
Energy: 0.8646267863696345
Energy: 0.7493261210527803
Energy: 0.9323430223920163
Energy: 0.9322934428317567
Energy: 0.7509865618726755
Energy: 0.9305443238231174
Energy: 0.7562951161589647
Energy: 0.9294560839090255
Energy: 0.7473402788876878
Energy: 0.7542088076598017
Energy: 0.9217577433954862
Energy: 0.7514400401679846
Energy: 0.8240242515584727
Energy: 1.15368072527262
Energy: 1.168712784523249
Energy: 1.1684238333324852
Energy: 1.0832556784345961
Energy: 1.2173804763577987
Energy: 1.168976105286731
Energy: 0.9924268832058208
Energy: 0.9800468747603346
Energy: 1.0041642342610344
Energy: 0.9600439246791989
Energy: 1.0218295160749016
Energy: 0.9492435430512182
Energy: 1.2758831254613723
Energy: 0.6052533672807043
Energy: 0.9083192001523755
Energy: 1.2779448873216925
Energy: 0.6016044093840719
Energy: 0.9003905302062845
Energy: 1.167664366445492
Energy: 0.6079492666339174
Energy: 0.9098046004992892
Energy: 1.1672176955617721
Energy: 0.6065637301831843
Energy: 0.8949063027913686
Energy: 0.784955653700462
Energy: 0.8245343301643794
Energy: 0.8994841140182532
Energy: 0.7808137693440454
Energy: 0.9675443202133156
Energy: 0.7920964466206477
Energy: 0.8696274938411859
Energy: 1.037724964661428
Energy: 1.0354498694973757
Energy: 0.8701251319028817
Energy: 1.2119204032648585
Energy: 0.986785638097317
Energy: 0.6275039273129488
Energy: 0.7515931472659181
Energy: 0.7501076960716463
Energy: 0.6272214505552355
Energy: 0.7530833820461692
Energy: 0.9134362286701986
Energy: 1.5891379657167053
Energy: 1.014478210913084
Energy: 1.2126255097573662
Energy: 1.5871622439028983
Energy: 1.0638436117655548
Energy: 0.9135924586242337
Energy: 0.892087485340976
Energy: 0.8430033648063305
Energy: 0.9337519370428028
Energy: 0.612282289999169
Energy: 0.8289079229051107
Energy: 0.7249044157349539
Energy: 0.6734752376251469
Energy: 0.6318306543641455
Energy: 0.7032159420547719
Energy: 0.6776390118308685
Energy: 0.676945783026526
Energy: 0.7366736440768669
Energy: 0.6851642102252145
Energy: 0.6986529975583051
Energy: 0.7221603122467356
Energy: 0.6816774132618415
Energy: 0.6738314447800711
Energy: 0.7002889233329896
Energy: 0.7581632713287771
Energy: 0.8551402633620531
Energy: 0.8300343870308053
Energy: 0.7583387432949236
Energy: 0.7621820114363898
Energy: 0.619509585873733
Energy: 1.419638329920429
Energy: 1.2279091201529035
Energy: 1.2773601509070516
Energy: 1.421628924105908
Energy: 1.9160152396849444
Energy: 1.2968822897599088
Energy: 0.9703887288556152
Energy: 0.8533675472436809
Energy: 0.8546660886350769
Energy: 0.9709643130527038
Energy: 0.8296226970413086
Energy: 0.7499737934736935
Energy: 0.7507652281390141
Energy: 0.9992263389898495
Energy: 1.0467424712342286
Energy: 0.7507433795958468
Energy: 1.0021315866490417
Energy: 0.6983930319033791
Energy: 0.9236739060905921
Energy: 0.7928362112150149
Energy: 0.7916139435045944
Energy: 0.9289089461219021
Energy: 0.788822947418477
Energy: 0.7456215587380746
Energy: 1.0762769758385784
Energy: 0.996580331575171
Energy: 0.9968017614366664
Energy: 1.0785411825818598
Energy: 1.1202988786436618
Energy: 0.9246941253413062
Energy: 1.1344890709806636
Energy: 1.1649967470137244
Energy: 1.0919506797944438
Energy: 1.0845461161383907
Energy: 1.2300565312069622
Energy: 1.1610040750288
Energy: 0.9716177849678065
Energy: 0.6042402041924075
Energy: 0.9538665687319482
Energy: 0.9713240006955908
Energy: 0.7264771967098888
Energy: 0.8793062763790691
Energy: 1.2182837053943354
Energy: 1.2453735472774676
Energy: 0.9563243763629945
Energy: 1.217293546627411
Energy: 0.6100992240786585
Energy: 1.0170890287712622
Energy: 0.7870751604771847
Energy: 0.8791239989328483
Energy: 0.9302640584554169
Energy: 0.7824375239156645
Energy: 0.9594489590359881
Energy: 0.7548431968654462
Energy: 0.8710780669576247
Energy: 0.68046948342461
Energy: 0.8689228211577625
Energy: 0.8709868300555355
Energy: 0.6769727450281928
Energy: 0.8693207080512969
Energy: 0.6344056509066371
Energy: 0.6363964946390916
Energy: 0.8332623158735629
Energy: 0.635358077458609
Energy: 0.6301945326403479
Energy: 0.8699621288656488
Energy: 1.4342849333627328
Energy: 0.8312314067066359
Energy: 1.0304301087837568
Energy: 1.4316271252164658
Energy: 0.9153820943431358
Energy: 1.0325154619391212

minimum gb energy = 0.6016044093840719 eV
minimum distance =  2.35952046693219 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.8689658700718209
Energy: 1.3342095252454258
Energy: 1.6157747309781012
Energy: 0.8710370633330984
Energy: 2.103299019618557
Energy: 1.194618806200988
Energy: 0.6927926201101311
Energy: 0.8009756832906029
Energy: 0.7965444556194414
Energy: 0.7015216793212989
Energy: 0.7134286807550959
Energy: 0.7955094427989611
Energy: 0.7803794896292169
Energy: 0.7345988152854841
Energy: 0.8189242381869536
Energy: 0.7818430432183618
Energy: 0.7796288246501725
Energy: 0.8162308780318418
Energy: 0.782763473626264
Energy: 0.7098160249839666
Energy: 0.8174553169883967
Energy: 0.7846274480070432
Energy: 0.7302589296025767
Energy: 0.8167052123446485
Energy: 0.8304672771037493
Energy: 0.9019888128071284
Energy: 0.8677349273740222
Energy: 0.8306730812117462
Energy: 0.7943351405407505
Energy: 0.799479800009629
Energy: 1.0629138329501122
Energy: 0.7732846653367864
Energy: 0.8423000573273277
Energy: 1.0624010563284398
Energy: 0.8583553397894026
Energy: 0.9085679581499551
Energy: 0.9442677559606858
Energy: 0.7886397498746285
Energy: 0.9801224013182266
Energy: 0.7924093615726608
Energy: 0.776841981096939
Energy: 0.8940507197125018
Energy: 0.8458660323988201
Energy: 1.1490706715700316
Energy: 0.7717229532513985
Energy: 0.8476823354854355
Energy: 1.1508036063881837
Energy: 0.8215639177265711
Energy: 0.9852845405540398
Energy: 0.8988135428464
Energy: 0.8777374337001471
Energy: 1.006832160738981
Energy: 0.9014864010111647
Energy: 1.012414368706121
Energy: 1.365828504868814
Energy: 1.0903671219138733
Energy: 0.8739992003630338
Energy: 0.7822779090356843
Energy: 1.0900871256883025
Energy: 0.7991385979001414
Energy: 1.0120753108127438
Energy: 0.7886010895692909
Energy: 0.7786293879288753
Energy: 0.817382329059147
Energy: 0.9209452188071219
Energy: 0.8677723193771458
Energy: 0.947329513070535
Energy: 0.7897404201248747
Energy: 0.9589812810504266
Energy: 0.9489308443067502
Energy: 0.7864055629981498
Energy: 0.8797991127474761
Energy: 0.8830764858794649
Energy: 0.8572375990296355
Energy: 0.8889136583711624
Energy: 0.8799669146691841
Energy: 0.7007470082805155
Energy: 0.8731565964239613
Energy: 0.7062142957226293
Energy: 0.6924309767097755
Energy: 0.8413790313496853
Energy: 0.7081238243030505
Energy: 0.9673247839890569
Energy: 0.7084805727201887
Energy: 0.8213660981746811
Energy: 0.801306813654914
Energy: 0.8041435611480084
Energy: 0.8805005060971977
Energy: 0.7840361910230275
Energy: 0.7396686255420631
Energy: 0.6875271849324187
Energy: 0.7970131273686927
Energy: 0.796386336472371
Energy: 0.6883521745878636
Energy: 0.7946266375458808
Energy: 0.973141317887465
Energy: 1.4443804958349507
Energy: 0.9552024495225154
Energy: 0.9366295789110097
Energy: 1.4465145810330753
Energy: 0.9546842350095036
Energy: 0.7929101858717056
Energy: 0.769049850969395
Energy: 0.9119066889231172
Energy: 0.8730995626710711
Energy: 0.7584259242959663
Energy: 1.0594240748008885
Energy: 0.8509214143736634
Energy: 0.9418857523902558
Energy: 0.8413242304662846
Energy: 0.817028381049117
Energy: 0.9416130461045211
Energy: 0.851926624351575
Energy: 0.9602916104478673
Energy: 0.6977279624047852
Energy: 0.7018363548713493
Energy: 0.7448326206668309
Energy: 0.6970439305749329
Energy: 0.8518174106710878
Energy: 0.7979296411767037
Energy: 0.7118382605051358
Energy: 0.7955410210333168
Energy: 0.8609711801536671
Energy: 0.7129597782180663
Energy: 0.722261306202082
Energy: 0.9395009875618427
Energy: 1.1874881519500864
Energy: 0.9249138971781966
Energy: 0.8914436515428538
Energy: 1.1887632130624046
Energy: 1.4818311430399276
Energy: 0.9148357134012056
Energy: 0.9722774742059196
Energy: 0.7990616390498817
Energy: 0.7946212029400787
Energy: 0.972704934704109
Energy: 0.9429946485861778
Energy: 0.7756538263947093
Energy: 0.8284047255330816
Energy: 1.2022351394699127
Energy: 1.184073697544804
Energy: 2.0224685871173884
Energy: 1.2018909721106663
Energy: 0.87206412637893
Energy: 0.9374767277087492
Energy: 0.8011680946081192
Energy: 0.8001481456907054
Energy: 0.931674856182229
Energy: 0.7150933593619849
Energy: 0.7981418819279708
Energy: 0.781472992810002
Energy: 0.7343442071572027
Energy: 0.8162857623506133
Energy: 0.7831146630137981
Energy: 0.7818103332609521
Energy: 0.7136491579121874
Energy: 0.7819948464978698
Energy: 0.7282366219443192
Energy: 0.8110538570978235
Energy: 0.7830261035926204
Energy: 0.7303369498255624
Energy: 0.8166723087802661
Energy: 0.8307542352578776
Energy: 0.776665346382298
Energy: 0.8655603687291561
Energy: 0.8303382194927537
Energy: 0.6934334422593739
Energy: 0.800194643715517
Energy: 1.3151133356729663
Energy: 0.7708928073299286
Energy: 0.9185941764486082
Energy: 1.2743943358576761
Energy: 1.4471488124689438
Energy: 0.7831283450419677
Energy: 0.9427706295634591
Energy: 0.7867501258902405
Energy: 0.8633118343133688
Energy: 0.9434537102958049
Energy: 0.7767967959555158
Energy: 0.8839702653787714
Energy: 0.8469766793091865
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Energy: 0.7720203114409858
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Energy: 1.2504216535975132
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Energy: 1.014582318750717
Energy: 0.8016040827344179
Energy: 0.799841258525579
Energy: 0.7792112189779778
Energy: 0.79840169367602
Energy: 0.7984444547274905
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Energy: 0.9037472617557122
Energy: 0.7770644289565578
Energy: 0.8565561958057047
Energy: 1.2012522043306202
Energy: 0.9130409600424003
Energy: 0.9903727124705624
Energy: 0.8786730629895647
Energy: 0.9019732557157072
Energy: 0.9926123547583687
Energy: 0.8749561031052661
Energy: 0.8084923131541049
Energy: 1.100089596603896
Energy: 0.7089632732132918
Energy: 0.8874163593450682
Energy: 1.0997391321263892
Energy: 0.7052359135030151
Energy: 0.9535024114563407
Energy: 0.8136548470740352
Energy: 0.8487322984678592
Energy: 0.843312074227834
Energy: 0.814509076811027
Energy: 0.9830974691131862
Energy: 0.7933564451383757
Energy: 0.8199084067663949
Energy: 0.8064352582586921
Energy: 0.8057887392407839
Energy: 0.8218365343433733
Energy: 0.7849758440988016
Energy: 0.8068254968478796
Energy: 0.6850241224078369
Energy: 0.7974610832663012
Energy: 0.794742240179014
Energy: 0.6860655165538563
Energy: 0.7079061096662987
Energy: 0.9538182006677252
Energy: 1.348016569939803
Energy: 0.9121654651724047
Energy: 0.9139315294940019
Energy: 1.3483013430010748
Energy: 0.9122740708123095
Energy: 0.7916942042486347
Energy: 0.7687784118322565
Energy: 0.9128467047933118
Energy: 0.9837256830199498
Energy: 0.7716184798199437
Energy: 1.0630420789658115
Energy: 0.842206634518192
Energy: 0.9202273760827648
Energy: 0.7509420026756534
Energy: 0.7441209839274705
Energy: 0.9213464477075239
Energy: 0.8548351289900936
Energy: 0.9596398383911051
Energy: 0.7996052920450837
Energy: 0.798870887361181
Energy: 0.7479141655487281
Energy: 0.8018359239071925
Energy: 0.8494860379781464
Energy: 0.7017718322536727
Energy: 0.7114210164425953
Energy: 0.9492291479293739
Energy: 1.0283390408460185
Energy: 0.7126504152370869
Energy: 0.7266923479188439
Energy: 0.8780226492611052
Energy: 1.1694052079053445
Energy: 0.8995657795605125
Energy: 0.9024857090114273
Energy: 1.0894918790795045
Energy: 1.4810385752411943
Energy: 1.0891696060381444
Energy: 0.9686922604248587
Energy: 0.7977464442966546
Energy: 0.9034954589019861
Energy: 0.969654807918676
Energy: 0.7950357307547337
Energy: 0.7762652276358651
Energy: 2.105103658765333
Energy: 1.2010535088185315
Energy: 0.9524944401862808
Energy: 0.7030607771855465
Energy: 1.2012739087298272
Energy: 0.8864841739818524

minimum gb energy = 0.6850241224078369 eV
minimum distance =  2.35531727270724 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.0241442316241964
Energy: 0.8458444896199351
Energy: 0.9236427991763143
Energy: 1.0268017326057473
Energy: 0.8860421321971163
Energy: 1.175236210383829
Energy: 0.9361298378079173
Energy: 0.7821415401680637
Energy: 0.7719168201550585
Energy: 0.9539957058269011
Energy: 0.7829007263793543
Energy: 0.760050543950694
Energy: 0.9472841290910625
Energy: 0.8505909753844073
Energy: 0.887717794883959
Energy: 0.9483821528881495
Energy: 0.8525061250381533
Energy: 0.8884794577823685
Energy: 0.9043830583228666
Energy: 0.8902969448946213
Energy: 0.8467439852345424
Energy: 0.9052037597812986
Energy: 0.8859876745013741
Energy: 0.8467730990678631
Energy: 0.8371828619464687
Energy: 0.8503353276513814
Energy: 0.8425853367875871
Energy: 0.8376198549294187
Energy: 0.821591069397668
Energy: 0.8462126168109526
Energy: 0.8384186222532394
Energy: 0.9325798842596363
Energy: 0.8382205353357584
Energy: 0.838905805633179
Energy: 0.9310036914263596
Energy: 0.8387254701457937
Energy: 0.9741140723011542
Energy: 0.7993337015315854
Energy: 0.7967814327712689
Energy: 0.9735525722931544
Energy: 0.8492702298514571
Energy: 0.7788830755531438

minimum gb energy = 0.760050543950694 eV
minimum distance =  2.41795905187906 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.4381835662863907
Energy: 1.4959557344079633
Energy: 1.0187388259550731
Energy: 1.3681453886758934
Energy: 1.8714936506691493
Energy: 1.0695729819894753
Energy: 1.3523464283640667
Energy: 1.101268638044624
Energy: 1.0472575150006107
Energy: 1.2056146827243253
Energy: 1.0994163072645504
Energy: 0.9950679010334273
Energy: 1.23440817109156
Energy: 1.303709045257648
Energy: 1.0679211628546437
Energy: 1.1366433715872082
Energy: 1.2787574217849815
Energy: 1.1951268784877032
Energy: 0.9888768384472625
Energy: 1.013653364052065
Energy: 1.0707202463018328
Energy: 1.007936434295177
Energy: 1.238208126151309
Energy: 0.9071864503026843
Energy: 1.002247157406086
Energy: 1.041093032797132
Energy: 1.0912566154716934
Energy: 1.0237627628490347
Energy: 1.1806140675487116
Energy: 0.9717221841556859
Energy: 1.1562795301474615
Energy: 1.2574555970274928
Energy: 1.1514315600910372
Energy: 1.1552033422227102
Energy: 1.2499933758070156
Energy: 1.1502830378454387
Energy: 1.2527444198025792
Energy: 1.1416750889565153
Energy: 1.074263196267603
Energy: 1.2440024386069297
Energy: 1.1230889376902928
Energy: 1.1408369349924212
Energy: 1.3488960788415927
Energy: 1.352985858019033
Energy: 1.30597820725074
Energy: 1.3496443924737247
Energy: 1.3484912367386688
Energy: 1.0916493313496085
Energy: 1.2532251735017252
Energy: 1.1350915113504287
Energy: 1.0698066920930314
Energy: 1.2570305981723504
Energy: 1.2170535207979187
Energy: 1.1471319328883955
Energy: 1.312840105950686
Energy: 1.257970271421611
Energy: 1.152356066108884
Energy: 1.3293684803068904
Energy: 1.4360185269731482
Energy: 1.235840628093984
Energy: 1.1968202881081278
Energy: 1.1619625978960373
Energy: 1.0357239649162115
Energy: 1.1990265370859603
Energy: 1.1649550733669467
Energy: 1.137876583367738
Energy: 1.2518941397876617
Energy: 1.1666240041968545
Energy: 1.1681646194647546
Energy: 1.1970342849736497
Energy: 1.1349051923940037
Energy: 1.1721574923801394
Energy: 1.1262949195475416
Energy: 1.0555654997981028
Energy: 1.0581113070261774
Energy: 1.1284419183446293
Energy: 1.1157555925566003
Energy: 1.0528340663123603
Energy: 1.2429112010243657
Energy: 0.987459954625009
Energy: 0.9863101284194123
Energy: 1.2448446727385614
Energy: 0.9817536228290712
Energy: 0.9794777769186243
Energy: 1.2065231766215578
Energy: 1.2308968062706376
Energy: 1.2326566833162482
Energy: 1.2102070075698137
Energy: 1.224042591467401
Energy: 1.1576074739733169
Energy: 1.2700646668832358
Energy: 1.0230224950860238
Energy: 1.0293069067577036
Energy: 1.2719435728651578
Energy: 1.1676331890746792
Energy: 1.0568017981416211
Energy: 1.2943144975515142
Energy: 1.2024860037535137
Energy: 1.1433094627540734
Energy: 1.295312106718482
Energy: 1.3859240912629034
Energy: 1.209811558493561
Energy: 1.3974417910437826
Energy: 1.098724309870595
Energy: 1.0554301834023678
Energy: 1.3899240965016317
Energy: 1.1306693233299845
Energy: 1.125875700714745
Energy: 1.3567825314470745
Energy: 1.2508397336083374
Energy: 1.1138848554544758
Energy: 1.3316305108208324
Energy: 1.2441559600755385
Energy: 0.9566020143074802
Energy: 1.3422998824098251
Energy: 1.041446511834259
Energy: 1.0421796179914333
Energy: 1.3221197357311256
Energy: 1.0325219109514518
Energy: 0.957836561873098
Energy: 1.1861247243259443
Energy: 1.0553677700896347
Energy: 1.0744720915942787
Energy: 1.1891934924812906
Energy: 1.0386171623076106
Energy: 1.1435931387611824
Energy: 1.134899720027424
Energy: 1.1553724158196759
Energy: 1.1463081680871248
Energy: 1.136817654271832
Energy: 1.1526288902304556
Energy: 1.1914283203596276
Energy: 1.0319585967592608
Energy: 1.101475492873697
Energy: 1.1235394266100538
Energy: 1.0339603883710637
Energy: 1.163596768168714
Energy: 1.0120795568022967
Energy: 1.2676497493077303
Energy: 1.4241586727939057
Energy: 1.1265053982864184
Energy: 1.189454125682241
Energy: 1.3507249175604124
Energy: 1.1899057346230955
Energy: 1.283360208040982
Energy: 1.2349783487303112
Energy: 1.111501580619745
Energy: 1.2674914459545492
Energy: 1.1821899362544876
Energy: 1.021153779287539
Energy: 1.332848519167635
Energy: 1.3296279269041265
Energy: 1.144734135348069
Energy: 1.2318637452590724
Energy: 1.3226405242174024
Energy: 1.096151312884454
Energy: 1.2283204764493414
Energy: 1.275607483369123
Energy: 1.170540002004657
Energy: 1.2295030927626496
Energy: 1.2669774958152797
Energy: 1.037517799723017
Energy: 1.2692763245792231
Energy: 1.2433027861706312
Energy: 1.0793937981007597
Energy: 1.2294950839412475
Energy: 1.173355432973995
Energy: 1.081470604095671
Energy: 1.165421785455357
Energy: 1.304358919118259
Energy: 1.086209101950834
Energy: 1.1670839198654672
Energy: 1.2761675700762782
Energy: 1.0985859125576503
Energy: 1.0013552660326044
Energy: 1.0694112281547379
Energy: 1.017124239720811
Energy: 1.003403523314056
Energy: 1.204896430352886
Energy: 1.0148989846403595
Energy: 1.125345920544593
Energy: 1.2364610640612252
Energy: 1.2546960087013368
Energy: 1.1272823536504994
Energy: 1.2333673818714153
Energy: 1.154499113490085
Energy: 1.2570733047527816
Energy: 1.1382415882646042
Energy: 1.0614437819390399
Energy: 1.252601099527971
Energy: 1.131371029675657
Energy: 1.0666674020421043
Energy: 1.3997458804445226
Energy: 1.2112222277766342
Energy: 1.1437221381917648
Energy: 1.40164966936191
Energy: 1.2716997320497436
Energy: 1.0119399111361844
Energy: 1.29339788751204
Energy: 1.2549859593048638
Energy: 1.1805131052550366
Energy: 1.2476953561666357
Energy: 1.25566157413738
Energy: 1.1787515607176406
Energy: 1.2816663500382404
Energy: 1.1255911236056557
Energy: 1.0902664963361275
Energy: 1.2758272129301589
Energy: 1.1394796965941538
Energy: 1.0885597010959536
Energy: 1.1755391223552547
Energy: 1.180449674444484
Energy: 1.164924222668138
Energy: 1.1767228394184899
Energy: 1.464311897145622
Energy: 1.1430001893102708
Energy: 1.1335989326179192
Energy: 1.073673265142743
Energy: 1.0810180440317445
Energy: 1.1357051077991536
Energy: 1.2264978846061825
Energy: 1.1415592384702422
Energy: 1.1383197571809995
Energy: 1.142324770316016
Energy: 1.1600171796445915
Energy: 1.139894807171335
Energy: 1.138337723010825
Energy: 1.1687034620488044
Energy: 1.186868666832588
Energy: 0.9965010019231806
Energy: 0.9938045896287153
Energy: 1.1717595089503918
Energy: 0.9930889295645753
Energy: 0.9771140747423812
Energy: 1.2181207308769058
Energy: 1.1616610276248325
Energy: 1.0627478935599235
Energy: 1.220255614076085
Energy: 1.1657002886832282
Energy: 1.0111370658331422
Energy: 1.282340920180479
Energy: 1.1672628544648624
Energy: 1.0583294579519056
Energy: 1.260444705640804
Energy: 1.2440334202250094
Energy: 1.028858974454638
Energy: 1.379684687969483
Energy: 1.1159519193411775
Energy: 1.1207788988534566
Energy: 1.3854142719415001
Energy: 1.2037034757415732
Energy: 1.2044374145567465
Energy: 1.351558489277609
Energy: 1.110513372553934
Energy: 1.076322543752735
Energy: 1.3334799883801618
Energy: 1.441934975884432
Energy: 1.1972038547747572
Energy: 1.2576991543106806
Energy: 1.049421014811386
Energy: 1.0360518413534179
Energy: 1.2854354182165184
Energy: 1.2456761985368394
Energy: 1.05450457559382
Energy: 1.2715192344918609
Energy: 1.0709697424685398
Energy: 1.1544336968255724
Energy: 1.2729082526497915
Energy: 1.2941399999482373
Energy: 1.1601158254941193
Energy: 1.222260572529453
Energy: 1.0492930288527695
Energy: 1.0364518328839922
Energy: 1.2098192849348495
Energy: 1.0330649727682562
Energy: 1.070256008352019
Energy: 1.144840031512395
Energy: 1.1558805535866563
Energy: 1.1644700126463317
Energy: 1.1337967567073515
Energy: 1.1334565680720894
Energy: 1.1504575689750172
Energy: 1.053565640829979
Energy: 1.0409135449745854
Energy: 1.130764288882999
Energy: 1.0667218745298943
Energy: 1.0830569243451493
Energy: 1.105195962510083
Energy: 1.089596587517611
Energy: 0.9698739490381283
Energy: 1.0720648966488453
Energy: 1.1001636438133389
Energy: 1.308347181312461
Energy: 0.9402505476641002
Energy: 1.3127232156953537
Energy: 1.0490274283532526
Energy: 1.0000018795079464
Energy: 1.2208421282591526
Energy: 1.4113353852575858
Energy: 0.9806431569012145
Energy: 1.3228973842901055
Energy: 1.10181445974077
Energy: 1.0507652424241591
Energy: 1.261831371926346
Energy: 1.1610027465486075
Energy: 1.0382072720776792

minimum gb energy = 0.9071864503026843 eV
minimum distance =  2.38194832761369 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.7066455553063418
Energy: 1.1509379422357393
Energy: 1.1060043476353267
Energy: 1.4044498119451845
Energy: 1.289479508209113
Energy: 1.2474171219241466
Energy: 1.5386875150731147
Energy: 0.9673157051698138
Energy: 0.8896778961697185
Energy: 1.1535597595111142
Energy: 0.9778653578584152
Energy: 0.9809643530861939
Energy: 1.4132159780204105
Energy: 1.2113541209220224
Energy: 1.126068476089029
Energy: 1.137517566493786
Energy: 1.212203805769782
Energy: 1.1837475120225105
Energy: 1.2389781898930563
Energy: 1.0976650882503043
Energy: 1.427664483625063
Energy: 1.2853837862241442
Energy: 1.1808213368720646
Energy: 1.0798096307163962
Energy: 1.2380743932915457
Energy: 0.9205191893829265
Energy: 1.0102013808180588
Energy: 1.1539119861929812
Energy: 1.0809450539934666
Energy: 0.9555917497962173
Energy: 1.391036603824502
Energy: 1.0706425118175456
Energy: 1.046257546424029
Energy: 1.3881317037271999
Energy: 1.4463925655883592
Energy: 1.314708680272666
Energy: 1.1313825076953585
Energy: 1.1660282274326836
Energy: 1.0159108848038354
Energy: 1.131334191119493
Energy: 1.4190036391871867
Energy: 1.0575603840215253
Energy: 1.4017634480568621
Energy: 1.4694783334111161
Energy: 1.468256911449372
Energy: 1.40311905739621
Energy: 1.2751884827333413
Energy: 1.1585757380447141
Energy: 1.134062066348585
Energy: 1.259192467271326
Energy: 1.1261525726297679
Energy: 1.1351236794386006
Energy: 1.2728843166624286
Energy: 1.0696552451372072
Energy: 1.260634178716704
Energy: 1.143666186931591
Energy: 1.1456801367870475
Energy: 1.2227892038512758
Energy: 1.4289559357472978
Energy: 1.1398689519058782
Energy: 1.0661587499808736
Energy: 1.076330804297557
Energy: 1.0337582720032497
Energy: 1.0760811123527274
Energy: 1.175521595609594
Energy: 1.0452574410675444
Energy: 1.1870619215895128
Energy: 1.260570404403171
Energy: 1.2266189102133696
Energy: 1.188012398236559
Energy: 1.1923629314713198
Energy: 1.2725697827216917
Energy: 1.2097411717710849
Energy: 1.3121060889297045
Energy: 1.317444400620909
Energy: 1.2114343234813856
Energy: 1.3327675861689794
Energy: 1.2183695686235683
Energy: 1.24070767605923
Energy: 1.0306941568470203
Energy: 1.057962361345398
Energy: 1.2129639830804124
Energy: 1.173207269022637
Energy: 1.0492949601213029
Energy: 1.5079198273668015
Energy: 1.3920338900267704
Energy: 1.4225349065830533
Energy: 1.508101353436181
Energy: 1.390656362247014
Energy: 1.217855317139404
Energy: 1.4275203770239038
Energy: 1.1336525988211448
Energy: 1.1168144188958304
Energy: 1.3953387737609724
Energy: 1.2013641622854565
Energy: 1.066079276909222
Energy: 1.4189481480589812
Energy: 1.3927128137856277
Energy: 1.2275793454596726
Energy: 1.3835686809515002
Energy: 1.405397237548709
Energy: 1.2272199983311733
Energy: 1.2696630157776507
Energy: 1.0503414804023898
Energy: 1.1714705193480914
Energy: 1.4592099625140755
Energy: 1.1022314320737805
Energy: 1.2928506669579762
Energy: 1.1739342147150709
Energy: 1.2030565288116208
Energy: 1.0405504457408135
Energy: 1.3059760330313819
Energy: 1.2076676443060168
Energy: 0.886276037957428
Energy: 1.1771423815895634
Energy: 1.047612710209665
Energy: 1.0335802656046909
Energy: 1.2662668996774809
Energy: 1.052906273512787
Energy: 0.8850635349254771
Energy: 1.1233902657611472
Energy: 1.0506757728730516
Energy: 1.1602784732530433
Energy: 1.0748446549229655
Energy: 1.1031502617602984
Energy: 1.2914098628396458
Energy: 1.2129046318286751
Energy: 1.2337861076464993
Energy: 1.125276130064207
Energy: 1.3011690812294496
Energy: 1.2316843706883371
Energy: 1.1162829288936418
Energy: 1.2809520641935483
Energy: 1.1255523559720388
Energy: 1.1004575278387578
Energy: 1.2482861533422007
Energy: 1.2222245850914453
Energy: 1.0395851784858146
Energy: 1.3527671093395912
Energy: 1.3858015244581023
Energy: 1.3723209109194514
Energy: 1.3896582082251934
Energy: 1.5089265437650021
Energy: 1.38826793097376
Energy: 1.193570047153354
Energy: 1.3030364447032865
Energy: 1.1028796082138268
Energy: 1.2007030603349604
Energy: 1.2902687329931541
Energy: 1.0947662354551408
Energy: 1.454252720058527
Energy: 1.4309227546177052
Energy: 1.4757759868998266
Energy: 1.4538711960854707
Energy: 1.3872635524197356
Energy: 1.1343085594195486
Energy: 1.3040334235633182
Energy: 1.3332068781685815
Energy: 1.300449129278273
Energy: 1.3052051647703609
Energy: 1.5087544065526108
Energy: 1.109822186009351
Energy: 1.1856409962124335
Energy: 1.1300267091368505
Energy: 1.041184730746987
Energy: 1.1926741703720898
Energy: 1.2461848980451915
Energy: 1.0458788304130726
Energy: 1.2209264955528079
Energy: 1.1010749179433632
Energy: 1.101045715212452
Energy: 1.1498626506327683
Energy: 1.605557909951536
Energy: 1.3076312022908883
Energy: 1.0042520992791772
Energy: 1.1160131921066059
Energy: 1.1076761908876418
Energy: 1.0529776999408598
Energy: 1.12629005367673
Energy: 1.1072915566045671
Energy: 1.2104873173556772
Energy: 1.2273837481555336
Energy: 1.1718469489405297
Energy: 1.212082247088707
Energy: 1.4313075051761646
Energy: 1.1565263467499325
Energy: 1.0085112058564674
Energy: 1.2720118350385055
Energy: 1.2718901970529755
Energy: 1.0092530579756025
Energy: 1.2442618132694803
Energy: 1.2258650755602087
Energy: 1.196482825605857
Energy: 1.3227213083350273
Energy: 0.9025903893354015
Energy: 1.197759076396522
Energy: 1.124069386643273
Energy: 1.1473523972313708
Energy: 1.3792759215062094
Energy: 1.0154097480895468
Energy: 1.0021423430145653
Energy: 1.4204902831064714
Energy: 1.0535101453034061
Energy: 0.9742370314844512
Energy: 1.383767103859419
Energy: 0.991446905663533
Energy: 1.3196891975469895
Energy: 1.4316804477536778
Energy: 1.249147706581861
Energy: 1.0833447052435883
Energy: 1.509332143062208
Energy: 1.1947382893060672
Energy: 1.1592304769786186
Energy: 1.2128913236301722
Energy: 1.4543176174967736
Energy: 1.1586432724780344
Energy: 1.5351741867951132
Energy: 0.9596117898325442
Energy: 0.8896727795064501
Energy: 1.1546975301154085
Energy: 1.100002854071567
Energy: 0.964229733109894
Energy: 1.7069392845460656
Energy: 1.14150996505704
Energy: 1.1397811533303488
Energy: 1.398265489662089
Energy: 1.1438567138755988
Energy: 1.2715819367435286

minimum gb energy = 0.8850635349254771 eV
minimum distance =  2.37688762935212 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.4570650534882141
Energy: 1.539843365134701
Energy: 1.1031630579919613
Energy: 1.4594611170346268
Energy: 1.5455260401251474
Energy: 1.1440575878064538
Energy: 1.1931664703171239
Energy: 1.1072820794915321
Energy: 0.9527264448775846
Energy: 1.1594760668784951
Energy: 1.106884862795067
Energy: 1.0643924394120647
Energy: 1.1803889718129912
Energy: 1.0647705730579764
Energy: 0.8852788325230124
Energy: 1.1806776346432055
Energy: 1.3622844858074932
Energy: 1.130660658058507
Energy: 0.9170525030865162
Energy: 0.9872896612955961
Energy: 0.9173764534152623
Energy: 0.9157785314562058
Energy: 1.174130413511313
Energy: 0.9169640507326909
Energy: 0.9354692957300056
Energy: 1.0343209817449146
Energy: 1.0478203086957667
Energy: 0.9353562288827354
Energy: 1.1149456869807397
Energy: 1.0670711916165714
Energy: 1.0801899680444507
Energy: 1.0951711419482228
Energy: 1.0374428493908314
Energy: 1.0811005614744367
Energy: 1.0616676963089535
Energy: 1.0181773091300517
Energy: 1.0633330879390956
Energy: 0.9179906110080894
Energy: 0.9181200818080018
Energy: 1.0636319920759716
Energy: 0.9181115682786659
Energy: 0.918076932813485
Energy: 1.2517050166041421
Energy: 1.1997736957539942
Energy: 1.20066175683519
Energy: 1.252044593154661
Energy: 1.1985091679231321
Energy: 1.200637558780626
Energy: 1.1169718187754896
Energy: 0.9353935502238764
Energy: 0.9356511329733264
Energy: 1.1180038787208373
Energy: 1.1010610924471
Energy: 1.0336271847309222
Energy: 1.2898988736580723
Energy: 1.1734683473237533
Energy: 1.0599016262043328
Energy: 1.290857764321735
Energy: 1.4256872486460623
Energy: 1.1703375500295172
Energy: 1.1778053555475254
Energy: 1.14484127380192
Energy: 1.091416469520531
Energy: 1.177764439811138
Energy: 1.167152204313822
Energy: 1.0738673633772606
Energy: 1.169998925877059
Energy: 1.1140720185497923
Energy: 0.9234281727744211
Energy: 0.9936685651570805
Energy: 1.1908680310701598
Energy: 0.9233845007136601
Energy: 1.3806055905238883
Energy: 0.9983478225420076
Energy: 1.0159887915137256
Energy: 1.3651368739456042
Energy: 1.004512844267181
Energy: 0.9575640629858725
Energy: 1.0803031786512454
Energy: 0.9908576865912027
Energy: 1.051811781120923
Energy: 1.08025637786926
Energy: 1.0005084385538483
Energy: 1.152301573614836
Energy: 1.056283800321933
Energy: 1.1697385996421996
Energy: 1.1683809836280106
Energy: 1.0517187237725758
Energy: 1.0900223954958455
Energy: 1.0508382763604065
Energy: 0.8802681099090871
Energy: 1.0177468849319946
Energy: 0.8902033983957688
Energy: 0.8801987687780868
Energy: 1.1025381822069116
Energy: 0.8794236455244021
Energy: 1.0827621249545398
Energy: 1.2139549691630824
Energy: 0.8826996771831889
Energy: 1.0828581619525361
Energy: 1.1419465495503642
Energy: 0.893530676964521
Energy: 1.182525080160972
Energy: 1.1179455924603094
Energy: 0.8840236111202551
Energy: 1.1745717968751264
Energy: 1.1136803533710273
Energy: 0.92213437069725
Energy: 1.2587854605541582
Energy: 1.1123386007561091
Energy: 0.9433346165190445
Energy: 1.2596996970551693
Energy: 1.1896959902489102
Energy: 0.9323943414708834
Energy: 1.2899686391623486
Energy: 1.2018769339430326
Energy: 1.1017877279495205
Energy: 1.2899186708688428
Energy: 1.2149582425778775
Energy: 0.9232560789403969
Energy: 1.2720629267775938
Energy: 1.0990983494033604
Energy: 1.1079309497434102
Energy: 1.2698916571927765
Energy: 1.1477106689762246
Energy: 1.0103251904452553
Energy: 1.1086316579539937
Energy: 1.322553969224027
Energy: 1.1597259022500956
Energy: 1.1088979575222113
Energy: 1.3026063291161958
Energy: 1.173420355005764
Energy: 1.1012272001735013
Energy: 1.0073199001610966
Energy: 1.107587340788351
Energy: 1.1021204326360583
Energy: 1.0392979625926677
Energy: 1.1068097890660131
Energy: 1.2009242155531892
Energy: 1.1290650214188198
Energy: 1.1503726678254578
Energy: 1.201885106854995
Energy: 1.1287985016635778
Energy: 1.105084753206057
Energy: 1.1007299727013748
Energy: 0.8888324308343951
Energy: 0.889127151845302
Energy: 1.1010740693497372
Energy: 0.8797873441401769
Energy: 0.8888177292318556
Energy: 1.177694295537454
Energy: 0.9074157294026033
Energy: 0.9493443346478091
Energy: 1.1792792230516735
Energy: 0.9054059676340284
Energy: 0.8934915360555601
Energy: 1.1158083997797237
Energy: 1.144307197719639
Energy: 1.1762315310592133
Energy: 1.1309983728217234
Energy: 1.0889086029832398
Energy: 1.0660305701396253
Energy: 1.0037175529478406
Energy: 1.0769702607888787
Energy: 1.0291036991212827
Energy: 1.0020745906995212
Energy: 1.0803765528869511
Energy: 0.9358324563185908
Energy: 1.256458487218095
Energy: 1.2019366523498791
Energy: 1.1518104791307637
Energy: 1.2577261484559643
Energy: 1.247779062984812
Energy: 1.185226366135439
Energy: 1.1933265549229766
Energy: 1.1045543017569377
Energy: 1.0761313069595455
Energy: 1.1922428297010643
Energy: 1.1578379958735705
Energy: 1.0339991300025297
Energy: 1.4762101175835496
Energy: 1.3187864783612293
Energy: 1.1466044836039042
Energy: 1.4800856393589998
Energy: 1.3284823358151956
Energy: 1.1031460769952754

minimum gb energy = 0.8794236455244021 eV
minimum distance =  2.33095213851707 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.109243699327816
Energy: 1.507005612169965
Energy: 1.1522273282980666
Energy: 1.1085865426073467
Energy: 1.2032500378284288
Energy: 1.1540447904147733
Energy: 1.073442308194405
Energy: 1.019127382246899
Energy: 0.9250437724183377
Energy: 0.9617503763941719
Energy: 0.9651551120715911
Energy: 1.0150793495020713
Energy: 1.1316918884759686
Energy: 1.021915476898257
Energy: 1.0227436239714822
Energy: 1.1316727462686966
Energy: 1.129135693933811
Energy: 1.0231562527909266
Energy: 0.9139279040620911
Energy: 1.0831607154024017
Energy: 0.9759779705892344
Energy: 0.9146532503431418
Energy: 1.124272924599252
Energy: 0.9076588936256695
Energy: 0.9090465195974763
Energy: 1.0308778308314506
Energy: 0.9354184419222199
Energy: 0.9099562224059005
Energy: 1.0879830894712288
Energy: 0.9189514580795192
Energy: 1.0522830260912148
Energy: 1.051073468222846
Energy: 1.0336556320494357
Energy: 1.090426946422515
Energy: 0.9898539121354307
Energy: 1.175424222309304
Energy: 1.0179399414537587
Energy: 0.9077098875738747
Energy: 0.9080880705707138
Energy: 1.0188533155095147
Energy: 0.9093697068402683
Energy: 0.9077070883169062
Energy: 1.0782140441702723
Energy: 1.1643180213372015
Energy: 1.1644368851674256
Energy: 1.0793348897342654
Energy: 1.1663729673092194
Energy: 0.9076736923802197
Energy: 1.1326422231647295
Energy: 0.9244680024682626
Energy: 1.019487341834858
Energy: 1.1336849627477963
Energy: 1.0247171396059636
Energy: 0.989461678900731
Energy: 1.0942598761981817
Energy: 0.9002884988285461
Energy: 1.0413151828124902
Energy: 1.095320120140012
Energy: 1.3205518578299167
Energy: 1.1658302049601752
Energy: 1.2629275104694677
Energy: 1.175831656341297
Energy: 1.1133007266916943
Energy: 1.264634102329906
Energy: 1.1187105937558868
Energy: 1.115816162312812
Energy: 1.2641096339828009
Energy: 1.1210967677886055
Energy: 1.1156661404491786
Energy: 1.2645552334787316
Energy: 1.1276610325557106
Energy: 0.9854637324976012
Energy: 1.1841981727822812
Energy: 1.0300007096405426
Energy: 0.9879431883218945
Energy: 1.2259216293283972
Energy: 1.0332486096830538
Energy: 0.9870690399122142
Energy: 1.2871670866615852
Energy: 0.909657225206329
Energy: 0.9249137554358026
Energy: 1.1323891299001478
Energy: 0.9119618530858052
Energy: 1.0169635910839248
Energy: 1.163338388418323
Energy: 1.1068789293209667
Energy: 0.9423651958721115
Energy: 1.1642160998872708
Energy: 1.1136386345764127
Energy: 0.9423073173396259
Energy: 0.9073273953929905
Energy: 0.9811997632445411
Energy: 0.9378290552055617
Energy: 0.9077916347812524
Energy: 0.9877925052697246
Energy: 0.9069287303842116
Energy: 1.0904535644867606
Energy: 1.089073381508169
Energy: 0.9202462017092629
Energy: 1.0229027239876485
Energy: 1.085694993545792
Energy: 0.9189211324954735
Energy: 1.0959239275250097
Energy: 0.9121473596446265
Energy: 0.9379765377093644
Energy: 1.0948980461461477
Energy: 0.9084990535442741
Energy: 1.1717591124035092
Energy: 1.1934619945367624
Energy: 0.9078773305013993
Energy: 0.9078470057074848
Energy: 1.1561181241816278
Energy: 0.9079565015833813
Energy: 0.922683105638253
Energy: 1.1350796151780795
Energy: 1.1295104125741817
Energy: 0.9127922732544692
Energy: 1.1349039066697673
Energy: 1.1297973570289892
Energy: 0.9100307923209208
Energy: 1.136122724086715
Energy: 0.9244456295235709
Energy: 1.0171409696108533
Energy: 1.136970994913163
Energy: 0.9308178642116006
Energy: 1.1152835505407213
Energy: 1.1656107288699127
Energy: 1.0801285037009514
Energy: 1.026194887511538
Energy: 1.1654519364843126
Energy: 1.299347739511893
Energy: 1.0909408532352258
Energy: 1.2415708305773252
Energy: 0.9117224642684809
Energy: 0.9256878375558613
Energy: 1.241429866274727
Energy: 1.0206435524256203
Energy: 1.1152969105640276
Energy: 1.1843098245568084
Energy: 1.1658966010891547
Energy: 0.9903801833654563
Energy: 1.4163304022001324
Energy: 1.1642781752153288
Energy: 0.9865767824870614

minimum gb energy = 0.9002884988285461 eV
minimum distance =  2.37873212735356 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.128634250565202
Energy: 1.3515635950621283
Energy: 1.0287833120930585
Energy: 1.1277842332375265
Energy: 1.3499853869385972
Energy: 0.8469790078923999
Energy: 1.1011323830115334
Energy: 1.0611595963106621
Energy: 0.8974501479547734
Energy: 1.0312712108498754
Energy: 1.0287068207361165
Energy: 0.9583762721822445
Energy: 1.0759380236385
Energy: 1.000888836967915
Energy: 0.9124318843483799
Energy: 1.0772815903103132
Energy: 1.049365046504269
Energy: 0.9731617884796404
Energy: 0.9026079834487267
Energy: 1.0004799185915612
Energy: 0.9111414353953324
Energy: 0.9026609646230289
Energy: 1.0676188530295427
Energy: 0.9033467120194321
Energy: 0.9488380679345384
Energy: 0.9449142419804968
Energy: 0.9383931288934563
Energy: 0.9492658895687089
Energy: 1.0537496754667828
Energy: 0.937803677955679
Energy: 1.0461606154776173
Energy: 0.805192790537703
Energy: 0.9318216992483161
Energy: 1.0527886373777764
Energy: 0.8048361776547239
Energy: 1.05026773324581
Energy: 1.0654302684860615
Energy: 0.8042411844861443
Energy: 0.8047026785840748
Energy: 1.0652932064969645
Energy: 0.806106483981058
Energy: 0.933714876774632
Energy: 1.0144813061688271
Energy: 1.014352694781282
Energy: 1.0533701692261186
Energy: 1.0134769955250629
Energy: 1.0267036983291478
Energy: 1.0934633859037874
Energy: 0.8048847976069006
Energy: 0.958540245534021
Energy: 0.9343930573653333
Energy: 0.806244365211085
Energy: 1.0673881847900275
Energy: 0.8037513444422322
Energy: 0.8044400077382061
Energy: 0.9954165055100962
Energy: 0.8454762675135657
Energy: 0.8048018862201088
Energy: 1.0534623622092438
Energy: 0.8062610547314486
Energy: 1.0451524006612456
Energy: 0.9486650250438389
Energy: 0.8125067321591325
Energy: 1.0462776654894916
Energy: 0.9488947609298344
Energy: 0.8619066983365287
Energy: 1.097117407542789
Energy: 0.901924901107062
Energy: 0.9018612678023922
Energy: 1.0983726599404984
Energy: 0.9019842936434602
Energy: 0.9014948100497648
Energy: 1.0812325509341731
Energy: 1.1144684315592386
Energy: 1.0079976802822124
Energy: 1.081342608915401
Energy: 1.115116284415201
Energy: 0.9033839915445555
Energy: 1.085205489869294
Energy: 0.9231165269031194
Energy: 0.9228583534914174
Energy: 1.0853195862610696
Energy: 1.0069038643905746
Energy: 0.9736816140652641
Energy: 1.0190034130398198
Energy: 1.0079104233051313
Energy: 1.009572078748923
Energy: 1.0194669869381223
Energy: 1.3071056234881826
Energy: 1.0087140153898846
Energy: 1.1222694548813739
Energy: 0.9251517182462838
Energy: 0.8918460600647967
Energy: 1.122651629064633
Energy: 1.0210164776090918
Energy: 0.8921018836958994
Energy: 1.1117906724869262
Energy: 1.1147187644135346
Energy: 0.9754501375015148
Energy: 1.1176909416342642
Energy: 1.1286710224555614
Energy: 0.9756414716664998

minimum gb energy = 0.8037513444422322 eV
minimum distance =  2.36462217977811 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.1104099704139145
Energy: 0.9418947994583812
Energy: 0.8036935604967025
Energy: 1.113631953951219
Energy: 0.9539979878352508
Energy: 0.8046906646889737
Energy: 1.0235173275871088
Energy: 0.9717812469644765
Energy: 0.8961013649396194
Energy: 1.0230349052527787
Energy: 0.9500679514447324
Energy: 0.8384904031396685
Energy: 1.018802067692841
Energy: 0.8344597238809474
Energy: 0.9132623381086872
Energy: 1.020796159386427
Energy: 0.974715010326094
Energy: 0.7768339114194551
Energy: 0.9012384947163242
Energy: 0.7307610135304183
Energy: 0.8458786113317038
Energy: 0.9024373627953394
Energy: 0.9934863465200291
Energy: 0.774907017603668
Energy: 0.995626793142239
Energy: 0.8935041451858539
Energy: 0.8391549632674343
Energy: 0.9025431006859401
Energy: 0.9646927215129625
Energy: 0.9157437248651789
Energy: 1.0249454455400806
Energy: 0.7581783845683161
Energy: 0.9514248746230167
Energy: 1.0270072180684697
Energy: 0.7558785585585407
Energy: 0.9514070445524823
Energy: 1.0011157723954696
Energy: 0.7612339333977491
Energy: 0.7553652985201963
Energy: 0.9939342806236662
Energy: 0.7603311611365913
Energy: 0.7799930086784301
Energy: 0.9119847214384197
Energy: 0.9216642869010788
Energy: 0.9279446741917148
Energy: 0.9145201516032827
Energy: 0.9580525610272325
Energy: 0.8968877992980012
Energy: 0.7287735715280497
Energy: 0.8288325755075324
Energy: 0.8269852883089283
Energy: 0.7305433619978651
Energy: 0.9770356915617449
Energy: 0.7264094177682057
Energy: 0.7247630599678748
Energy: 0.9957525494014426
Energy: 0.9298392520028629
Energy: 0.7245477803636919
Energy: 0.9508461126358589
Energy: 0.9267773632482554
Energy: 0.9485077575058615
Energy: 0.725274559874287
Energy: 0.923759652351725
Energy: 0.9495671817931157
Energy: 0.7255493292842128
Energy: 0.8468208823935285
Energy: 0.9900208412820326
Energy: 0.733141476689694
Energy: 0.7254670775521785
Energy: 0.9882439042380807
Energy: 0.7305454413505882
Energy: 0.8291255221661842
Energy: 0.9875527207560804
Energy: 0.9297571814297622
Energy: 0.9578483744563291
Energy: 0.9877015902388919
Energy: 0.9157415455931482
Energy: 0.7692964184530906
Energy: 0.7564886197943259
Energy: 0.8731558201477007
Energy: 0.8719660197315581
Energy: 0.757360249897395
Energy: 0.9965122021006444
Energy: 0.754425158431492
Energy: 0.7594835419381711
Energy: 1.0334024217586482
Energy: 0.9483275453040076
Energy: 0.758902140423923
Energy: 0.9933723429319924
Energy: 0.8581280249444886
Energy: 0.9628978086310906
Energy: 0.8900955231631563
Energy: 0.7876647289569985
Energy: 0.9648317027773815
Energy: 0.894030241346114
Energy: 0.7851917757143388
Energy: 1.0127806519639138
Energy: 0.8466536792080714
Energy: 0.8467283856028235
Energy: 1.0127402805772918
Energy: 0.8551319252384646
Energy: 0.7680270627812934
Energy: 1.0114240694572598
Energy: 1.0209993764769225
Energy: 0.9263646765271842
Energy: 1.0121807287021778
Energy: 1.0177920731025196
Energy: 0.8433993876332632
Energy: 0.9977002954512605
Energy: 0.8595141121569271
Energy: 0.8853908306847844
Energy: 0.9987871346434507
Energy: 1.0403603210630594
Energy: 0.8677488439739791
Energy: 1.0164559130936603
Energy: 1.1640612038057452
Energy: 0.8888289695921671
Energy: 1.019342373097759
Energy: 1.0652842063426018
Energy: 0.9337754185962162
Energy: 1.026838165201138
Energy: 0.849180462702517
Energy: 0.8398117886556388
Energy: 1.028197868713439
Energy: 1.0246065810130784
Energy: 0.837161324292841
Energy: 1.2139225575569221
Energy: 1.0219037220268745
Energy: 0.9908804816471211
Energy: 1.2148396272306001
Energy: 1.0188737056257078
Energy: 0.896304424709039
Energy: 1.035391800067655
Energy: 0.9516788527489011
Energy: 0.9755820126415916
Energy: 1.028594561467338
Energy: 0.9421403747708499
Energy: 0.9110410610863452
Energy: 1.0261379856401176
Energy: 1.0036713486205526
Energy: 0.9183581359004949
Energy: 1.0335162433885547
Energy: 1.0013777993964712
Energy: 0.9251792917946934
Energy: 0.8496625843455965
Energy: 0.8856266518507424
Energy: 0.8333324745434639
Energy: 0.8484019557598877
Energy: 1.0185796159956693
Energy: 0.7750475756065291
Energy: 0.8911623866209587
Energy: 0.8529984809382284
Energy: 0.8012299498672956
Energy: 0.8911888657018858
Energy: 0.9672355814915905
Energy: 0.8893904691686451
Energy: 1.029765587588186
Energy: 0.941995656932258
Energy: 1.0045575154317699
Energy: 1.0296290729620807
Energy: 0.9362593926166205
Energy: 0.9168002394334447
Energy: 0.9685262496986083
Energy: 0.7618587655437852
Energy: 0.7664231035233402
Energy: 0.9500675196864887
Energy: 0.7616563933723539
Energy: 0.7557616218741612
Energy: 0.9143921771897803
Energy: 0.8791940979251981
Energy: 0.8753105905489299
Energy: 0.9162126844970974
Energy: 0.7558365957884554
Energy: 0.9286987591697565
Energy: 0.7360110501364806
Energy: 0.871121753300209
Energy: 0.9008268312779059
Energy: 0.7368757313932586
Energy: 1.0142676803794017
Energy: 0.9158409169408883
Energy: 0.7290559021228958
Energy: 0.8496104435915334
Energy: 0.8478067912906133
Energy: 0.7302798366389265
Energy: 0.9866166847345299
Energy: 0.9202704169148563
Energy: 0.9366816381431089
Energy: 0.7999080298122959
Energy: 0.8020362497745293
Energy: 0.9390153985438389
Energy: 0.9353657338434052
Energy: 0.9529927006987186
Energy: 0.9538308422924426
Energy: 0.7307197521234081
Energy: 0.735430025694266
Energy: 0.9611389608256743
Energy: 0.7289032327722811
Energy: 0.7245013642947266
Energy: 0.9936772348616002
Energy: 0.8811704405236063
Energy: 0.8533443709640278
Energy: 0.9962520530174107
Energy: 0.9482170497559075
Energy: 0.9696021970050068
Energy: 0.7655011374440192
Energy: 0.8000117910973792
Energy: 0.7978369555265559
Energy: 0.7608597529935297
Energy: 0.9347866428017414
Energy: 0.7980977643782333
Energy: 0.7644097318968452
Energy: 0.8995757836104772
Energy: 0.758802032223595
Energy: 0.7659655662429441
Energy: 0.972800735746204
Energy: 0.7706315386785343
Energy: 0.9438597644515063
Energy: 0.8749268902474217
Energy: 0.8524230073246277
Energy: 0.9356772184730703
Energy: 0.905587912687844
Energy: 0.7852729295487005
Energy: 0.9908987155429894
Energy: 0.8534260737252825
Energy: 0.8473060924279872
Energy: 0.9900733504839526
Energy: 0.8545799090306737
Energy: 0.8463192134530839
Energy: 1.0697583621036515
Energy: 1.0106210964574982
Energy: 0.8343262491076854
Energy: 1.0717348367564588
Energy: 1.0182588234598382
Energy: 0.8864175166037028
Energy: 0.9923828771456171
Energy: 0.8573379379888943
Energy: 0.8325349921348539
Energy: 0.9931358648766008
Energy: 1.0347987666690854
Energy: 0.9748051179318614
Energy: 0.9437488800571854
Energy: 0.8338278539548372
Energy: 0.9063223971518211
Energy: 0.9443278567691265
Energy: 1.080616673125532
Energy: 0.9223018830859608
Energy: 1.018585359229588
Energy: 0.8956313160620809
Energy: 0.91251195050764
Energy: 1.0204327272705962
Energy: 0.9824433795374634
Energy: 0.9698894363105798
Energy: 1.0270339966407682
Energy: 1.029330271419065
Energy: 0.9755938851953306
Energy: 1.0282626266805928
Energy: 1.028508380941283
Energy: 0.9111116123177115

minimum gb energy = 0.7245013642947266 eV
minimum distance =  2.35551060972802 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.9880595256402713
Energy: 0.8694917069941492
Energy: 0.7622885878728204
Energy: 0.995881587624887
Energy: 1.3048622677638202
Energy: 0.7517571111495767
Energy: 0.9736272125907005
Energy: 0.9324404080414757
Energy: 0.8913923590914454
Energy: 0.9566230914910958
Energy: 0.9111884034649058
Energy: 0.7558769765220794
Energy: 0.933537945134846
Energy: 0.7607289553814753
Energy: 0.779252501523596
Energy: 0.9351171748809509
Energy: 0.9568932642995118
Energy: 0.7287453845328846
Energy: 0.837751475801226
Energy: 0.7554949848372582
Energy: 0.7275511921931123
Energy: 0.8385151946274282
Energy: 0.90676906698298
Energy: 0.7443939231818796
Energy: 0.8908926642620163
Energy: 0.854110930347016
Energy: 0.7851243712922549
Energy: 0.892199258133377
Energy: 0.8808057318093594
Energy: 0.6962788456166213
Energy: 0.9254342725273116
Energy: 0.7068171085212254
Energy: 0.8245374235944818
Energy: 0.9281684476664277
Energy: 0.7075239149325223
Energy: 0.8286975985878496
Energy: 0.8897337294016745
Energy: 0.7916814381136766
Energy: 0.7970030302558692
Energy: 0.8911915495807913
Energy: 0.7862231589367262
Energy: 0.8258508237706267
Energy: 0.834638961165523
Energy: 0.7661507925849282
Energy: 0.8466152844730431
Energy: 0.8363033291043634
Energy: 0.7058089102035597
Energy: 0.8270839061875376
Energy: 0.675701935552297
Energy: 0.918854031741743
Energy: 0.7665537561090874
Energy: 0.6773261530153729
Energy: 0.8883334132771069
Energy: 0.6861889477911294
Energy: 0.6858583692246635
Energy: 0.9032012543124136
Energy: 0.8233923156628636
Energy: 0.6864474926088943
Energy: 0.8517976553153271
Energy: 0.8243195394135646
Energy: 0.8785673921786005
Energy: 0.6700553132750858
Energy: 0.8246939628378185
Energy: 0.8802323736091142
Energy: 0.6679828835369112
Energy: 0.8209334595234321
Energy: 0.8867854132122948
Energy: 0.6665017391818606
Energy: 0.6670730307602128
Energy: 0.8876613169751234
Energy: 0.6623658001213938
Energy: 0.8289314977688078
Energy: 0.8621733653987561
Energy: 0.9251752598428752
Energy: 0.8526007153254375
Energy: 0.8635171999999959
Energy: 0.8671840987850834
Energy: 0.84507968604727
Energy: 0.6546860319642075
Energy: 0.8520422822467782
Energy: 0.8328051693571099
Energy: 0.6565078402436625
Energy: 0.8786298744575252
Energy: 0.6680856164072795
Energy: 0.6715609490480201
Energy: 0.9661410778828117
Energy: 0.8287660956761722
Energy: 0.6708058621185039
Energy: 0.9128067034508845
Energy: 0.8276539675370436
Energy: 0.8519606805630845
Energy: 0.6854580224458605
Energy: 0.8383599296389889
Energy: 0.8544654781302353
Energy: 0.6815447894729285
Energy: 0.8201577477727745
Energy: 0.9660263855989365
Energy: 0.6849360529964983
Energy: 0.6861225218733406
Energy: 0.9673788052785159
Energy: 0.6829789992166222
Energy: 0.7776330850387319
Energy: 0.8982374534540271
Energy: 0.8429418148745179
Energy: 0.7902089190362583
Energy: 0.9014586065661945
Energy: 0.8360810016773024
Energy: 0.7474312757929208
Energy: 0.7082505798950954
Energy: 0.7174338568355274
Energy: 0.7069338795292098
Energy: 0.7094141501974287
Energy: 0.9137965893635452
Energy: 0.7189049396815802
Energy: 0.8671698460623586
Energy: 0.9285534387185788
Energy: 0.8517077873412828
Energy: 0.8685434434161113
Energy: 0.9670476832008289
Energy: 0.851503261737881
Energy: 0.9038242723852812
Energy: 0.9115353533443599
Energy: 0.9138550835473228
Energy: 0.9049214068827327
Energy: 0.9056033145341177
Energy: 0.726517061272836
Energy: 0.9651404556396692
Energy: 0.8034041251974599
Energy: 0.7681699098359152
Energy: 0.9633438750815962
Energy: 0.8014052960025294
Energy: 0.7259996820393103
Energy: 0.9257537368286679
Energy: 0.9383608270443231
Energy: 0.7969541376472017
Energy: 0.9259943507551274
Energy: 0.9315064157328138
Energy: 0.8425031655112033
Energy: 0.9056347213431178
Energy: 0.7645551067830741
Energy: 0.7782538198816176
Energy: 0.9072147182454345
Energy: 0.9158068482427264
Energy: 0.9493252735847824
Energy: 0.9363406628673964
Energy: 0.8155140454537115
Energy: 0.8166385456720897
Energy: 0.9376595933485379
Energy: 1.0782683060360239
Energy: 0.7849280905254545
Energy: 0.943252212255528
Energy: 0.7986294446324891
Energy: 0.7948377940233278
Energy: 0.950521658782416
Energy: 0.9467494938838882
Energy: 0.7965253293872023
Energy: 0.9981392231554685
Energy: 0.9161156748272467
Energy: 0.757163544851837
Energy: 0.9916094532571016
Energy: 0.9200133176183776
Energy: 0.7282871003976541

minimum gb energy = 0.6546860319642075 eV
minimum distance =  2.35895461054745 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.8582257000054057
Energy: 0.7298359428514976
Energy: 0.6359087849120069
Energy: 0.8607744280577739
Energy: 0.7314116262936563
Energy: 0.7031010626484028
Energy: 0.7703084759406045
Energy: 0.7377029491335876
Energy: 0.6678633911199622
Energy: 0.7693827937370649
Energy: 0.7362049674265417
Energy: 0.5677907186584232
Energy: 0.7566000957400637
Energy: 0.6471955028261122
Energy: 0.5733617681036619
Energy: 0.7577293666777611
Energy: 0.9392396023505336
Energy: 0.5843132969423731
Energy: 0.6513817896607609
Energy: 0.5828612934989637
Energy: 0.5966857746699257
Energy: 0.6530779841872463
Energy: 0.718827394524723
Energy: 0.598946538262987
Energy: 0.7371675757292493
Energy: 0.654672853344265
Energy: 0.5645839058699342
Energy: 0.7304231167190185
Energy: 0.7289636499412576
Energy: 0.5544164029807183
Energy: 0.8124161691483597
Energy: 0.587965625676296
Energy: 0.66606494671475
Energy: 0.8129758554648043
Energy: 0.586870714572043
Energy: 0.6768592458507464
Energy: 0.7012984495284732
Energy: 0.6466856408101318
Energy: 0.6434007642059301
Energy: 0.7014277999834475
Energy: 0.6510056432035244
Energy: 0.6875242018556464
Energy: 0.6961239189041868
Energy: 0.6083474159702249
Energy: 0.6535022658321151
Energy: 0.6972513290705916
Energy: 0.6066941624843876
Energy: 0.6518293433590043
Energy: 0.5632857022442769
Energy: 0.6221535551615573
Energy: 0.5593917251323681
Energy: 0.5642649004353691
Energy: 0.7222720453116535
Energy: 0.5604313868372249
Energy: 0.6222053421769443
Energy: 0.7023738509431968
Energy: 0.6540779326675736
Energy: 0.6238728033053866
Energy: 0.6940558365058931
Energy: 0.6552222614231092
Energy: 0.775427163417266
Energy: 0.5409367377304448
Energy: 0.6664332162491925
Energy: 0.7765303058661358
Energy: 0.5417569776245513
Energy: 0.6667284405837005
Energy: 0.7496062904737878
Energy: 0.5412912597143934
Energy: 0.5419246082326628
Energy: 0.7516958171059077
Energy: 0.548813022790153
Energy: 0.6370125497893657
Energy: 0.6994007594808583
Energy: 0.6489392015090389
Energy: 0.6703854401071881
Energy: 0.7007310063511533
Energy: 0.8267348389887589
Energy: 0.6649067949936154
Energy: 0.5309878963841814
Energy: 0.6949732414395843
Energy: 0.5297212895809541
Energy: 0.5322280834380282
Energy: 0.7275833730233604
Energy: 0.529537676290453
Energy: 0.5312825462182836
Energy: 0.7532695428244147
Energy: 0.592531020470942
Energy: 0.5302832250667163
Energy: 0.7146567703966399
Energy: 0.545467688623895
Energy: 0.7489618477867428
Energy: 0.5249857217699723
Energy: 0.5285375936174843
Energy: 0.8121403883609108
Energy: 0.5245857946526536
Energy: 0.6516282726129704
Energy: 0.8359739781461836
Energy: 0.524210339288743
Energy: 0.5249161722638801
Energy: 0.8232354347215098
Energy: 0.5237214756880386
Energy: 0.6511773026980436
Energy: 0.7085966068282992
Energy: 0.5498742925025315
Energy: 0.5423001862032371
Energy: 0.7098933988802961
Energy: 0.7343819070171234
Energy: 0.5482453760635851
Energy: 0.5244666130510555
Energy: 0.7034286104265115
Energy: 0.5238730976187823
Energy: 0.5265335832959464
Energy: 0.7172313014531206
Energy: 0.5238379121392968
Energy: 0.7403299854128714
Energy: 0.6530304859251705
Energy: 0.5517925387410688
Energy: 0.7091898414911125
Energy: 0.7625374356315899
Energy: 0.5924826241891504
Energy: 0.7647749072367823
Energy: 0.530005493263159
Energy: 0.5304961598168846
Energy: 0.7633798502375126
Energy: 0.5403440897700342
Energy: 0.628494407863943
Energy: 0.9036714999429887
Energy: 0.5297496596746154
Energy: 0.5329767249770835
Energy: 0.892044763105252
Energy: 0.5297057350458841
Energy: 0.658479348733476
Energy: 0.5406207017689462
Energy: 0.7229827417001745
Energy: 0.5747509416135882
Energy: 0.5418324798767056
Energy: 0.697328125434409
Energy: 0.5441272270905806
Energy: 0.542582603758306
Energy: 0.7074458831190411
Energy: 0.5416010553500069
Energy: 0.5437788787734645
Energy: 0.7318636690015944
Energy: 0.5417446950604197
Energy: 0.6922193362821359
Energy: 0.6610873439402181
Energy: 0.6688032953424429
Energy: 0.6941071433992986
Energy: 0.8564818012225591
Energy: 0.5584981839825404
Energy: 0.6944412289719957
Energy: 0.570552285278963
Energy: 0.5606172049075736
Energy: 0.6955212758209659
Energy: 0.5665990019664796
Energy: 0.6513319265754547
Energy: 0.794104653563802
Energy: 0.5592282521937162
Energy: 0.6280243886591115
Energy: 0.795635605954513
Energy: 0.5591936587274634
Energy: 0.637064081347931
Energy: 0.7122605257752732
Energy: 0.6969523611491815
Energy: 0.6459531375029408
Energy: 0.7126413762985667
Energy: 0.6974878442472874
Energy: 0.630642257271831
Energy: 0.590817593773531
Energy: 0.6293277117619704
Energy: 0.5867078392005411
Energy: 0.5921400133261363
Energy: 0.7220086705481958
Energy: 0.5867504048374502
Energy: 0.7127309736527595
Energy: 0.6228624274820929
Energy: 0.6363602050319245
Energy: 0.7140744029621328
Energy: 0.6152977346262838
Energy: 0.5917620600973631
Energy: 0.7180600486489649
Energy: 0.7340546639860285
Energy: 0.7353661524053592
Energy: 0.719867412464675
Energy: 0.7388469182725095
Energy: 0.7420270979582186
Energy: 0.8360487055160347
Energy: 0.644397983917812
Energy: 0.64414405580959
Energy: 0.8364093624473478
Energy: 0.6443475038669343
Energy: 0.6545428275690136
Energy: 0.7447328081375906
Energy: 0.6990415842000951
Energy: 0.6117869219533748
Energy: 0.743409506834599
Energy: 0.7737080864723866
Energy: 0.6143344327145155
Energy: 0.7065143891873327
Energy: 0.5520573200822239
Energy: 0.6161538854254174
Energy: 0.7074267426369213
Energy: 0.7257214486954338
Energy: 0.6868557646378609
Energy: 0.7569354396023755
Energy: 0.6296739578137713
Energy: 0.6115105547191979
Energy: 0.7587214754969166
Energy: 0.9695230472525962
Energy: 0.5922731010054294
Energy: 0.7659232397810674
Energy: 0.7571204726902162
Energy: 0.6427158749972685
Energy: 0.7665019967899532
Energy: 0.756447466520472
Energy: 0.6086344597876036

minimum gb energy = 0.5237214756880386 eV
minimum distance =  2.35570952597479 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.018163179276773207
Energy: 0.04638749969743274
Energy: 0.01890830282688147
Energy: 0.02022173311833664
Energy: 0.04609898560390049
Energy: 0.019118538971291534
Energy: 0.04589444437615039
Energy: 0.019055341065068846
Energy: 0.01908529645795302
Energy: 0.046054657736013895
Energy: 0.019854060206971304
Energy: 0.019143221666496537
Energy: 0.23033058114105567
Energy: 0.019026628562859735
Energy: 0.01889331600720093
Energy: 0.22915426749646184
Energy: 0.019039561751550013
Energy: 0.04518688746999048
Energy: 0.01957690628138221
Energy: 0.019026305518051356
Energy: 0.019321181160806757
Energy: 0.019206225531446207
Energy: 0.01923733268659901
Energy: 0.04565846934372709
Energy: 0.04487393211067678
Energy: 0.2291311621477661
Energy: 0.04613065877526084
Energy: 0.04576416689162516
Energy: 0.22655894582743677
Energy: 0.04578894374808983
Energy: 0.019411208028878347
Energy: 0.019265484998440472
Energy: 0.01945571860554476
Energy: 0.02060947561099629
Energy: 0.01895588448048402
Energy: 0.018795880071083924
Energy: 0.22416561403765195
Energy: 0.019078346367237063
Energy: 0.018996644777574116
Energy: 0.22808125755659994
Energy: 0.01907722079924233
Energy: 0.01930728520124182
Energy: 0.22689456559129142
Energy: 0.018735769217706026
Energy: 0.018844955195561775
Energy: 0.2314392415727238
Energy: 0.01881356903539961
Energy: 0.04518885881419335
Energy: 0.019277163124222327
Energy: 0.019036772907544193
Energy: 0.04714374458149306
Energy: 0.019589582782184978
Energy: 0.019004925263927733
Energy: 0.04676568953948006
Energy: 0.01912178232898695
Energy: 0.22420411667374393
Energy: 0.04597852190701027
Energy: 0.019590549994818105
Energy: 0.23183143439928966
Energy: 0.04584571460738645

minimum gb energy = 0.018163179276773207 eV
minimum distance =  2.49640624456712 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.9951340154699051
Energy: 0.807758387448326
Energy: 0.6788929524474587
Energy: 0.9962899854988498
Energy: 0.8075925690898198
Energy: 0.6237238358251881
Energy: 0.6393430183328219
Energy: 0.6429691922276987
Energy: 0.6468662666571307
Energy: 0.6394357230981254
Energy: 0.6478278954235424
Energy: 0.662582011256898
Energy: 0.7743183981537929
Energy: 0.6190579764300032
Energy: 0.6187426239996167
Energy: 0.7755777867691946
Energy: 0.6182313803319773
Energy: 0.7625571201878039
Energy: 0.7416258046061867
Energy: 0.6191032005776136
Energy: 0.6191381610896575
Energy: 0.7424115708547118
Energy: 0.6457122819516066
Energy: 0.6420091164192477
Energy: 0.7526692052167764
Energy: 0.6980897659949877
Energy: 0.6662367696593526
Energy: 0.6472801118257915
Energy: 0.6662622091310019
Energy: 0.6594236307838576
Energy: 0.9164957725896924
Energy: 0.7834388645798838
Energy: 0.6444922238751423
Energy: 0.8719740255651436
Energy: 0.7876247300196058
Energy: 0.6095121176726426
Energy: 0.6139278711979312
Energy: 0.6854121889060092
Energy: 0.6802014060629513
Energy: 0.6158380211226153
Energy: 0.6822880501884377
Energy: 0.7794525925737622
Energy: 0.7521289646284165
Energy: 0.5980819920212863
Energy: 0.5991638901496695
Energy: 0.7527013531362872
Energy: 0.5724186872671767
Energy: 0.6321399793177465
Energy: 0.6456265998366705
Energy: 0.5998225983892832
Energy: 0.6543502688077901
Energy: 0.6455243746075003
Energy: 0.6864555101682259
Energy: 0.6519927520557727
Energy: 0.7089320177743641
Energy: 0.6930579088279797
Energy: 0.5799923767709361
Energy: 0.708661566022025
Energy: 0.7018127648396951
Energy: 0.626796149743357
Energy: 0.820415502133935
Energy: 0.6162306085715915
Energy: 0.6177701955827737
Energy: 0.8194170717370359
Energy: 0.6543667026673222
Energy: 0.6034501204961161
Energy: 0.6323813951014854
Energy: 0.6101698926949201
Energy: 0.620276904991229
Energy: 0.632685780399264
Energy: 0.6911864427955877
Energy: 0.5513091524789782
Energy: 0.637010353067738
Energy: 0.5665372628716745
Energy: 0.6366263774427798
Energy: 0.6374911024642979
Energy: 0.7323979988453252
Energy: 0.5880833996727075
Energy: 0.6607172717737139
Energy: 0.6831679238651474
Energy: 0.5838144681983299
Energy: 0.6672020649710938
Energy: 0.6824592328465218
Energy: 0.5906609404867372
Energy: 0.6293547276522921
Energy: 0.6122013079808177
Energy: 0.6115107022089384
Energy: 0.630526435718463
Energy: 0.6155640227830645
Energy: 0.6155018113660587
Energy: 0.726519913396585
Energy: 0.5806387609685608
Energy: 0.5793639967543519
Energy: 0.7316146483104456
Energy: 0.5752464219648564
Energy: 0.5806392799220316
Energy: 0.6010405144276582
Energy: 0.5736935896488932
Energy: 0.5674670457764447
Energy: 0.5702437204581787
Energy: 0.6391104193668903
Energy: 0.5465411148314221
Energy: 0.5486538706167946
Energy: 0.569060992504822
Energy: 0.5683053440997492
Energy: 0.5756036939090217
Energy: 0.6982302155789286
Energy: 0.56743528881081
Energy: 0.7075793488813304
Energy: 0.6677878870209732
Energy: 0.5722623381557143
Energy: 0.7101939992915643
Energy: 0.674199908436404
Energy: 0.5778079674191158
Energy: 0.6266105431607782
Energy: 0.5701985452182046
Energy: 0.5421041592338351
Energy: 0.6274206371610377
Energy: 0.6053229134423203
Energy: 0.541804462460593
Energy: 0.5697309038208824
Energy: 0.5819977314061177
Energy: 0.5801251456288528
Energy: 0.5701630628788312
Energy: 0.647847143055798
Energy: 0.5776091818168299
Energy: 0.6160465287410504
Energy: 0.5821754320365361
Energy: 0.5631392818794737
Energy: 0.6169660360873587
Energy: 0.6179625352733458
Energy: 0.6158266548163188
Energy: 0.6146095146447044
Energy: 0.6864633619857031
Energy: 0.5894014588449348
Energy: 0.615413112811655
Energy: 0.7123823746729933
Energy: 0.5892800279450813
Energy: 0.8147157693371826
Energy: 0.6185703560397079
Energy: 0.6284529069326507
Energy: 0.8165113914037408
Energy: 0.6179184333501441
Energy: 0.5687336853406841
Energy: 0.6714124316152772
Energy: 0.554041797763342
Energy: 0.5570879417537205
Energy: 0.6906985556597277
Energy: 0.6297965818170455
Energy: 0.5471597597480189
Energy: 0.7152498455810185
Energy: 0.591917053256799
Energy: 0.5941976437544113
Energy: 0.5933691340703984
Energy: 0.6054467720819952
Energy: 0.617095848909127
Energy: 0.6983262256156079
Energy: 0.5949264005888583
Energy: 0.5840657875717423
Energy: 0.6997948541446508
Energy: 0.6646668141992043
Energy: 0.5802543234901482
Energy: 0.6398492661048918
Energy: 0.6391392016687536
Energy: 0.6357721507581214
Energy: 0.6838819516189514
Energy: 0.6476269827801826
Energy: 0.6574252451001542
Energy: 0.8647105744995214
Energy: 0.6976495321971559
Energy: 0.6030100858031261
Energy: 0.8666506716118498
Energy: 0.6956938300016543
Energy: 0.607782190051259
Energy: 0.7340671482066501
Energy: 0.6145543523776102
Energy: 0.6341775284837856
Energy: 0.5972086360418424
Energy: 0.6479381116276465
Energy: 0.7797489273296546
Energy: 0.6691685558021804
Energy: 0.604785821601504
Energy: 0.6051624147281323
Energy: 0.669006965978476
Energy: 0.5792160856827093
Energy: 0.6304833025096864
Energy: 0.6487207031606678
Energy: 0.611422064648073
Energy: 0.6648018533374803
Energy: 0.6493173933781011
Energy: 0.6387947175505715
Energy: 0.6606281080867606
Energy: 0.6488428926015839
Energy: 0.6210658541940698
Energy: 0.6226388522388904
Energy: 0.7550702344172463
Energy: 0.6201559762101048
Energy: 0.6087249783434832

minimum gb energy = 0.541804462460593 eV
minimum distance =  2.35485041051344 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 1.0653467627485775
Energy: 0.7585092552846884
Energy: 0.8959201241219011
Energy: 1.0673814531582306
Energy: 0.7583419907096349
Energy: 0.7931347532308736
Energy: 0.7591079705224653
Energy: 0.7752276727973626
Energy: 0.7686074655373918
Energy: 0.7546614246385801
Energy: 0.7722645575090737
Energy: 0.7983246203261957
Energy: 0.7701279256010076
Energy: 0.7682218292020695
Energy: 0.7608704463573276
Energy: 0.7732062575897712
Energy: 0.8904605062447358
Energy: 0.7784464680100901
Energy: 0.725672195379355
Energy: 0.7642490878188478
Energy: 0.7623102971630875
Energy: 0.727063985673581
Energy: 0.7834215636100336
Energy: 0.7811302207839617
Energy: 0.8329816183033728
Energy: 0.77538263164449
Energy: 0.7924053013038459
Energy: 0.8351180734449907
Energy: 0.7722330516535961
Energy: 0.7980422299212542
Energy: 0.9751173967801041
Energy: 0.7253353544306952
Energy: 0.7918103226888978
Energy: 1.148701984752336
Energy: 0.7494094848764303
Energy: 0.776653597568818
Energy: 0.7174416881816652
Energy: 0.786885097783815
Energy: 0.8344622286692229
Energy: 0.8376116799860716
Energy: 0.7933215858134881
Energy: 0.7610794386101851
Energy: 0.8149205664010037
Energy: 0.7378860090949664
Energy: 0.7756407332081839
Energy: 0.8160710512417251
Energy: 0.8137011786728028
Energy: 0.7715432026097546
Energy: 0.7675563079590381
Energy: 0.7876507711559058
Energy: 0.7827106814533591
Energy: 0.7686451757941515
Energy: 0.8949668952252582
Energy: 0.7784582775837491
Energy: 0.7884714728582679
Energy: 0.8237909475901256
Energy: 0.8241514477312276
Energy: 0.7902271884721209
Energy: 0.8178771659775109
Energy: 0.813515085427726
Energy: 0.9671814489916254
Energy: 0.7643380281085445
Energy: 0.7505023264942533
Energy: 0.7365411127693973
Energy: 0.8345082300780282
Energy: 0.7478793280989565
Energy: 0.7207524595997685
Energy: 0.7392215829113313
Energy: 0.7938418162208952
Energy: 0.7215932339221931
Energy: 0.7633118524242403
Energy: 0.733936087646841
Energy: 0.7645001355362588
Energy: 0.7360756807139954
Energy: 0.8142883832595909
Energy: 0.7646624433277808
Energy: 0.8957034745505665
Energy: 0.7555435193782439
Energy: 0.8899362010872063
Energy: 0.8350267305006447
Energy: 0.7337983488020808
Energy: 0.8871755516687908
Energy: 0.832599227560763
Energy: 0.729739438591829
Energy: 0.7506474755289336
Energy: 0.7649321303756047
Energy: 0.7656538031074874
Energy: 0.7525637550248817
Energy: 0.7598213758295077
Energy: 0.7178464772068799
Energy: 0.8187391957623453
Energy: 0.7508787425021317
Energy: 0.7494182009738426
Energy: 0.8204090519880315
Energy: 0.8821157824945741
Energy: 0.7463347286674796
Energy: 0.8090338681847682
Energy: 0.728350326622712
Energy: 0.759012217619944
Energy: 0.8100961628048973
Energy: 0.8067170583032643
Energy: 0.7426976151950916
Energy: 0.6990166220996121
Energy: 0.732110006398177
Energy: 0.7789519264230441
Energy: 0.6946311997453473
Energy: 0.7338654799448565
Energy: 0.7338761665903648
Energy: 0.9262625246241588
Energy: 0.8798723538341244
Energy: 0.7687759435702747
Energy: 1.0548369540796725
Energy: 0.8782908645792217
Energy: 0.7689912964254134
Energy: 0.8573937070949825
Energy: 0.8139381123225355
Energy: 0.762190534168835
Energy: 0.8586844414709758
Energy: 0.8114017215000802
Energy: 0.8655576468281769
Energy: 0.7825839586696235
Energy: 0.8071477811533713
Energy: 0.8011754085153729
Energy: 0.7839631338885248
Energy: 0.8383480270339112
Energy: 0.7956701296340568
Energy: 0.7706767345144162
Energy: 0.751097487687907
Energy: 0.8027941436625912
Energy: 0.7713138236174322
Energy: 0.7314765882164169
Energy: 0.7972530362412519
Energy: 0.7777297980580142
Energy: 0.8829867244312498
Energy: 0.8198782900984065
Energy: 0.7725665771145132
Energy: 0.8768034130356014
Energy: 0.8346408002406323

minimum gb energy = 0.6946311997453473 eV
minimum distance =  2.34127526080355 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.243278837503208
Energy: 0.8869305354563893
Energy: 0.9060925454333417
Energy: 1.2307481815838222
Energy: 0.8870663220062359
Energy: 0.9336283124399654
Energy: 0.8857091169271146
Energy: 0.8863989000831652
Energy: 0.8558950986892196
Energy: 0.9458951327154347
Energy: 1.0637493404030183
Energy: 1.0236729864139364
Energy: 1.0241409045448295
Energy: 0.858388612968983
Energy: 0.8584644472848144
Energy: 1.024856314194832
Energy: 0.8626570411520795
Energy: 0.8667268581066875
Energy: 0.9153931516612135
Energy: 0.8560372704286552
Energy: 0.8557732723139198
Energy: 0.9673581638766766
Energy: 0.9083357415636992
Energy: 0.8637303537270854
Energy: 0.8748541868354966
Energy: 1.0206044576863114
Energy: 0.8874663172195129
Energy: 0.8742730407429846
Energy: 1.0191280601226795
Energy: 0.8905560525297904
Energy: 1.1500165886681275
Energy: 0.910657874684801
Energy: 0.8862570380761177
Energy: 1.1512938408708409
Energy: 0.9114943059348954
Energy: 0.8792208843341907
Energy: 0.9350203997898289
Energy: 0.8169462103160681
Energy: 0.8862460154155521
Energy: 0.9365527634457439
Energy: 0.9165250688106844
Energy: 0.9075378756183275
Energy: 0.9556237130353217
Energy: 0.8855570519322731
Energy: 0.8850830600870373
Energy: 0.9558634544683579
Energy: 0.885852129750184
Energy: 0.9091849205760361
Energy: 0.8626234021553
Energy: 0.8831029506876547
Energy: 0.8921589734327403
Energy: 0.8693248905392543
Energy: 0.9469853992316156
Energy: 0.8894794095034793
Energy: 0.8571727826396005
Energy: 0.8749786596225617
Energy: 0.8692299105441258
Energy: 0.8594858485799827
Energy: 0.8714413849696365
Energy: 0.8279419025415332
Energy: 1.0284754536808922
Energy: 0.9515840015889397
Energy: 0.8658935286856354
Energy: 1.0274059945408527
Energy: 0.9456517230195767
Energy: 0.8663736810063558
Energy: 0.9049278425213189
Energy: 0.8629736534293563
Energy: 0.9535591395195978
Energy: 0.9064750965986144
Energy: 0.9575386847653071
Energy: 0.8693045529832293
Energy: 0.8993635659211575
Energy: 0.8668764729387075
Energy: 0.9460711112519343
Energy: 0.8996692871513347
Energy: 0.8710036558359249
Energy: 0.8755866974761032
Energy: 1.064584933814447
Energy: 0.9416759097658524
Energy: 0.8879264977541889
Energy: 1.0683303665654056
Energy: 0.9394524191083745
Energy: 0.8504957626665101
Energy: 0.9194573218171849
Energy: 0.9436644980288291
Energy: 0.9078308142842955
Energy: 0.9218230472679194
Energy: 0.9405320196016316
Energy: 0.8595515261858666
Energy: 0.8848259064501985
Energy: 0.9048290537969645
Energy: 0.9048965578048213
Energy: 0.8770125998572155
Energy: 0.9518190736027227
Energy: 0.9403049873444723
Energy: 1.0196046742704103
Energy: 0.9010816819609914
Energy: 0.9002792286547774
Energy: 1.0171084493174625
Energy: 0.9006979432772126
Energy: 0.9058549860696625
Energy: 1.0045205476872183
Energy: 0.9528408657911633
Energy: 0.8417458241146597
Energy: 1.0054705492837257
Energy: 0.9680137701553955
Energy: 0.9237693905553154
Energy: 1.2323096379969154
Energy: 0.9225441373345131
Energy: 0.9225635993373394
Energy: 1.233734510267541
Energy: 0.9214077339154054
Energy: 0.8902518236360843
Energy: 0.8521932886021384
Energy: 0.8874386044708553
Energy: 0.8543047347216739
Energy: 0.8527905805935883
Energy: 0.9299848802300871
Energy: 0.8500163087813531
Energy: 1.0194236880682332
Energy: 0.8631960859315067
Energy: 0.8651245082835248
Energy: 1.0196840445721838
Energy: 0.9092498243302498
Energy: 0.8701908437948328
Energy: 0.9235586096834244
Energy: 0.8580010011400843
Energy: 0.8565591290388452
Energy: 0.9243246290453387
Energy: 0.8962141292671598
Energy: 0.8644181812476939
Energy: 0.8746767597732065
Energy: 0.8856106010451413
Energy: 0.8875388731800672
Energy: 0.8747409183106766
Energy: 1.0189114490281574
Energy: 0.8856833688184879
Energy: 1.15557351692535
Energy: 0.9125422063855437
Energy: 0.9094112353390544
Energy: 1.1560589192408364
Energy: 0.9119480524968113
Energy: 0.8792853977772953
Energy: 0.9325938269041895
Energy: 0.8764588029570632
Energy: 0.8747177371909908
Energy: 0.9323586985810358
Energy: 0.8752415403074946
Energy: 0.8732926998794267
Energy: 0.9546283063520208
Energy: 0.8850756634039058
Energy: 0.9018438807608254
Energy: 0.9566071735915018
Energy: 0.884327682120466
Energy: 0.9075582264431769
Energy: 0.8854066757156605
Energy: 0.8834306026879576
Energy: 0.8943617323230423
Energy: 0.8862890567194328
Energy: 0.9301095375591983
Energy: 0.8902606467032451
Energy: 0.8946688289953235
Energy: 0.875906065833789
Energy: 0.8700949373993285
Energy: 0.8950850690967578
Energy: 0.8732351635155193
Energy: 0.8280815943093429
Energy: 1.0264388500164947
Energy: 0.9499315904178885
Energy: 0.8685249491095814
Energy: 1.0290270699581954
Energy: 0.9452793504505569
Energy: 0.8710410701089432
Energy: 0.8998149854700396
Energy: 0.9184237454716642
Energy: 0.9489882174284711
Energy: 0.9004987414524037
Energy: 0.9567597959472872
Energy: 0.8849461745509793
Energy: 0.8908681353733042
Energy: 0.8257499373170896
Energy: 0.8848800910630533
Energy: 0.8919428009695212
Energy: 0.8650974008490311
Energy: 0.8272484313158751
Energy: 1.0467751217189385
Energy: 0.89194983269128
Energy: 0.8939174527880507
Energy: 1.048114309884184
Energy: 0.9374192527497841
Energy: 0.8624159955777245
Energy: 0.9235308298932405
Energy: 0.9430966963504018
Energy: 0.9079759630216038
Energy: 0.9228684229809357
Energy: 0.9409916965364967
Energy: 0.9033733361528071
Energy: 0.8769563095786762
Energy: 0.9059973346858052
Energy: 0.972746285716104
Energy: 0.8768587368364639
Energy: 0.9507618847518458
Energy: 0.9713568120512548
Energy: 1.0101253501668985
Energy: 0.9011149406309239
Energy: 0.9055605372797826
Energy: 1.007166263404515
Energy: 1.06170725658352
Energy: 0.9049047872692895
Energy: 0.9298582517524895
Energy: 0.9521316865839659
Energy: 0.8392527264173921
Energy: 0.9499915833507472
Energy: 1.0087174275920452
Energy: 0.8803269702391978
Energy: 1.2316885140472686
Energy: 0.9186130583763306
Energy: 0.8284398097990805
Energy: 1.2331503326773214
Energy: 0.9206645533421918
Energy: 0.8897904337942594

minimum gb energy = 0.8169462103160681 eV
minimum distance =  2.37398012606623 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2410715227994793
Energy: 1.3512763564099781
Energy: 1.2187803463524596
Energy: 1.2434817886920846
Energy: 1.3514555525104837
Energy: 1.0653143242709981
Energy: 1.1370268961724725
Energy: 1.141012428807213
Energy: 1.084398626801057
Energy: 1.1372653221875382
Energy: 1.1398061758698192
Energy: 1.0816777497951784
Energy: 1.1285143311837256
Energy: 1.0359068681954722
Energy: 1.036566935225347
Energy: 1.1291983987910286
Energy: 1.154255491230479
Energy: 1.1539340352854504
Energy: 1.069898026833388
Energy: 1.0388435105681595
Energy: 1.0395617390518421
Energy: 1.0711073122708024
Energy: 1.1105772871691082
Energy: 1.096776205604369
Energy: 1.1470725583369614
Energy: 1.1530999915328786
Energy: 1.029800255521667
Energy: 1.1475890719692652
Energy: 1.1515177548218427
Energy: 1.0503593503686985
Energy: 1.1592504351626387
Energy: 1.1460139605788515
Energy: 1.0518298779909037
Energy: 1.1596907021380403
Energy: 1.1532535515399438
Energy: 1.0462628612021871
Energy: 1.0835190397357997
Energy: 1.0460143113233915
Energy: 1.0919149503387546
Energy: 1.0840552967218668
Energy: 1.0426941586902119
Energy: 1.0795068623935498
Energy: 1.0711897068209948
Energy: 1.0865561794189775
Energy: 1.0846740691373915
Energy: 1.0728010060952842
Energy: 1.1626733426602032
Energy: 1.068939911649978
Energy: 1.080329898507641
Energy: 1.0864505500241093
Energy: 1.1031476919568735
Energy: 1.082814961416036
Energy: 1.0839700890430763
Energy: 1.0791002334805546
Energy: 1.08040307648236
Energy: 1.0724741039204342
Energy: 1.0779701000371242
Energy: 1.0800749659819833
Energy: 1.0697633853073043
Energy: 1.1166294791933302
Energy: 1.0871629602282231
Energy: 1.1137555173528824
Energy: 1.0522179264700249
Energy: 1.086735544900404
Energy: 1.1069696260818478
Energy: 1.052300382144375
Energy: 1.0986715793648894
Energy: 1.0674433035583344
Energy: 1.1059574610812395
Energy: 1.0994617460259541
Energy: 1.241862417593418
Energy: 1.1007323960380675
Energy: 1.1384187326559185
Energy: 1.0863116271990945
Energy: 1.0806274155913993
Energy: 1.1393395105181825
Energy: 1.0838953287101185
Energy: 1.082499485597283
Energy: 1.239768235897982
Energy: 1.1710638587010398
Energy: 1.0033768935350678
Energy: 1.2423216753107367
Energy: 1.1683652010404222
Energy: 1.0026875784374458

minimum gb energy = 1.0026875784374458 eV
minimum distance =  2.38614635405534 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.6957393123205267
Energy: 1.4818064916395752
Energy: 1.3195083028184047
Energy: 1.6972263357367783
Energy: 1.39820517292059
Energy: 1.2656568907995494
Energy: 1.2011921653977922
Energy: 1.1496091696787136
Energy: 1.1539549470808776
Energy: 1.201262408894039
Energy: 1.1503349815100152
Energy: 1.211579353425234
Energy: 1.3216854441752406
Energy: 1.2798503868741546
Energy: 1.1966033251612425
Energy: 1.3226579974944035
Energy: 1.5481396838313917
Energy: 1.215080848811583
Energy: 1.2121582681144687
Energy: 1.2620407726863834
Energy: 1.225734577333824
Energy: 1.2133390831886317
Energy: 1.1274851976329634
Energy: 1.1612194523858566
Energy: 1.1514791296683557
Energy: 1.1497166451742613
Energy: 1.150719651282068
Energy: 1.141485874451394
Energy: 1.1545673202304332
Energy: 1.232178741234184
Energy: 1.2815593587352758
Energy: 1.1689071269466542
Energy: 1.1745049963868728
Energy: 1.2823773062896986
Energy: 1.171010622396954
Energy: 1.2694835103382007
Energy: 1.1791047837922835
Energy: 1.2802681072680024
Energy: 1.2735332270598414
Energy: 1.189758892275856
Energy: 1.2223484067468833
Energy: 1.1745891492361502
Energy: 1.151396415132345
Energy: 1.1412476409301113
Energy: 1.2240297255211494
Energy: 1.1520783285079585
Energy: 1.1490671777650496
Energy: 1.149481946196081
Energy: 1.3162013248576734
Energy: 1.2124995384749446
Energy: 1.1998010668272518
Energy: 1.3572732124037037
Energy: 1.2178752417762408
Energy: 1.2442482033501632
Energy: 1.2302012918249177
Energy: 1.2402344619429793
Energy: 1.2007755607827917
Energy: 1.2014150826214391
Energy: 1.2009637082996678
Energy: 1.243920121668684
Energy: 1.1586753060169213
Energy: 1.2358793653528328
Energy: 1.2118410551139511
Energy: 1.1498207518611148
Energy: 1.1358800735340375
Energy: 1.1529159785958656
Energy: 1.3669038891554053
Energy: 1.2589248574454919
Energy: 1.2399868681976574
Energy: 1.3668450086646997
Energy: 1.6024116035052847
Energy: 1.3018485215069766
Energy: 1.1440218646139027
Energy: 1.1498368018348972
Energy: 1.11925504170875
Energy: 1.1445049393487805
Energy: 1.1996996971739753
Energy: 1.2125387754741335
Energy: 1.402255225474781
Energy: 1.3188011277103917
Energy: 1.22383060424348
Energy: 1.4033772021624389
Energy: 1.3191191025057067
Energy: 1.2157885415244898
Energy: 1.1675918928562212
Energy: 1.1889119571894016
Energy: 1.204404458123685
Energy: 1.1676626537518597
Energy: 1.2126972499426496
Energy: 1.2133786095873678
Energy: 1.182857829312941
Energy: 1.149984983515097
Energy: 1.2226302388941168
Energy: 1.1698843936605563
Energy: 1.1603051520984724
Energy: 1.1715996490561247
Energy: 1.1635305696413174
Energy: 1.2602628535328253
Energy: 1.2737874952403156
Energy: 1.1639557008975099
Energy: 1.2490511028757365
Energy: 1.291533594224938
Energy: 1.3271067643060646
Energy: 1.2762209948217178
Energy: 1.235132619525058
Energy: 1.3285745334815169
Energy: 1.276449432002831
Energy: 1.161947921205515
Energy: 1.1236422519096396
Energy: 1.1309148823820698
Energy: 1.1295637746377487
Energy: 1.1116501051135503
Energy: 1.1420041217159393
Energy: 1.1936055442993396
Energy: 1.1846646392257247
Energy: 1.2179148230672097
Energy: 1.236988551993969
Energy: 1.1849459639218398
Energy: 1.3029554913752268
Energy: 1.1756889074480128
Energy: 1.1412001725695928
Energy: 1.1371124646838082
Energy: 1.14460415050864
Energy: 1.1420568044572792
Energy: 1.1280328931482495
Energy: 1.138933071140091
Energy: 1.1151965222547198
Energy: 1.1393250326684745
Energy: 1.1409855742227224
Energy: 1.1537675572053532
Energy: 1.1414090263247956
Energy: 1.1457365775767583
Energy: 1.5723793817857181
Energy: 1.1710069520147388
Energy: 1.2301333219328565
Energy: 1.5745705447386003
Energy: 1.2642594474093343
Energy: 1.2356765213195287
Energy: 1.1410363233765013
Energy: 1.1205186342425215
Energy: 1.169775363784186
Energy: 1.1383035497397151
Energy: 1.1217851444082805
Energy: 1.1294108987341291
Energy: 1.248401370111592
Energy: 1.3657942805896206
Energy: 1.172864683056177
Energy: 1.2492764484133858
Energy: 1.2722647141426715
Energy: 1.180233612527457
Energy: 1.228257203918881
Energy: 1.1646303835510448
Energy: 1.291018957273425
Energy: 1.2126801454015117
Energy: 1.1577267973391168
Energy: 1.2892236714006093
Energy: 1.1509340692859942
Energy: 1.1647511682376877
Energy: 1.1667968463604206
Energy: 1.1505341956881918
Energy: 1.164396047787947
Energy: 1.216145616507147
Energy: 1.2021954832182662
Energy: 1.1683207823226611
Energy: 1.2079957598510498
Energy: 1.1945662911875743
Energy: 1.1677393835354273
Energy: 1.2076059651913587
Energy: 1.318813653946662
Energy: 1.3599458846606378
Energy: 1.2180003486124156
Energy: 1.3188995316892158
Energy: 1.321122861760556
Energy: 1.203697972668209
Energy: 1.2016992726077462
Energy: 1.1429211497794607
Energy: 1.1530053188152023
Energy: 1.2011374044471559
Energy: 1.142949282429294
Energy: 1.1170714001352735
Energy: 1.6712364993030697
Energy: 1.2740779970149299
Energy: 1.1791524842887742
Energy: 1.6719103016130052
Energy: 1.2747199142694035
Energy: 1.218410160866045

minimum gb energy = 1.1116501051135503 eV
minimum distance =  2.32310877121243 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.6850399202775812
Energy: 1.2202390214199093
Energy: 1.238139365074113
Energy: 1.575128168938632
Energy: 1.2232882831171064
Energy: 1.2322111904899706
Energy: 1.2614894430571797
Energy: 1.217768326032769
Energy: 1.2156775733696912
Energy: 1.2451921212459012
Energy: 1.2301212016609722
Energy: 1.124560931554173
Energy: 1.2893952775512456
Energy: 1.1506865463162197
Energy: 1.1495027299219784
Energy: 1.2897905404174188
Energy: 1.3150493269102757
Energy: 1.19261182417446
Energy: 1.2327760583863756
Energy: 1.1236090049529472
Energy: 1.1664856431356718
Energy: 1.232646513855651
Energy: 1.2836431314304242
Energy: 1.1227498069694315
Energy: 1.2262719013133894
Energy: 1.2476217513869214
Energy: 1.1963755023161835
Energy: 1.2292843271627616
Energy: 1.291114139596403
Energy: 1.2146890423428895
Energy: 1.3751777187652872
Energy: 1.2058241571217454
Energy: 1.204102097868545
Energy: 1.3761930275915362
Energy: 1.2030782273557799
Energy: 1.1653295655935434
Energy: 1.2384632838952434
Energy: 1.11926125938151
Energy: 1.21823888235004
Energy: 1.238818280838614
Energy: 1.1467845923931506
Energy: 1.2028705580727013
Energy: 1.2280879259631932
Energy: 1.1668632537071038
Energy: 1.1023293783277555
Energy: 1.2283519031230192
Energy: 1.2640324398594889
Energy: 1.122055416509818
Energy: 1.2934042656067557
Energy: 1.1982148147207903
Energy: 1.2065718525990867
Energy: 1.3870302688754719
Energy: 1.1956383970555258
Energy: 1.2065305576270167
Energy: 1.294574994979369
Energy: 1.295408464379698
Energy: 1.2063579162580729
Energy: 1.2938557922287826
Energy: 1.290839980640713
Energy: 1.2091056664169664
Energy: 1.335411385427945
Energy: 1.159446716034874
Energy: 1.3525682128672116
Energy: 1.3359347914048807
Energy: 1.313988416614001
Energy: 1.122568652631352
Energy: 1.198771500328992
Energy: 1.3564809023393813
Energy: 1.2866242960636898
Energy: 1.4230940521355568
Energy: 1.3530487573666348
Energy: 1.1931928013535256
Energy: 1.16014114843189
Energy: 1.2152993485117896
Energy: 1.1249093313461689
Energy: 1.16036845920449
Energy: 1.2325873490095989
Energy: 1.1235088196488374
Energy: 1.376619348054441
Energy: 1.2921710377930593
Energy: 1.2868445920392522
Energy: 1.3776549839860164
Energy: 1.2973721282343464
Energy: 1.1963457791130345
Energy: 1.2389946675995918
Energy: 1.133081957876067
Energy: 1.1798265783404602
Energy: 1.2391761404852455
Energy: 1.1310625130290324
Energy: 1.1562194215365413
Energy: 1.2881385808755517
Energy: 1.133358299877409
Energy: 1.128286649992043
Energy: 1.2883884647615809
Energy: 1.1307406208990252
Energy: 1.2046058444678769
Energy: 1.1485079537121616
Energy: 1.1814701680272328
Energy: 1.1809633854999602
Energy: 1.1488285037162829
Energy: 1.1779979142498054
Energy: 1.266655077264736

minimum gb energy = 1.1023293783277555 eV
minimum distance =  2.3396712181724 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.4913280216306086
Energy: 1.3621767000446687
Energy: 1.4411198497361235
Energy: 1.3530667009346282
Energy: 1.3790867450289703
Energy: 1.581134839346622
Energy: 1.4588715238502028
Energy: 1.239297727290285
Energy: 1.2126775638027578
Energy: 1.463246940426456
Energy: 1.2076498659641652
Energy: 1.3661408538236868
Energy: 1.3507486996317901
Energy: 1.2046918715532133
Energy: 1.3902795970479032
Energy: 1.3722812994219133
Energy: 1.340405972327204
Energy: 1.2780782221313076
Energy: 1.2746431480089073
Energy: 1.2338846599938884
Energy: 1.376574168078893
Energy: 1.2762445597741625
Energy: 1.2381094202085074
Energy: 1.3628720611356353
Energy: 1.2298460151423787
Energy: 1.2080135966737686
Energy: 1.1906825804044077
Energy: 1.2307723094510867
Energy: 1.1895874768397738
Energy: 1.3380912879895208
Energy: 1.2409234617498948
Energy: 1.2640358162054146
Energy: 1.3278455344795554
Energy: 1.2382900981965523
Energy: 1.2965456363287728
Energy: 1.3218912526432354
Energy: 1.1654447884036874
Energy: 1.2829226700372012
Energy: 1.304820326092115
Energy: 1.168719536999641
Energy: 1.4360709012925161
Energy: 1.419763348968426
Energy: 1.3123984187538968
Energy: 1.3241341595415157
Energy: 1.3186725148561125
Energy: 1.3128808081679768
Energy: 1.2113189493288556
Energy: 1.2733050216669053
Energy: 1.4138415779935487
Energy: 1.2584291765521105
Energy: 1.1788476559949617
Energy: 1.415921882114199
Energy: 1.2574878612534033
Energy: 1.3439402466455117
Energy: 1.3331151180103742
Energy: 1.15249338506173
Energy: 1.155138869598264
Energy: 1.3354852042710206
Energy: 1.1470884472420375
Energy: 1.2161331598813987
Energy: 1.2452068129435008
Energy: 1.3288933431141021
Energy: 1.337164366938406
Energy: 1.2455981644014065
Energy: 1.250060309597703
Energy: 1.3082246218605185
Energy: 1.263736912588844
Energy: 1.2556312978384176
Energy: 1.3288294288955036
Energy: 1.2638295217880908
Energy: 1.279822012108832
Energy: 1.3235023430846233
Energy: 1.4440662507940356
Energy: 1.2026083120865854
Energy: 1.2640141803003617
Energy: 1.4457702998184572
Energy: 1.1988048480836175
Energy: 1.390032020341509
Energy: 1.3735841632394965
Energy: 1.2718169046309358
Energy: 1.3501230373186408
Energy: 1.3751061348574585
Energy: 1.3206674389396154
Energy: 1.3984276587128246
Energy: 1.2699688226178751
Energy: 1.3131810322323678
Energy: 1.2102677173526055
Energy: 1.2711184149607375
Energy: 1.295862873200637
Energy: 1.1831789040757403
Energy: 1.2253715767025806
Energy: 1.2523689667991111
Energy: 1.2666419239966813
Energy: 1.2285772608430015
Energy: 1.2673114730039716
Energy: 1.2541861843290945
Energy: 1.29016485491256
Energy: 1.3516392346620554
Energy: 1.331760930484716
Energy: 1.2847966094841476
Energy: 1.3652074528036218
Energy: 1.3449377471482895
Energy: 1.3644361864563868
Energy: 1.2523932900745827
Energy: 1.2343665741212382
Energy: 1.3656435640660083
Energy: 1.2310260816639857
Energy: 1.3675625551496675
Energy: 1.2769111539058093
Energy: 1.287746396120542
Energy: 1.3641439917583131
Energy: 1.2762483995620972
Energy: 1.2686076143202463
Energy: 1.408014749446409
Energy: 1.2893045227906863
Energy: 1.2520876341876397
Energy: 1.2674408802636885
Energy: 1.2972398537992305
Energy: 1.35309412530875
Energy: 1.3540334912583882
Energy: 1.3416517966017456
Energy: 1.1863656342990947
Energy: 1.1895484809496435
Energy: 1.3416767117469055
Energy: 1.1823997477609292
Energy: 1.1679007123299623

minimum gb energy = 1.1470884472420375 eV
minimum distance =  2.38436971235102 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.5178685961677572
Energy: 1.2534030467927553
Energy: 1.330689595322969
Energy: 1.266127561873858
Energy: 1.209536612831378
Energy: 1.4537275557945153
Energy: 1.299734415972439
Energy: 1.2941631654441499
Energy: 1.2939043493407307
Energy: 1.3180275464245474
Energy: 1.1490871881646114
Energy: 1.2648688921541118
Energy: 1.3014786145910524
Energy: 1.3412677978507448
Energy: 1.2578027822151425
Energy: 1.3010071969174835
Energy: 1.2102666464469645
Energy: 1.2967320398363742
Energy: 1.2633245253042806
Energy: 1.2446686716016548
Energy: 1.31979898792192
Energy: 1.2621857311267282
Energy: 1.2996233016883956
Energy: 1.3018067853460793
Energy: 1.2122684652057538
Energy: 1.2039977600260252
Energy: 1.2418936611570226
Energy: 1.2140441128174895
Energy: 1.202234915816924
Energy: 1.2488495164546807
Energy: 1.2524878479024626
Energy: 1.26993932738436
Energy: 1.3092697061273628
Energy: 1.2535725395467052
Energy: 1.2668086521207647
Energy: 1.3072096860301479
Energy: 1.1881918629560566
Energy: 1.1778853039770005
Energy: 1.2707124636370182
Energy: 1.1886593691854395
Energy: 1.182830022220606
Energy: 1.2683336921586816
Energy: 1.2119065909215276
Energy: 1.1844774149401978
Energy: 1.2708227662875498
Energy: 1.211963806436829
Energy: 1.1813879672229994
Energy: 1.3076561724180038
Energy: 1.466694757484298
Energy: 1.2002466715504911
Energy: 1.2245210615336812
Energy: 1.4828934589967604
Energy: 1.2408147208130715
Energy: 1.2677357947391446
Energy: 1.5048749203001424
Energy: 1.2340799449047641
Energy: 1.2323430723381374
Energy: 1.5052759925376487
Energy: 1.277501992140943
Energy: 1.2317575954434345
Energy: 1.3105349007916114
Energy: 1.2949515573390966
Energy: 1.2768299739767506
Energy: 1.310850208338065
Energy: 1.2241749120896088
Energy: 1.3557953104964682
Energy: 1.2261006383751232
Energy: 1.2588467316208445
Energy: 1.3271578414771763
Energy: 1.2268200067912642
Energy: 1.2761667480246104
Energy: 1.3266608679488663
Energy: 1.1751037442427927
Energy: 1.2233182950800374
Energy: 1.2711037337145745
Energy: 1.177038987680491
Energy: 1.2199091191772935
Energy: 1.2660020233191265
Energy: 1.1761383186432302
Energy: 1.2535899197274034
Energy: 1.3147120213204628
Energy: 1.177289771050943
Energy: 1.2565417891553965
Energy: 1.2708483157554429
Energy: 1.2448442177539245
Energy: 1.3516646824562901
Energy: 1.315698657627691
Energy: 1.2439347704318815
Energy: 1.3083881943596023
Energy: 1.249396276413214
Energy: 1.2717413558964856
Energy: 1.2868335527051917
Energy: 1.2506526394535886
Energy: 1.2722603576875604
Energy: 1.3099180322631294
Energy: 1.24193691463804
Energy: 1.2254775163349718
Energy: 1.309845182573519
Energy: 1.266781726491918
Energy: 1.2267537341300692
Energy: 1.2728306326156933
Energy: 1.2701923470156655
Energy: 1.2701010941544888
Energy: 1.2430538893813181
Energy: 1.2635762587320825
Energy: 1.2709513944586144
Energy: 1.260432712745906
Energy: 1.3030570076319734
Energy: 1.1872519295672492
Energy: 1.1788902282438098
Energy: 1.247467940115673
Energy: 1.1879293295876752
Energy: 1.1755542179328318
Energy: 1.2779424581931302
Energy: 1.1968262719970015
Energy: 1.1798662463189207
Energy: 1.2239494451257937
Energy: 1.1918815188245602
Energy: 1.1762066835149263
Energy: 1.2796183681362845
Energy: 1.443013597457635
Energy: 1.2256268122712752
Energy: 1.2389991070371982
Energy: 1.4434285294480376
Energy: 1.2230730150606102
Energy: 1.2482219519030429
Energy: 1.2144037424636653
Energy: 1.2571137615923733
Energy: 1.2605170221210042
Energy: 1.2159068735759189
Energy: 1.273978098026134
Energy: 1.2306650999526658
Energy: 1.2858791843537767
Energy: 1.2362296264893013
Energy: 1.2762484540913295
Energy: 1.2851546864956074
Energy: 1.212132890770791
Energy: 1.3032744493688264
Energy: 1.2444563897764915
Energy: 1.2869891581617536
Energy: 1.3470103315898565
Energy: 1.2447249466500552
Energy: 1.275811765089195
Energy: 1.327469954769227
Energy: 1.2490431952730294
Energy: 1.2774016574382736
Energy: 1.3243720964412242
Energy: 1.2500344406574446
Energy: 1.2775240297095005
Energy: 1.2997938741678832

minimum gb energy = 1.1490871881646114 eV
minimum distance =  2.35547500992589 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.830129649296794
Energy: 1.3001254609122253
Energy: 1.3357203311324433
Energy: 1.2804587278782003
Energy: 1.3012333632668138
Energy: 1.3461808782366278
Energy: 1.2613779108459457
Energy: 1.169320150130658
Energy: 1.1731536929439839
Energy: 1.281768979080669
Energy: 1.1755088013190096
Energy: 1.280070768479338
Energy: 1.1075844793579104
Energy: 1.2205940471380352
Energy: 1.2988910401951854
Energy: 1.127316642022802
Energy: 1.2202135240827578
Energy: 1.2761309947207142
Energy: 1.1652509877557238
Energy: 1.1782168619795699
Energy: 1.2648477028729896
Energy: 1.1671187755896923
Energy: 1.1686262222046893
Energy: 1.2572365992321861
Energy: 1.2310528675039354
Energy: 1.1048940056861325
Energy: 1.087701166528594
Energy: 1.231274966549001
Energy: 1.105443498110466
Energy: 1.3012764784045758
Energy: 1.2253221905496807
Energy: 1.2761025425384351
Energy: 1.2716430470081244
Energy: 1.2212182060487806
Energy: 1.1857371899477465
Energy: 1.276781866664685
Energy: 1.2831839026093603
Energy: 1.2842704361045687
Energy: 1.2366608410036022
Energy: 1.2448173867139851
Energy: 1.298018411516291
Energy: 1.2346587437079743
Energy: 1.226169249764968
Energy: 1.2406239791854512
Energy: 1.3006206788953774
Energy: 1.2264139517417305
Energy: 1.18471730271279
Energy: 1.1673225999725572
Energy: 1.2153740975348624
Energy: 1.105467427369541
Energy: 1.270270387274249
Energy: 1.2163913621597195
Energy: 1.1069167628513958
Energy: 1.3148472288393787
Energy: 1.2117225564849197
Energy: 1.2080961114786857
Energy: 1.223602573817089
Energy: 1.2123694267345642
Energy: 1.2073179677075516
Energy: 1.240756309471253
Energy: 1.1091841384769536
Energy: 1.246344690396981
Energy: 1.2634969059551957
Energy: 1.1099402022744627
Energy: 1.1993326170699192
Energy: 1.206451793749411
Energy: 1.101017697007821
Energy: 1.2126315214427017
Energy: 1.262981825712083
Energy: 1.1007040804796615
Energy: 1.2167460923061175
Energy: 1.2509210829930033
Energy: 1.210725478112246
Energy: 1.2088204714196438
Energy: 1.1735408466537889
Energy: 1.1961391588698596
Energy: 1.2062188385543158
Energy: 1.2647734091587157
Energy: 1.293051466404528
Energy: 1.2092052277124656
Energy: 1.212305127527572
Energy: 1.3105664791792
Energy: 1.2100898950415508
Energy: 1.2116705321602466
Energy: 1.083504002747923
Energy: 1.192777849136423
Energy: 1.237078033726289
Energy: 1.1063748935149784
Energy: 1.191993934065912
Energy: 1.3102228357161092
Energy: 1.1559509283311225
Energy: 1.208940444672814
Energy: 1.247596069460659
Energy: 1.1561755993596807
Energy: 1.1998743708240218
Energy: 1.2355976690930108
Energy: 1.1870303466055405
Energy: 1.1806552026885038
Energy: 1.1638038235696142
Energy: 1.187657894448315
Energy: 1.1807396134024708
Energy: 1.252828395431686
Energy: 1.2713605775099144
Energy: 1.1265274525005327
Energy: 1.2218130982500095
Energy: 1.2729828094103826
Energy: 1.12423952130148
Energy: 1.2307307298859158
Energy: 1.1656219209843213
Energy: 1.2208141686073983
Energy: 1.253602374351682
Energy: 1.1660093120961375
Energy: 1.218991626622025
Energy: 1.1948020671092787
Energy: 1.1833616815685337
Energy: 1.2624503655666657
Energy: 1.2653004231133262
Energy: 1.1790065863035213
Energy: 1.2476935071584008
Energy: 1.195814912869548
Energy: 1.2354131099129317
Energy: 1.0846354910309568
Energy: 1.2347263534639823
Energy: 1.235967775311136
Energy: 1.084275847406104
Energy: 1.2995329924101717
Energy: 1.2111459823101942
Energy: 1.1137750475509753
Energy: 1.254160490076208
Energy: 1.2093928094279538
Energy: 1.1000167250937827
Energy: 1.2850084756406257
Energy: 1.2022207398801268
Energy: 1.236873268063915
Energy: 1.2709289430820694
Energy: 1.1903616993008581
Energy: 1.2592017059459908
Energy: 1.1962665152859464
Energy: 1.2326871824886518
Energy: 1.2782236919647731
Energy: 1.273684753270783
Energy: 1.2298987268076906
Energy: 1.2669446154062518
Energy: 1.176437849495964
Energy: 1.2296425661750487
Energy: 1.1379614706625985
Energy: 1.2674035830983181
Energy: 1.2313302064504683
Energy: 1.1269072048335242
Energy: 1.282330182004943
Energy: 1.2092453915370198
Energy: 1.1605282385259719
Energy: 1.1186186472472428
Energy: 1.2106303942013452
Energy: 1.1616531945780086
Energy: 1.2503153382340062
Energy: 1.1032265796978225
Energy: 1.2403864343074529
Energy: 1.284342718939807
Energy: 1.103830333661884
Energy: 1.2259918026072705
Energy: 1.233857854973275
Energy: 1.1234267849051736
Energy: 1.237304674679394
Energy: 1.2695836591331722
Energy: 1.1236900212257914
Energy: 1.2253702762480778
Energy: 1.295845117260454
Energy: 1.2511227250460002
Energy: 1.2246620046804857
Energy: 1.2187248769391033
Energy: 1.2523806779507936
Energy: 1.2263378546398451
Energy: 1.2684031359783212

minimum gb energy = 1.083504002747923 eV
minimum distance =  2.34479784036553 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.1652520417163266
Energy: 1.1983256506008024
Energy: 1.1264091740839528
Energy: 1.165949217287565
Energy: 1.1914195989827943
Energy: 1.8089141742070884
Energy: 1.3599561452067885
Energy: 1.0762305638754517
Energy: 1.1179609627712297
Energy: 1.3559778909545757
Energy: 1.1345427345403172
Energy: 1.1875093164876622
Energy: 1.085492469685463
Energy: 1.1810645023363144
Energy: 1.1785067994674596
Energy: 1.086169743878655
Energy: 1.1819124632879905
Energy: 1.192632248120009
Energy: 1.1078275704705345
Energy: 1.1342590772649592
Energy: 1.1863979529675222
Energy: 1.1080455114903949
Energy: 1.1348443981141378
Energy: 1.1861587981942276
Energy: 1.1996954061698502
Energy: 1.0769452492598597
Energy: 1.0450306577422526
Energy: 1.2001772782490425
Energy: 1.0941308470001918
Energy: 1.2930676746396654
Energy: 1.1325383365131596
Energy: 1.2001788734370016
Energy: 1.2099649522047917
Energy: 1.1331942374694832
Energy: 1.1635386939255306
Energy: 1.2089004982104112
Energy: 1.2003163342601466
Energy: 1.1365320698902928
Energy: 1.0900125895481245
Energy: 1.1977893651743168
Energy: 1.168695016666386
Energy: 1.0910588535778565
Energy: 1.1142994386528924
Energy: 1.2886902756587342
Energy: 1.1921910419101402
Energy: 1.1145935288857742
Energy: 1.1883150732834105
Energy: 1.1444157656050604
Energy: 1.1742514636797532
Energy: 1.0716905017323028
Energy: 1.2083096971000105
Energy: 1.1750573454190243
Energy: 1.0841370208254093
Energy: 1.2304488437337713
Energy: 1.16712415389239
Energy: 1.082995842439249
Energy: 1.1735265891854643
Energy: 1.16825064105892
Energy: 1.1389708318618872
Energy: 1.176730137851659
Energy: 1.3502777884858297
Energy: 1.1507919501128798
Energy: 1.0589588386893523
Energy: 1.0558082164753482
Energy: 1.151690313476612
Energy: 1.1124469312745413
Energy: 1.1445280272258902
Energy: 1.199658233095507
Energy: 1.187367311323182
Energy: 1.1448891485159345
Energy: 1.2117438195596046
Energy: 1.175215040491745
Energy: 1.166346497260365
Energy: 1.0763222850854657
Energy: 1.0722965825070965
Energy: 1.1667950652328543
Energy: 1.075134412770635
Energy: 1.098429364051546
Energy: 1.1652342793032429
Energy: 1.1351672735174243
Energy: 1.1243888973950042
Energy: 1.1663409396575628
Energy: 1.1323095635252542
Energy: 1.1748213356969885
Energy: 1.0852975637824611
Energy: 1.1853348059404367
Energy: 1.2358721111892994
Energy: 1.0835953077590348
Energy: 1.182434288018757
Energy: 1.248277549081069
Energy: 1.1604780859903376
Energy: 1.1473475667147779
Energy: 1.1923900225820976
Energy: 1.1605246059813719
Energy: 1.1452605657285788
Energy: 1.1866059770267796
Energy: 1.1328329866506601
Energy: 1.1791552549558528
Energy: 1.128890281872639
Energy: 1.1341033981501412
Energy: 1.177185843239808
Energy: 1.0643639991473723
Energy: 1.2348647843027292
Energy: 1.1293428680282076
Energy: 1.0951098740965746
Energy: 1.2356723176861837
Energy: 1.1257896549120199
Energy: 1.1541107981829166
Energy: 1.08313868435134
Energy: 1.1820209345456805
Energy: 1.2154668965857787
Energy: 1.0835124124905848
Energy: 1.1812896500537307
Energy: 1.1772967691871623
Energy: 1.1242693026825474
Energy: 1.2190961603065475
Energy: 1.1921666816266603
Energy: 1.124156328095672
Energy: 1.1815867385149212
Energy: 1.116292818484844
Energy: 1.1966272954006485
Energy: 1.1320037219858332
Energy: 1.0779585895467523
Energy: 1.1986550078985514
Energy: 1.1272267886049094
Energy: 1.2964572391302949
Energy: 1.190304516204317
Energy: 1.037689418676459
Energy: 1.2080847278858438
Energy: 1.190566275063529
Energy: 1.0840826192543367
Energy: 1.2078459361398577
Energy: 1.2536025121854837
Energy: 1.1566210528692102
Energy: 1.1772042641397609
Energy: 1.2522565492331006
Energy: 1.1083887009552977
Energy: 1.113620297590236
Energy: 1.13173214824104
Energy: 1.205647813289379
Energy: 1.1684853215733204
Energy: 1.1315654577570193
Energy: 1.2077996851143622
Energy: 1.1843740703743177
Energy: 1.1838637689244285
Energy: 1.0725757504228048
Energy: 1.1934418063068517
Energy: 1.1841075934577003
Energy: 1.084043999126186
Energy: 1.2576044732067666
Energy: 1.1847206267943697
Energy: 1.0834736876748563
Energy: 1.1422094611128835
Energy: 1.1858427468446004
Energy: 1.0832219028444894
Energy: 1.1920233742605224
Energy: 1.0774905805532025
Energy: 1.185479599899442
Energy: 1.061928246079376
Energy: 1.078192840760404
Energy: 1.1523780174526355
Energy: 1.0632948068251473
Energy: 1.1064726014747457
Energy: 1.2238241382316597
Energy: 1.1908593286540876
Energy: 1.1077539872661333
Energy: 1.1890446703011057
Energy: 1.1867148271365089
Energy: 1.1656558915608737
Energy: 1.1016872341347026
Energy: 1.1148035952240725
Energy: 1.1667286511271107
Energy: 1.0758434250122408
Energy: 1.1543569042187811
Energy: 1.1634973904981758
Energy: 1.1371943332608776
Energy: 1.1300459104162768
Energy: 1.1635644963635319
Energy: 1.1339944994879807
Energy: 1.1718087332123786
Energy: 1.0880334067999669
Energy: 1.188383031904338
Energy: 1.183548234512564
Energy: 1.0835073046577455
Energy: 1.1853686793149476
Energy: 1.207363850916193
Energy: 1.083653587338808
Energy: 1.1964833149626892
Energy: 1.1982337551229778
Energy: 1.0934127651441623
Energy: 1.1872203950058973
Energy: 1.2327977065444151
Energy: 1.1339000026524324
Energy: 1.2302614780724983
Energy: 1.1458644720728008
Energy: 1.1353936216955491
Energy: 1.2245213672269757
Energy: 1.1431041274635168

minimum gb energy = 1.037689418676459 eV
minimum distance =  2.33248488342629 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.019773565041433832
Energy: 1.366152707945778
Energy: 0.020574558303054383
Energy: 0.021493690307695393
Energy: 1.3680478798105749
Energy: 0.02745140692060471
Energy: 0.42365057795077404
Energy: 0.1045076562656611
Energy: 0.10459685975984764
Energy: 0.1040545322495071
Energy: 0.10449425480958836
Energy: 0.10377986339139075
Energy: 1.7217351996412897
Energy: 1.3676153303066956
Energy: 1.3653735697061933
Energy: 1.72222357833326
Energy: 1.3648612616838434
Energy: 1.3639023398987435
Energy: 0.4236505779530073
Energy: 0.10450765626388464
Energy: 0.10459685976030447
Energy: 0.10405453224773065
Energy: 0.10449425480867475
Energy: 0.10377986339448685

minimum gb energy = 0.019773565041433832 eV
minimum distance =  2.48505221265236 Angstroms
sigma value = 1